*HEADER    TOXIN                                   09-SEP-15   2N7F              
*TITLE     NMR SOLUTION STRUCTURE OF MUO-CONOTOXIN MFVIA                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ENTITY;                                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    MUO-CONOTOXIN, DIULFIDE-RICH, TOXIN                                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.I.SCHROEDER, M.MOBLI                                                
*REVDAT   1   06-APR-16 2N7F    0                                                


!Distance restraints
assign (resid   32 and name HN   ) (resid   32 and name HG2# )    4.09    4.09    0.00
assign (resid   21 and name HN   ) (resid   21 and name HB2  )    3.50    3.50    0.00
assign (resid   21 and name HN   ) (resid   21 and name HB1  )    3.77    3.77    0.00
assign (resid    4 and name HN   ) (resid    4 and name HB1  )    3.78    3.78    0.00
assign (resid    4 and name HN   ) (resid    4 and name HG2  )    3.90    3.90    0.00
assign (resid   26 and name HN   ) (resid   26 and name HB2  )    3.33    3.33    0.00
assign (resid    2 and name HN   ) (resid    2 and name HB1  )    3.96    3.96    0.00
assign (resid   22 and name HA   ) (resid   23 and name HN   )    2.59    2.59    0.00
assign (resid   31 and name HN   ) (resid   31 and name HB2  )    3.44    3.44    0.00
assign (resid   27 and name HN   ) (resid   28 and name HD#  )    3.38    3.38    0.00
assign (resid   11 and name HN   ) (resid   11 and name HG2# )    4.07    4.07    0.00
assign (resid   11 and name HN   ) (resid   11 and name HD1# )    4.53    4.53    0.00
assign (resid   25 and name HN   ) (resid   25 and name HG2# )    3.50    3.50    0.00
assign (resid   25 and name HN   ) (resid   25 and name HB   )    3.97    3.97    0.00
assign (resid   25 and name HN   ) (resid   25 and name HG11 )    3.83    3.83    0.00
assign (resid    5 and name HN   ) (resid    5 and name HG1  )    3.40    3.40    0.00
assign (resid    5 and name HN   ) (resid    5 and name HG2  )    3.66    3.66    0.00
assign (resid    5 and name HN   ) (resid    5 and name HB2  )    3.07    3.07    0.00
assign (resid    5 and name HN   ) (resid    5 and name HB1  )    3.56    3.56    0.00
assign (resid   30 and name HN   ) (resid   30 and name HG1# )    3.85    3.85    0.00
assign (resid   30 and name HN   ) (resid   30 and name HG2# )    3.16    3.16    0.00
assign (resid    1 and name QG   ) (resid    1 and name HE   )    3.52    3.52    0.00
assign (resid    1 and name HB#  ) (resid    1 and name HE   )    3.78    3.78    0.00
assign (resid    6 and name HN   ) (resid    6 and name HG1  )    4.25    4.25    0.00
assign (resid    6 and name HN   ) (resid    6 and name HG2  )    4.25    4.25    0.00
assign (resid    3 and name HN   ) (resid    3 and name HB1  )    4.14    4.14    0.00
assign (resid    3 and name HN   ) (resid    3 and name HB2  )    4.14    4.14    0.00
assign (resid   18 and name HN   ) (resid   18 and name HG2# )    5.12    5.12    0.00
assign (resid   18 and name HN   ) (resid   18 and name HG1# )    5.12    5.12    0.00
assign (resid    9 and name HN   ) (resid    9 and name HB2  )    3.86    3.86    0.00
assign (resid    9 and name HN   ) (resid    9 and name HB1  )    3.86    3.86    0.00
assign (resid    8 and name HN   ) (resid    8 and name HB#  )    3.47    3.47    0.00
assign (resid   31 and name HA   ) (resid   32 and name HN   )    3.09    3.09    0.00
assign (resid   31 and name HB1  ) (resid   32 and name HN   )    3.87    3.87    0.00
assign (resid   30 and name HA   ) (resid   31 and name HN   )    3.15    3.15    0.00
assign (resid   30 and name HB   ) (resid   31 and name HN   )    3.52    3.52    0.00
assign (resid   30 and name HG2# ) (resid   31 and name HN   )    3.97    3.97    0.00
assign (resid   30 and name HG1# ) (resid   31 and name HN   )    3.80    3.80    0.00
assign (resid   29 and name HA   ) (resid   29 and name HD#  )    3.90    3.90    0.00
assign (resid   29 and name HA   ) (resid   29 and name HE#  )    4.84    4.84    0.00
assign (resid   29 and name HB2  ) (resid   30 and name HN   )    4.53    4.53    0.00
assign (resid   29 and name HB1  ) (resid   30 and name HN   )    4.53    4.53    0.00
assign (resid    7 and name HA   ) (resid    7 and name HD1  )    4.70    4.70    0.00
assign (resid    7 and name HB1  ) (resid    7 and name HD1  )    3.80    3.80    0.00
assign (resid    7 and name HB2  ) (resid    7 and name HD1  )    3.41    3.41    0.00
assign (resid    8 and name HN   ) (resid    8 and name HG2  )    3.24    3.24    0.00
assign (resid    8 and name HG1  ) (resid    9 and name HN   )    4.34    4.34    0.00
assign (resid    8 and name HB#  ) (resid    9 and name HN   )    3.83    3.83    0.00
assign (resid    8 and name HA   ) (resid    8 and name HG2  )    3.51    3.51    0.00
assign (resid    8 and name HA   ) (resid    8 and name HG1  )    3.87    3.87    0.00
assign (resid    7 and name HB1  ) (resid    8 and name HN   )    4.50    4.50    0.00
assign (resid   32 and name HA   ) (resid   32 and name HG2# )    3.15    3.15    0.00
assign (resid   30 and name HA   ) (resid   30 and name HG2# )    3.82    3.82    0.00
assign (resid   30 and name HA   ) (resid   30 and name HG1# )    3.54    3.54    0.00
assign (resid    9 and name HN   ) (resid    9 and name HD#  )    4.16    4.16    0.00
assign (resid    9 and name HA   ) (resid    9 and name HD#  )    3.42    3.42    0.00
assign (resid    9 and name HA   ) (resid    9 and name HE#  )    4.61    4.61    0.00
assign (resid   25 and name HN   ) (resid   31 and name HB1  )    4.74    4.74    0.00
assign (resid    6 and name HA   ) (resid    6 and name HD#  )    4.40    4.40    0.00
assign (resid    6 and name HA   ) (resid    6 and name HG2  )    4.00    4.00    0.00
assign (resid    6 and name HA   ) (resid    6 and name HG1  )    4.13    4.13    0.00
assign (resid    6 and name HG1  ) (resid    7 and name HA   )    5.01    5.01    0.00
assign (resid    6 and name HG1  ) (resid   32 and name HA   )    4.35    4.35    0.00
assign (resid    6 and name HN   ) (resid    6 and name HB#  )    2.75    2.75    0.00
assign (resid    6 and name HN   ) (resid    6 and name HD#  )    3.54    3.54    0.00
assign (resid    6 and name HB#  ) (resid   31 and name HB1  )    4.11    4.11    0.00
assign (resid    6 and name HD#  ) (resid    7 and name HD1  )    3.84    3.84    0.00
assign (resid    6 and name HG2  ) (resid    7 and name HD1  )    4.21    4.21    0.00
assign (resid    6 and name HG1  ) (resid    7 and name HD1  )    3.88    3.88    0.00
assign (resid    6 and name HG1  ) (resid    7 and name HE3  )    5.09    5.09    0.00
assign (resid    6 and name HG1  ) (resid    7 and name HZ2  )    5.41    5.41    0.00
assign (resid    6 and name HG1  ) (resid    8 and name HN   )    5.18    5.18    0.00
assign (resid    7 and name HB1  ) (resid    7 and name HE3  )    3.73    3.73    0.00
assign (resid   22 and name HD1  ) (resid   23 and name HN   )    5.50    5.50    0.00
assign (resid   21 and name HB2  ) (resid   22 and name HD2  )    3.79    3.79    0.00
assign (resid   22 and name HB2  ) (resid   23 and name HN   )    3.56    3.56    0.00
assign (resid   22 and name HB1  ) (resid   23 and name HN   )    3.89    3.89    0.00
assign (resid   21 and name HA   ) (resid   22 and name HD2  )    3.35    3.35    0.00
assign (resid   21 and name HA   ) (resid   22 and name HD1  )    3.72    3.72    0.00
assign (resid   21 and name HA   ) (resid   22 and name HG2  )    4.75    4.75    0.00
assign (resid   21 and name HA   ) (resid   22 and name HG1  )    4.75    4.75    0.00
assign (resid   21 and name HA   ) (resid   22 and name HB1  )    4.94    4.94    0.00
assign (resid   24 and name HA   ) (resid   24 and name HG#  )    3.67    3.67    0.00
assign (resid   24 and name HA   ) (resid   24 and name HD1# )    4.04    4.04    0.00
assign (resid   24 and name HA   ) (resid   24 and name HD2# )    3.00    3.00    0.00
assign (resid   22 and name HA   ) (resid   24 and name HG#  )    4.63    4.63    0.00
assign (resid   23 and name HA1  ) (resid   24 and name HG#  )    4.88    4.88    0.00
assign (resid   23 and name HA1  ) (resid   24 and name HD2# )    3.84    3.84    0.00
assign (resid   24 and name HB1  ) (resid   24 and name HD1# )    3.13    3.13    0.00
assign (resid   24 and name HB1  ) (resid   24 and name HD2# )    3.50    3.50    0.00
assign (resid   24 and name HB2  ) (resid   24 and name HD2# )    3.41    3.41    0.00
assign (resid   24 and name HB2  ) (resid   24 and name HD1# )    3.34    3.34    0.00
assign (resid   24 and name HN   ) (resid   24 and name HB1  )    3.85    3.85    0.00
assign (resid   24 and name HN   ) (resid   24 and name HG#  )    3.39    3.39    0.00
assign (resid   24 and name HN   ) (resid   24 and name HB2  )    3.89    3.89    0.00
assign (resid   24 and name HN   ) (resid   24 and name HD1# )    4.05    4.05    0.00
assign (resid   24 and name HN   ) (resid   24 and name HD2# )    3.97    3.97    0.00
assign (resid   25 and name HA   ) (resid   25 and name HG2# )    3.21    3.21    0.00
assign (resid   25 and name HB   ) (resid   25 and name HD1# )    3.28    3.28    0.00
assign (resid   25 and name HN   ) (resid   25 and name HG12 )    3.83    3.83    0.00
assign (resid   24 and name HA   ) (resid   25 and name HN   )    3.04    3.04    0.00
assign (resid   24 and name HB1  ) (resid   25 and name HN   )    3.65    3.65    0.00
assign (resid   24 and name HB2  ) (resid   25 and name HN   )    3.60    3.60    0.00
assign (resid   24 and name HD1# ) (resid   25 and name HN   )    4.50    4.50    0.00
assign (resid   24 and name HD2# ) (resid   25 and name HN   )    4.07    4.07    0.00
assign (resid   25 and name HA   ) (resid   26 and name HN   )    3.04    3.04    0.00
assign (resid   25 and name HB   ) (resid   26 and name HN   )    3.56    3.56    0.00
assign (resid   25 and name HG2# ) (resid   26 and name HN   )    3.87    3.87    0.00
assign (resid   28 and name HA   ) (resid   29 and name HN   )    3.52    3.52    0.00
assign (resid   28 and name HB2  ) (resid   29 and name HN   )    4.49    4.49    0.00
assign (resid   28 and name HG2  ) (resid   29 and name HN   )    4.34    4.34    0.00
assign (resid   28 and name HB1  ) (resid   29 and name HN   )    4.49    4.49    0.00
assign (resid   28 and name HG1  ) (resid   29 and name HN   )    4.34    4.34    0.00
assign (resid   26 and name HA   ) (resid   27 and name HN   )    3.14    3.14    0.00
assign (resid   26 and name HB1  ) (resid   27 and name HN   )    4.47    4.47    0.00
assign (resid   26 and name HB2  ) (resid   27 and name HN   )    4.77    4.77    0.00
assign (resid    2 and name HN   ) (resid    2 and name HB2  )    3.96    3.96    0.00
assign (resid   14 and name HN   ) (resid   14 and name HG2# )    4.57    4.57    0.00
assign (resid   14 and name HN   ) (resid   14 and name HD1# )    5.11    5.11    0.00
assign (resid    7 and name HB2  ) (resid    7 and name HE1  )    4.96    4.96    0.00
assign (resid    7 and name HB1  ) (resid    7 and name HE1  )    5.25    5.25    0.00
assign (resid    6 and name HG1  ) (resid    7 and name HE1  )    4.15    4.15    0.00
assign (resid    6 and name HG2  ) (resid    7 and name HE1  )    4.69    4.69    0.00
assign (resid    6 and name HD#  ) (resid    7 and name HE1  )    3.51    3.51    0.00
assign (resid    6 and name HE1  ) (resid    7 and name HE1  )    4.69    4.69    0.00
assign (resid    6 and name HE2  ) (resid    7 and name HE1  )    4.69    4.69    0.00
assign (resid   31 and name HN   ) (resid   32 and name HN   )    4.70    4.70    0.00
assign (resid   27 and name HN   ) (resid   32 and name HN   )    4.94    4.94    0.00
assign (resid    4 and name HN   ) (resid    5 and name HN   )    4.75    4.75    0.00
assign (resid    4 and name HN   ) (resid    4 and name HE21 )    4.86    4.86    0.00
assign (resid   25 and name HN   ) (resid   26 and name HN   )    4.40    4.40    0.00
assign (resid   26 and name HN   ) (resid   27 and name HN   )    4.46    4.46    0.00
assign (resid   10 and name HN   ) (resid   31 and name HN   )    5.44    5.44    0.00
assign (resid    8 and name HN   ) (resid   31 and name HN   )    4.27    4.27    0.00
assign (resid   23 and name HN   ) (resid   24 and name HN   )    3.28    3.28    0.00
assign (resid    2 and name HN   ) (resid    3 and name HN   )    4.18    4.18    0.00
assign (resid    1 and name HE   ) (resid    2 and name HN   )    5.19    5.19    0.00
assign (resid    4 and name HE22 ) (resid    9 and name HN   )    5.50    5.50    0.00
assign (resid   29 and name HN   ) (resid   30 and name HN   )    3.56    3.56    0.00
assign (resid   27 and name HN   ) (resid   30 and name HN   )    4.56    4.56    0.00
assign (resid   30 and name HN   ) (resid   31 and name HN   )    4.83    4.83    0.00
assign (resid   29 and name HN   ) (resid   29 and name HD#  )    4.32    4.32    0.00
assign (resid    8 and name HN   ) (resid   10 and name HN   )    5.11    5.11    0.00
assign (resid   24 and name HN   ) (resid   25 and name HN   )    5.44    5.44    0.00
assign (resid    9 and name HN   ) (resid   10 and name HN   )    4.45    4.45    0.00
assign (resid   17 and name HN   ) (resid   17 and name HD#  )    4.64    4.64    0.00
assign (resid    6 and name HG1  ) (resid    6 and name QZ   )    4.81    4.81    0.00
assign (resid    6 and name HG2  ) (resid    6 and name QZ   )    4.81    4.81    0.00
assign (resid    6 and name HD#  ) (resid    6 and name QZ   )    3.42    3.42    0.00
assign (resid    6 and name HB#  ) (resid    6 and name QZ   )    4.30    4.30    0.00
assign (resid    5 and name HA   ) (resid    6 and name HN   )    3.03    3.03    0.00
assign (resid    5 and name HG1  ) (resid    6 and name HN   )    4.63    4.63    0.00
assign (resid    5 and name HG2  ) (resid    6 and name HN   )    4.05    4.05    0.00
assign (resid    5 and name HB1  ) (resid    6 and name HN   )    3.29    3.29    0.00
assign (resid    4 and name HA   ) (resid    5 and name HN   )    2.92    2.92    0.00
assign (resid    4 and name HG2  ) (resid    5 and name HN   )    4.49    4.49    0.00
assign (resid    4 and name HG1  ) (resid    5 and name HN   )    4.16    4.16    0.00
assign (resid    4 and name HB1  ) (resid    5 and name HN   )    4.27    4.27    0.00
assign (resid    4 and name HB2  ) (resid    5 and name HN   )    4.05    4.05    0.00
assign (resid    4 and name HG2  ) (resid    4 and name HE22 )    4.04    4.04    0.00
assign (resid    4 and name HB1  ) (resid    4 and name HE21 )    4.11    4.11    0.00
assign (resid    4 and name HB1  ) (resid    4 and name HE22 )    4.50    4.50    0.00
assign (resid    4 and name HB2  ) (resid    4 and name HE22 )    5.06    5.06    0.00
assign (resid    3 and name HA   ) (resid    4 and name HN   )    3.17    3.17    0.00
assign (resid    3 and name HB2  ) (resid    4 and name HN   )    3.78    3.78    0.00
assign (resid    3 and name HB1  ) (resid    4 and name HN   )    3.78    3.78    0.00
assign (resid    2 and name HA   ) (resid    3 and name HN   )    2.95    2.95    0.00
assign (resid    2 and name HB2  ) (resid    3 and name HN   )    4.74    4.74    0.00
assign (resid    2 and name HB1  ) (resid    3 and name HN   )    4.74    4.74    0.00
assign (resid    1 and name QG   ) (resid    2 and name HN   )    3.42    3.42    0.00
assign (resid    1 and name HB#  ) (resid    2 and name HN   )    3.48    3.48    0.00
assign (resid    1 and name HA   ) (resid    2 and name HN   )    2.83    2.83    0.00
assign (resid    1 and name HA   ) (resid    1 and name HD#  )    5.41    5.41    0.00
assign (resid    1 and name HA   ) (resid    1 and name QG   )    3.76    3.76    0.00
assign (resid    1 and name HB#  ) (resid    1 and name HD#  )    3.56    3.56    0.00
assign (resid    1 and name HB#  ) (resid    1 and name QG   )    2.95    2.95    0.00
assign (resid    4 and name HE21 ) (resid   20 and name HA   )    3.94    3.94    0.00
assign (resid    9 and name HB2  ) (resid   10 and name HN   )    4.64    4.64    0.00
assign (resid    9 and name HB1  ) (resid   10 and name HN   )    4.64    4.64    0.00
assign (resid   12 and name HA   ) (resid   12 and name HG1# )    3.92    3.92    0.00
assign (resid   11 and name HN   ) (resid   11 and name HG12 )    4.59    4.59    0.00
assign (resid   11 and name HN   ) (resid   11 and name HG11 )    4.59    4.59    0.00
assign (resid   10 and name HB2  ) (resid   11 and name HN   )    4.89    4.89    0.00
assign (resid   10 and name HB1  ) (resid   11 and name HN   )    4.43    4.43    0.00
assign (resid   11 and name HA   ) (resid   11 and name HG2# )    3.46    3.46    0.00
assign (resid   30 and name HA   ) (resid   31 and name HA   )    4.52    4.52    0.00
assign (resid   17 and name HA   ) (resid   17 and name HD#  )    3.81    3.81    0.00
assign (resid   20 and name HA   ) (resid   21 and name HN   )    3.24    3.24    0.00
assign (resid   20 and name HB2  ) (resid   21 and name HN   )    4.12    4.12    0.00
assign (resid   20 and name HB1  ) (resid   21 and name HN   )    4.12    4.12    0.00
assign (resid    5 and name HN   ) (resid    8 and name HG2  )    3.71    3.71    0.00
assign (resid   19 and name HB1  ) (resid   20 and name HN   )    4.78    4.78    0.00
assign (resid   19 and name HB2  ) (resid   20 and name HN   )    4.78    4.78    0.00
assign (resid   25 and name HN   ) (resid   32 and name HN   )    3.66    3.66    0.00
assign (resid   24 and name HD2# ) (resid   32 and name HN   )    4.46    4.46    0.00
assign (resid   24 and name HD1# ) (resid   32 and name HN   )    4.70    4.70    0.00
assign (resid   24 and name HB2  ) (resid   32 and name HN   )    4.34    4.34    0.00
assign (resid   24 and name HB1  ) (resid   32 and name HN   )    4.66    4.66    0.00
assign (resid   24 and name HA   ) (resid   32 and name HN   )    4.49    4.49    0.00
assign (resid   26 and name HA   ) (resid   32 and name HN   )    4.25    4.25    0.00
assign (resid    4 and name HB1  ) (resid   21 and name HN   )    5.18    5.18    0.00
assign (resid   21 and name HN   ) (resid   24 and name HD1# )    3.59    3.59    0.00
assign (resid   21 and name HN   ) (resid   24 and name HG#  )    5.04    5.04    0.00
assign (resid    5 and name HA   ) (resid    5 and name HG1  )    3.71    3.71    0.00
assign (resid    5 and name HA   ) (resid    5 and name HG2  )    3.63    3.63    0.00
assign (resid    4 and name HA   ) (resid    4 and name HG1  )    4.11    4.11    0.00
assign (resid   11 and name HB   ) (resid   11 and name HD1# )    3.54    3.54    0.00
assign (resid   12 and name HA   ) (resid   12 and name HG2# )    3.92    3.92    0.00
assign (resid    7 and name HE1  ) (resid   32 and name HG2# )    4.64    4.64    0.00
assign (resid   32 and name HN   ) (resid   32 and name HG1# )    3.22    3.22    0.00
assign (resid   21 and name HN   ) (resid   24 and name HB2  )    5.18    5.18    0.00
assign (resid   21 and name HN   ) (resid   24 and name HD2# )    5.29    5.29    0.00
assign (resid    5 and name HA   ) (resid   21 and name HN   )    4.60    4.60    0.00
assign (resid    3 and name HA   ) (resid   21 and name HN   )    5.12    5.12    0.00
assign (resid   21 and name HN   ) (resid   22 and name HD1  )    5.29    5.29    0.00
assign (resid   28 and name HD#  ) (resid   32 and name HN   )    5.50    5.50    0.00
assign (resid   26 and name HB2  ) (resid   32 and name HN   )    5.50    5.50    0.00
assign (resid   32 and name HN   ) (resid   32 and name HB   )    4.17    4.17    0.00
assign (resid   25 and name HB   ) (resid   32 and name HN   )    5.41    5.41    0.00
assign (resid   30 and name HN   ) (resid   31 and name HA   )    5.03    5.03    0.00
assign (resid   26 and name HA   ) (resid   30 and name HN   )    5.17    5.17    0.00
assign (resid   28 and name HA   ) (resid   30 and name HN   )    5.02    5.02    0.00
assign (resid   28 and name HG2  ) (resid   30 and name HN   )    4.94    4.94    0.00
assign (resid   28 and name HG1  ) (resid   30 and name HN   )    4.94    4.94    0.00
assign (resid   30 and name HN   ) (resid   32 and name HG1# )    5.50    5.50    0.00
assign (resid    7 and name HD1  ) (resid   32 and name HA   )    5.50    5.50    0.00
assign (resid    4 and name HN   ) (resid   20 and name HA   )    3.67    3.67    0.00
assign (resid   26 and name HN   ) (resid   31 and name HA   )    5.17    5.17    0.00
assign (resid    4 and name HE22 ) (resid    8 and name HG1  )    5.50    5.50    0.00
assign (resid    4 and name HE22 ) (resid    8 and name HB#  )    4.34    4.34    0.00
assign (resid   23 and name HN   ) (resid   24 and name HG#  )    4.52    4.52    0.00
assign (resid   23 and name HN   ) (resid   24 and name HD1# )    5.50    5.50    0.00
assign (resid   23 and name HN   ) (resid   24 and name HD2# )    5.16    5.16    0.00
assign (resid    8 and name HN   ) (resid   10 and name HB2  )    4.69    4.69    0.00
assign (resid    8 and name HN   ) (resid   31 and name HB2  )    3.99    3.99    0.00
assign (resid    6 and name HA   ) (resid    8 and name HN   )    3.98    3.98    0.00
assign (resid    7 and name HE3  ) (resid   32 and name HB   )    5.50    5.50    0.00
assign (resid    7 and name HZ2  ) (resid   32 and name HB   )    5.50    5.50    0.00
assign (resid   26 and name HA   ) (resid   31 and name HA   )    4.09    4.09    0.00
assign (resid    8 and name HA   ) (resid    9 and name HA   )    5.50    5.50    0.00
assign (resid   10 and name HA   ) (resid   11 and name HA   )    5.50    5.50    0.00
assign (resid   10 and name HB2  ) (resid   30 and name HA   )    5.50    5.50    0.00
assign (resid   30 and name HA   ) (resid   31 and name HB2  )    4.81    4.81    0.00
assign (resid    7 and name HA   ) (resid   30 and name HA   )    5.35    5.35    0.00
assign (resid   31 and name HA   ) (resid   32 and name HG1# )    4.78    4.78    0.00
assign (resid   25 and name HB   ) (resid   31 and name HA   )    5.50    5.50    0.00
assign (resid   21 and name HB1  ) (resid   22 and name HD2  )    3.15    3.15    0.00
assign (resid   21 and name HB1  ) (resid   22 and name HD1  )    3.49    3.49    0.00
assign (resid    5 and name HA   ) (resid    6 and name HA   )    4.47    4.47    0.00
assign (resid    7 and name HA   ) (resid   31 and name HB2  )    4.79    4.79    0.00
assign (resid    6 and name HA   ) (resid   32 and name HA   )    4.53    4.53    0.00
assign (resid   31 and name HB2  ) (resid   32 and name HA   )    5.32    5.32    0.00
assign (resid    3 and name HB2  ) (resid   22 and name HD2  )    5.42    5.42    0.00
assign (resid    3 and name HB1  ) (resid   22 and name HD2  )    5.42    5.42    0.00
assign (resid    1 and name HA   ) (resid    2 and name HB1  )    5.50    5.50    0.00
assign (resid    1 and name HA   ) (resid    2 and name HB2  )    5.50    5.50    0.00
assign (resid    3 and name HA   ) (resid    4 and name HG2  )    5.22    5.22    0.00
assign (resid    4 and name HG2  ) (resid   20 and name HA   )    4.67    4.67    0.00
assign (resid    4 and name HA   ) (resid    5 and name HG1  )    5.07    5.07    0.00
assign (resid    6 and name HE1  ) (resid   24 and name HD2# )    4.37    4.37    0.00
assign (resid    6 and name HE2  ) (resid   24 and name HD2# )    4.37    4.37    0.00
assign (resid   24 and name HD2# ) (resid   31 and name HB1  )    4.44    4.44    0.00
assign (resid   24 and name HD2# ) (resid   31 and name HB2  )    4.91    4.91    0.00
assign (resid   24 and name HD1# ) (resid   31 and name HB2  )    3.51    3.51    0.00
assign (resid   24 and name HD1# ) (resid   31 and name HB1  )    3.18    3.18    0.00
assign (resid    5 and name HG2  ) (resid   24 and name HD1# )    5.27    5.27    0.00
assign (resid   24 and name HB2  ) (resid   31 and name HB2  )    4.40    4.40    0.00
assign (resid   24 and name HB1  ) (resid   31 and name HB2  )    4.35    4.35    0.00
assign (resid   24 and name HB1  ) (resid   31 and name HB1  )    3.26    3.26    0.00
assign (resid   24 and name HB2  ) (resid   31 and name HA   )    4.81    4.81    0.00
assign (resid    4 and name HB1  ) (resid   20 and name HA   )    3.94    3.94    0.00
assign (resid    3 and name HA   ) (resid    4 and name HB1  )    4.66    4.66    0.00
assign (resid    1 and name HB#  ) (resid    2 and name HA   )    4.53    4.53    0.00
assign (resid    4 and name HG1  ) (resid   20 and name HA   )    4.31    4.31    0.00
assign (resid   29 and name HB2  ) (resid   30 and name HG1# )    4.78    4.78    0.00
assign (resid   29 and name HB1  ) (resid   30 and name HG1# )    4.78    4.78    0.00
assign (resid    4 and name HA   ) (resid    5 and name HG2  )    5.50    5.50    0.00
assign (resid    7 and name HA   ) (resid   30 and name HB   )    3.68    3.68    0.00
assign (resid    7 and name HE1  ) (resid   32 and name HA   )    5.50    5.50    0.00
assign (resid   25 and name HA   ) (resid   32 and name HN   )    5.22    5.22    0.00
assign (resid    1 and name QG   ) (resid    3 and name HN   )    4.10    4.10    0.00
assign (resid    1 and name HB#  ) (resid    3 and name HN   )    4.59    4.59    0.00
assign (resid    5 and name HN   ) (resid    8 and name HB#  )    4.31    4.31    0.00
assign (resid    6 and name HN   ) (resid   24 and name HD1# )    3.20    3.20    0.00
assign (resid   10 and name HN   ) (resid   30 and name HG1# )    5.06    5.06    0.00
assign (resid   29 and name HN   ) (resid   30 and name HG1# )    5.26    5.26    0.00
assign (resid    4 and name HN   ) (resid   21 and name HN   )    4.12    4.12    0.00
assign (resid   26 and name HN   ) (resid   32 and name HN   )    5.50    5.50    0.00
assign (resid    3 and name HB1  ) (resid   22 and name HD1  )    4.68    4.68    0.00
assign (resid    3 and name HB2  ) (resid   22 and name HD1  )    4.68    4.68    0.00
assign (resid   25 and name HA   ) (resid   26 and name HB2  )    4.34    4.34    0.00
assign (resid    3 and name HB1  ) (resid   21 and name HA   )    3.65    3.65    0.00
assign (resid    3 and name HB2  ) (resid   21 and name HA   )    3.65    3.65    0.00
assign (resid    9 and name HA   ) (resid   30 and name HB   )    5.50    5.50    0.00
assign (resid   30 and name HB   ) (resid   31 and name HA   )    5.50    5.50    0.00
assign (resid   30 and name HG1# ) (resid   31 and name HB2  )    5.50    5.50    0.00
assign (resid    9 and name HA   ) (resid   30 and name HG1# )    3.96    3.96    0.00
assign (resid   30 and name HG2# ) (resid   31 and name HA   )    4.70    4.70    0.00
assign (resid   24 and name HD2# ) (resid   31 and name HA   )    5.50    5.50    0.00
assign (resid   32 and name HA   ) (resid   32 and name HG1# )    3.33    3.33    0.00
assign (resid    3 and name HB1  ) (resid   21 and name HN   )    4.83    4.83    0.00
assign (resid    6 and name HA   ) (resid    8 and name HG2  )    4.99    4.99    0.00
assign (resid    3 and name HB2  ) (resid   21 and name HN   )    4.83    4.83    0.00
assign (resid    6 and name HA   ) (resid   32 and name HN   )    5.50    5.50    0.00
assign (resid    4 and name HN   ) (resid   21 and name HA   )    4.55    4.55    0.00
assign (resid    1 and name HD#  ) (resid    2 and name HN   )    4.84    4.84    0.00
assign (resid   23 and name HN   ) (resid   24 and name HA   )    5.24    5.24    0.00
assign (resid    6 and name HA   ) (resid   31 and name HN   )    4.80    4.80    0.00
assign (resid    7 and name HA   ) (resid   31 and name HN   )    4.49    4.49    0.00
assign (resid    4 and name HN   ) (resid   24 and name HD1# )    5.19    5.19    0.00
assign (resid   26 and name HN   ) (resid   31 and name HB1  )    5.08    5.08    0.00
assign (resid   22 and name HA   ) (resid   24 and name HN   )    3.69    3.69    0.00
assign (resid    6 and name HN   ) (resid   24 and name HD2# )    4.05    4.05    0.00
assign (resid    7 and name HE3  ) (resid   30 and name HG1# )    4.29    4.29    0.00
assign (resid    7 and name HE3  ) (resid   30 and name HG2# )    3.16    3.16    0.00
assign (resid    8 and name HB#  ) (resid    9 and name HA   )    5.41    5.41    0.00
assign (resid    8 and name HB#  ) (resid   10 and name HA   )    5.50    5.50    0.00
assign (resid    6 and name HB#  ) (resid   32 and name HA   )    4.43    4.43    0.00
assign (resid    7 and name HA   ) (resid   30 and name HG2# )    3.37    3.37    0.00
assign (resid    5 and name HA   ) (resid   24 and name HD1# )    3.69    3.69    0.00
assign (resid    7 and name HA   ) (resid   30 and name HG1# )    3.85    3.85    0.00
assign (resid    5 and name HA   ) (resid    6 and name HG2  )    5.50    5.50    0.00
assign (resid    6 and name HG2  ) (resid    7 and name HA   )    5.50    5.50    0.00
assign (resid    5 and name HA   ) (resid   24 and name HD2# )    5.11    5.11    0.00
assign (resid   20 and name HA   ) (resid   24 and name HD1# )    4.59    4.59    0.00
assign (resid    6 and name HA   ) (resid   24 and name HD2# )    3.82    3.82    0.00
assign (resid    6 and name HA   ) (resid   24 and name HD1# )    3.40    3.40    0.00
assign (resid   27 and name HA1  ) (resid   30 and name HN   )    5.50    5.50    0.00
assign (resid   10 and name HB2  ) (resid   31 and name HN   )    3.83    3.83    0.00
assign (resid    6 and name HN   ) (resid    8 and name HN   )    4.32    4.32    0.00
assign (resid    6 and name HG2  ) (resid   32 and name HN   )    5.50    5.50    0.00
assign (resid   24 and name HB2  ) (resid   31 and name HB1  )    3.64    3.64    0.00
assign (resid   24 and name HA   ) (resid   31 and name HB1  )    4.59    4.59    0.00
assign (resid    1 and name QG   ) (resid    2 and name HA   )    5.41    5.41    0.00
assign (resid    1 and name QG   ) (resid    3 and name HA   )    5.50    5.50    0.00
assign (resid    5 and name HA   ) (resid    6 and name HB#  )    4.70    4.70    0.00
assign (resid    6 and name HB#  ) (resid    7 and name HA   )    5.13    5.13    0.00
assign (resid    6 and name HD#  ) (resid   32 and name HA   )    4.26    4.26    0.00
assign (resid    4 and name HN   ) (resid    4 and name HB2  )    3.79    3.79    0.00
assign (resid    4 and name HN   ) (resid    4 and name HG1  )    4.10    4.10    0.00
assign (resid   24 and name HB1  ) (resid   31 and name HA   )    4.23    4.23    0.00
assign (resid    7 and name HE1  ) (resid   32 and name HB   )    5.50    5.50    0.00
assign (resid    7 and name HN   ) (resid    7 and name HE1  )    5.50    5.50    0.00
assign (resid    7 and name HN   ) (resid   31 and name HN   )    5.50    5.50    0.00
assign (resid    7 and name HN   ) (resid    8 and name HN   )    3.90    3.90    0.00
assign (resid    7 and name HN   ) (resid    7 and name HE3  )    5.02    5.02    0.00
assign (resid    7 and name HN   ) (resid    7 and name HD1  )    4.95    4.95    0.00
assign (resid    7 and name HN   ) (resid   32 and name HA   )    4.96    4.96    0.00
assign (resid    6 and name HA   ) (resid    7 and name HN   )    3.54    3.54    0.00
assign (resid    7 and name HN   ) (resid   31 and name HB2  )    4.95    4.95    0.00
assign (resid    7 and name HN   ) (resid    8 and name HG2  )    5.32    5.32    0.00
assign (resid    7 and name HN   ) (resid   30 and name HB   )    5.48    5.48    0.00
assign (resid    6 and name HB#  ) (resid    7 and name HN   )    3.90    3.90    0.00
assign (resid    6 and name HD#  ) (resid    7 and name HN   )    4.70    4.70    0.00
assign (resid    7 and name HN   ) (resid   30 and name HG2# )    5.46    5.46    0.00
assign (resid    6 and name HG2  ) (resid    7 and name HN   )    4.03    4.03    0.00
assign (resid    6 and name HG1  ) (resid    7 and name HN   )    4.00    4.00    0.00
assign (resid   31 and name HB2  ) (resid   32 and name HN   )    4.22    4.22    0.00
assign (resid    7 and name HN   ) (resid   24 and name HD2# )    5.47    5.47    0.00
assign (resid    7 and name HN   ) (resid   24 and name HD1# )    4.65    4.65    0.00
assign (resid    7 and name HE3  ) (resid   30 and name HB   )    4.21    4.21    0.00
assign (resid    7 and name HZ3  ) (resid   32 and name HG2# )    3.92    3.92    0.00
assign (resid    7 and name HZ3  ) (resid   30 and name HG1# )    5.50    5.50    0.00
assign (resid    7 and name HZ2  ) (resid   32 and name HG2# )    3.32    3.32    0.00
assign (resid    7 and name HH2  ) (resid   32 and name HG2# )    3.57    3.57    0.00
assign (resid    7 and name HZ3  ) (resid   32 and name HB   )    5.50    5.50    0.00
assign (resid    7 and name HH2  ) (resid   32 and name HB   )    5.09    5.09    0.00
assign (resid    7 and name HA   ) (resid    7 and name HZ3  )    5.05    5.05    0.00
assign (resid    7 and name HZ3  ) (resid   32 and name HA   )    5.50    5.50    0.00
assign (resid    7 and name HA   ) (resid    7 and name HE3  )    3.02    3.02    0.00
assign (resid    7 and name HZ2  ) (resid   32 and name HA   )    5.02    5.02    0.00
assign (resid    6 and name QZ   ) (resid   24 and name HD2# )    4.74    4.74    0.00
assign (resid    8 and name HN   ) (resid   30 and name HG1# )    4.47    4.47    0.00
assign (resid    8 and name HN   ) (resid   30 and name HB   )    4.26    4.26    0.00
assign (resid   14 and name HA   ) (resid   14 and name HG2# )    3.48    3.48    0.00
assign (resid    4 and name HA   ) (resid   21 and name HN   )    5.50    5.50    0.00
assign (resid   12 and name HN   ) (resid   12 and name HG2# )    4.65    4.65    0.00
assign (resid   12 and name HN   ) (resid   12 and name HG1# )    4.65    4.65    0.00
assign (resid    4 and name HG2  ) (resid   21 and name HN   )    5.42    5.42    0.00
assign (resid    4 and name HG1  ) (resid   21 and name HN   )    5.25    5.25    0.00
assign (resid    6 and name HB#  ) (resid   32 and name HN   )    4.61    4.61    0.00
assign (resid   22 and name HD2  ) (resid   24 and name HD1# )    4.77    4.77    0.00
assign (resid   26 and name HN   ) (resid   26 and name HB1  )    3.71    3.71    0.00
assign (resid   27 and name HN   ) (resid   32 and name HG1# )    3.76    3.76    0.00
assign (resid    6 and name HN   ) (resid   21 and name HN   )    5.46    5.46    0.00
assign (resid    4 and name HE21 ) (resid   21 and name HN   )    5.35    5.35    0.00
assign (resid   21 and name HN   ) (resid   22 and name HD2  )    4.80    4.80    0.00
assign (resid    4 and name HN   ) (resid   21 and name HB2  )    4.82    4.82    0.00
assign (resid    4 and name HN   ) (resid   21 and name HB1  )    5.50    5.50    0.00
assign (resid    4 and name HN   ) (resid    5 and name HA   )    5.50    5.50    0.00
assign (resid   26 and name HN   ) (resid   27 and name HA2  )    5.50    5.50    0.00
assign (resid    8 and name HB#  ) (resid   31 and name HN   )    5.35    5.35    0.00
assign (resid    8 and name HB#  ) (resid   10 and name HN   )    3.92    3.92    0.00
assign (resid    9 and name HN   ) (resid   30 and name HG1# )    4.74    4.74    0.00
assign (resid    6 and name HN   ) (resid    7 and name HB2  )    4.98    4.98    0.00
assign (resid   29 and name HA   ) (resid   30 and name HA   )    5.50    5.50    0.00
assign (resid    3 and name HA   ) (resid    4 and name HB2  )    5.50    5.50    0.00
assign (resid   26 and name HA   ) (resid   28 and name HD#  )    4.63    4.63    0.00
assign (resid    6 and name HA   ) (resid   31 and name HB1  )    4.09    4.09    0.00
assign (resid   20 and name HA   ) (resid   21 and name HB2  )    4.94    4.94    0.00
assign (resid    4 and name HA   ) (resid    5 and name HB2  )    4.48    4.48    0.00
assign (resid    1 and name HA   ) (resid    2 and name HB#  )    4.77    4.77    0.00
assign (resid    2 and name HN   ) (resid    2 and name HB#  )    3.18    3.18    0.00
assign (resid    2 and name HB#  ) (resid    3 and name HN   )    4.06    4.06    0.00
assign (resid    3 and name HN   ) (resid    3 and name HB#  )    3.61    3.61    0.00
assign (resid    3 and name HB#  ) (resid    4 and name HN   )    3.28    3.28    0.00
assign (resid    3 and name HB#  ) (resid   21 and name HN   )    3.98    3.98    0.00
assign (resid    3 and name HB#  ) (resid   21 and name HA   )    3.20    3.20    0.00
assign (resid    3 and name HB#  ) (resid   22 and name HD2  )    4.73    4.73    0.00
assign (resid    3 and name HB#  ) (resid   22 and name HD1  )    4.06    4.06    0.00
assign (resid    4 and name HG1  ) (resid   20 and name HB#  )    3.71    3.71    0.00
assign (resid    6 and name HB#  ) (resid    6 and name HE#  )    4.34    4.34    0.00
assign (resid    6 and name HE#  ) (resid    7 and name HD1  )    4.38    4.38    0.00
assign (resid    6 and name HE#  ) (resid    7 and name HE1  )    3.83    3.83    0.00
assign (resid    6 and name HE#  ) (resid    7 and name HZ2  )    3.52    3.52    0.00
assign (resid    6 and name HE#  ) (resid    7 and name HH2  )    4.74    4.74    0.00
assign (resid    6 and name HE#  ) (resid   24 and name HD2# )    3.75    3.75    0.00
assign (resid    6 and name HE#  ) (resid   32 and name HA   )    4.41    4.41    0.00
assign (resid    9 and name HB#  ) (resid   10 and name HN   )    3.80    3.80    0.00
assign (resid    9 and name HB#  ) (resid   30 and name HG1# )    5.34    5.34    0.00
assign (resid   11 and name HN   ) (resid   11 and name HG1# )    3.75    3.75    0.00
assign (resid   11 and name HG2# ) (resid   11 and name HG1# )    3.26    3.26    0.00
assign (resid   12 and name HN   ) (resid   12 and name HG## )    3.83    3.83    0.00
assign (resid   14 and name HA   ) (resid   14 and name HG1# )    3.63    3.63    0.00
assign (resid   18 and name HN   ) (resid   18 and name HG## )    4.05    4.05    0.00
assign (resid   18 and name HG## ) (resid   19 and name HN   )    4.67    4.67    0.00
assign (resid   21 and name HB1  ) (resid   22 and name QG   )    4.21    4.21    0.00
assign (resid   22 and name QG   ) (resid   23 and name HN   )    4.56    4.56    0.00
assign (resid   25 and name HG1# ) (resid   26 and name HN   )    4.45    4.45    0.00
assign (resid   25 and name HG1# ) (resid   32 and name HN   )    5.05    5.05    0.00
assign (resid   28 and name HB#  ) (resid   29 and name HN   )    3.84    3.84    0.00
assign (resid   28 and name HB#  ) (resid   30 and name HN   )    5.01    5.01    0.00
assign (resid   28 and name QG   ) (resid   29 and name HN   )    3.60    3.60    0.00
assign (resid   28 and name QG   ) (resid   30 and name HN   )    4.22    4.22    0.00
assign (resid   29 and name HB#  ) (resid   30 and name HN   )    3.97    3.97    0.00
assign (resid   29 and name HB#  ) (resid   30 and name HA   )    5.34    5.34    0.00
assign (resid   29 and name HB#  ) (resid   30 and name HG1# )    4.08    4.08    0.00
assign (resid   29 and name HB#  ) (resid   30 and name HG2# )    3.80    3.80    0.00
!Dihedral restraints
assign (resid    1 and name C    ) (resid    2 and name N    )
       (resid    2 and name CA   ) (resid    2 and name C    )    1.0  -86.0   30.0 2
assign (resid    2 and name N    ) (resid    2 and name CA   )
       (resid    2 and name C    ) (resid    3 and name N    )    1.0  141.0   86.0 2
assign (resid    2 and name C    ) (resid    3 and name N    )
       (resid    3 and name CA   ) (resid    3 and name C    )    1.0 -128.0   62.0 2
assign (resid    3 and name N    ) (resid    3 and name CA   )
       (resid    3 and name C    ) (resid    4 and name N    )    1.0  161.0   18.0 2
assign (resid    3 and name C    ) (resid    4 and name N    )
       (resid    4 and name CA   ) (resid    4 and name C    )    1.0 -124.0   42.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name C    ) (resid    5 and name N    )    1.0  154.0   18.0 2
assign (resid    4 and name C    ) (resid    5 and name N    )
       (resid    5 and name CA   ) (resid    5 and name C    )    1.0  -97.0   52.0 2
assign (resid    5 and name N    ) (resid    5 and name CA   )
       (resid    5 and name C    ) (resid    6 and name N    )    1.0  162.0   64.0 2
assign (resid    5 and name C    ) (resid    6 and name N    )
       (resid    6 and name CA   ) (resid    6 and name C    )    1.0  -61.0   16.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name C    ) (resid    7 and name N    )    1.0  -28.0   20.0 2
assign (resid    6 and name C    ) (resid    7 and name N    )
       (resid    7 and name CA   ) (resid    7 and name C    )    1.0  -69.0   14.0 2
assign (resid    7 and name C    ) (resid    8 and name N    )
       (resid    8 and name CA   ) (resid    8 and name C    )    1.0  -65.0   18.0 2
assign (resid    8 and name C    ) (resid    9 and name N    )
       (resid    9 and name CA   ) (resid    9 and name C    )    1.0  -80.0   28.0 2
assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name C    ) (resid   10 and name N    )    1.0  -27.0   32.0 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0 -131.0   34.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  159.0   26.0 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0 -109.0   48.0 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  116.0   54.0 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0 -126.0   32.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name C    ) (resid   15 and name N    )    1.0  152.0   32.0 2
assign (resid   14 and name C    ) (resid   15 and name N    )
       (resid   15 and name CA   ) (resid   15 and name C    )    1.0 -129.0   88.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name C    ) (resid   16 and name N    )    1.0  151.0   30.0 2
assign (resid   15 and name C    ) (resid   16 and name N    )
       (resid   16 and name CA   ) (resid   16 and name C    )    1.0   90.0   32.0 2
assign (resid   16 and name N    ) (resid   16 and name CA   )
       (resid   16 and name C    ) (resid   17 and name N    )    1.0   15.0   20.0 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -90.0   36.0 2
assign (resid   17 and name N    ) (resid   17 and name CA   )
       (resid   17 and name C    ) (resid   18 and name N    )    1.0  143.0   32.0 2
assign (resid   17 and name C    ) (resid   18 and name N    )
       (resid   18 and name CA   ) (resid   18 and name C    )    1.0 -133.0   28.0 2
assign (resid   18 and name N    ) (resid   18 and name CA   )
       (resid   18 and name C    ) (resid   19 and name N    )    1.0  158.0   28.0 2
assign (resid   18 and name C    ) (resid   19 and name N    )
       (resid   19 and name CA   ) (resid   19 and name C    )    1.0  -88.0   48.0 2
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name C    ) (resid   20 and name N    )    1.0  135.0   28.0 2
assign (resid   19 and name C    ) (resid   20 and name N    )
       (resid   20 and name CA   ) (resid   20 and name C    )    1.0  -92.0   70.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name C    ) (resid   21 and name N    )    1.0  146.0   52.0 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )    1.0  -86.0   60.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name C    ) (resid   22 and name N    )    1.0  125.0   58.0 2
assign (resid   22 and name C    ) (resid   23 and name N    )
       (resid   23 and name CA   ) (resid   23 and name C    )    1.0   90.0   22.0 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name C    ) (resid   24 and name N    )    1.0   -8.0   22.0 2
assign (resid   23 and name C    ) (resid   24 and name N    )
       (resid   24 and name CA   ) (resid   24 and name C    )    1.0 -118.0   52.0 2
assign (resid   24 and name N    ) (resid   24 and name CA   )
       (resid   24 and name C    ) (resid   25 and name N    )    1.0  157.0   14.0 2
assign (resid   24 and name C    ) (resid   25 and name N    )
       (resid   25 and name CA   ) (resid   25 and name C    )    1.0 -139.0   32.0 2
assign (resid   25 and name N    ) (resid   25 and name CA   )
       (resid   25 and name C    ) (resid   26 and name N    )    1.0  150.0   32.0 2
assign (resid   25 and name C    ) (resid   26 and name N    )
       (resid   26 and name CA   ) (resid   26 and name C    )    1.0 -100.0   64.0 2
assign (resid   26 and name N    ) (resid   26 and name CA   )
       (resid   26 and name C    ) (resid   27 and name N    )    1.0  122.0   34.0 2
assign (resid   26 and name C    ) (resid   27 and name N    )
       (resid   27 and name CA   ) (resid   27 and name C    )    1.0  -83.0   54.0 2
assign (resid   29 and name C    ) (resid   30 and name N    )
       (resid   30 and name CA   ) (resid   30 and name C    )    1.0 -126.0   28.0 2
assign (resid   30 and name N    ) (resid   30 and name CA   )
       (resid   30 and name C    ) (resid   31 and name N    )    1.0  152.0   58.0 2
assign (resid   30 and name C    ) (resid   31 and name N    )
       (resid   31 and name CA   ) (resid   31 and name C    )    1.0 -119.0   68.0 2
assign (resid   31 and name N    ) (resid   31 and name CA   )
       (resid   31 and name C    ) (resid   32 and name N    )    1.0  154.0   46.0 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           H        ARG   1 -10.046  11.227   0.196
    2    HA   ARG   1           HA       ARG   1 -11.247  10.756  -2.208
    3    HB2  ARG   1           2HB      ARG   1  -8.257  10.403  -2.269
    4    HB3  ARG   1           1HB      ARG   1  -9.350   9.515  -3.320
    5    HG2  ARG   1           2HG      ARG   1  -9.013  12.508  -3.225
    6    HG3  ARG   1           1HG      ARG   1  -8.418  11.421  -4.485
    7    HD2  ARG   1           2HD      ARG   1 -11.312  11.975  -3.785
    8    HD3  ARG   1           1HD      ARG   1 -10.457  12.463  -5.235
    9    HE   ARG   1           HE       ARG   1 -10.281  10.140  -5.853
   10   HH11  ARG   1          1HH1      ARG   1 -12.748  10.899  -3.383
   11   HH12  ARG   1          2HH1      ARG   1 -13.617   9.458  -3.658
   12   HH21  ARG   1          1HH2      ARG   1 -11.596   8.233  -6.244
   13   HH22  ARG   1          2HH2      ARG   1 -13.002   7.965  -5.336
   14    H    ASP   2           H        ASP   2 -11.156   8.474  -2.808
   15    HA   ASP   2           HA       ASP   2 -11.732   7.111  -0.342
   16    HB2  ASP   2           2HB      ASP   2 -12.330   6.369  -3.217
   17    HB3  ASP   2           1HB      ASP   2 -12.745   5.385  -1.818
   18    H    CYS   3           H        CYS   3  -9.545   7.042   0.192
   19    HA   CYS   3           HA       CYS   3  -8.207   4.624  -0.314
   20    HB2  CYS   3           2HB      CYS   3  -6.160   5.759  -1.288
   21    HB3  CYS   3           1HB      CYS   3  -7.516   5.606  -2.403
   22    H    GLN   4           H        GLN   4  -5.859   5.054   0.664
   23    HA   GLN   4           HA       GLN   4  -6.342   6.549   3.195
   24    HB2  GLN   4           2HB      GLN   4  -5.218   4.823   4.358
   25    HB3  GLN   4           1HB      GLN   4  -6.317   4.010   3.258
   26    HG2  GLN   4           2HG      GLN   4  -4.538   3.611   1.692
   27    HG3  GLN   4           1HG      GLN   4  -3.364   4.350   2.795
   28   HE21  GLN   4          1HE2      GLN   4  -5.327   1.789   2.043
   29   HE22  GLN   4          2HE2      GLN   4  -4.783   0.655   3.256
   30    H    GLU   5           H        GLU   5  -4.474   7.259   4.204
   31    HA   GLU   5           HA       GLU   5  -2.763   8.651   2.489
   32    HB2  GLU   5           2HB      GLU   5  -2.788   8.151   5.429
   33    HB3  GLU   5           1HB      GLU   5  -1.557   9.148   4.643
   34    HG2  GLU   5           2HG      GLU   5  -4.371   9.482   4.153
   35    HG3  GLU   5           1HG      GLU   5  -3.721  10.298   5.583
   36    H    LYS   6           H        LYS   6  -0.423   8.569   3.063
   37    HA   LYS   6           HA       LYS   6   0.342   6.088   1.910
   38    HB2  LYS   6           2HB      LYS   6   2.519   6.993   1.478
   39    HB3  LYS   6           1HB      LYS   6   1.299   8.195   1.130
   40    HG2  LYS   6           2HG      LYS   6   1.836   9.060   3.461
   41    HG3  LYS   6           1HG      LYS   6   3.335   8.155   3.290
   42    HD2  LYS   6           2HD      LYS   6   3.645   9.348   1.042
   43    HD3  LYS   6           1HD      LYS   6   2.233  10.314   1.578
   44    HE2  LYS   6           2HE      LYS   6   3.493  11.105   3.431
   45    HE3  LYS   6           1HE      LYS   6   4.888  10.165   2.883
   46    HZ1  LYS   6           3HZ      LYS   6   4.945  11.485   0.862
   47    HZ2  LYS   6           1HZ      LYS   6   5.016  12.499   2.206
   48    HZ3  LYS   6           2HZ      LYS   6   3.580  12.339   1.345
   49    H    TRP   7           H        TRP   7   1.068   7.579   4.976
   50    HA   TRP   7           HA       TRP   7   2.784   5.411   5.773
   51    HB2  TRP   7           2HB      TRP   7   1.777   7.807   7.289
   52    HB3  TRP   7           1HB      TRP   7   3.023   6.698   7.845
   53    HD1  TRP   7           HD       TRP   7   2.558   9.845   5.828
   54    HE1  TRP   7           1HE      TRP   7   4.756  10.553   4.850
   55    HE3  TRP   7           3HE      TRP   7   5.266   5.564   6.634
   56    HZ2  TRP   7           2HZ      TRP   7   7.310   9.519   4.419
   57    HZ3  TRP   7           3HZ      TRP   7   7.607   5.536   5.834
   58    HH2  TRP   7           HH       TRP   7   8.580   7.480   4.754
   59    H    GLU   8           H        GLU   8  -0.156   4.863   5.323
   60    HA   GLU   8           HA       GLU   8  -1.111   4.519   8.055
   61    HB2  GLU   8           2HB      GLU   8  -2.548   3.731   5.527
   62    HB3  GLU   8           1HB      GLU   8  -3.228   3.747   7.145
   63    HG2  GLU   8           2HG      GLU   8  -2.309   6.088   5.529
   64    HG3  GLU   8           1HG      GLU   8  -3.966   5.562   5.861
   65    H    TYR   9           H        TYR   9  -2.188   2.061   5.937
   66    HA   TYR   9           HA       TYR   9  -0.641   0.132   7.499
   67    HB2  TYR   9           2HB      TYR   9  -3.280  -0.182   6.071
   68    HB3  TYR   9           1HB      TYR   9  -2.398  -1.501   6.827
   69    HD1  TYR   9           2HD      TYR   9  -2.234  -1.643   9.259
   70    HD2  TYR   9           1HD      TYR   9  -4.485   1.430   7.374
   71    HE1  TYR   9           2HE      TYR   9  -3.341  -1.165  11.377
   72    HE2  TYR   9           1HE      TYR   9  -5.595   1.915   9.488
   73    HH   TYR   9           HH       TYR   9  -6.115   0.734  11.577
   74    H    CYS  10           H        CYS  10  -2.136   0.535   4.334
   75    HA   CYS  10           HA       CYS  10  -1.696  -0.291   2.304
   76    HB2  CYS  10           2HB      CYS  10   0.412   1.070   2.513
   77    HB3  CYS  10           1HB      CYS  10   1.206  -0.347   3.187
   78    H    ILE  11           H        ILE  11  -2.727  -2.209   2.357
   79    HA   ILE  11           HA       ILE  11  -1.274  -4.485   3.449
   80    HB   ILE  11           HB       ILE  11  -3.422  -5.723   3.274
   81   HG12  ILE  11          2HG1      ILE  11  -4.592  -3.021   2.539
   82   HG13  ILE  11          1HG1      ILE  11  -4.430  -4.388   1.446
   83   HG21  ILE  11          1HG2      ILE  11  -2.786  -4.706   5.377
   84   HG22  ILE  11          2HG2      ILE  11  -4.532  -4.586   5.161
   85   HG23  ILE  11          3HG2      ILE  11  -3.512  -3.175   4.885
   86   HD11  ILE  11          3HD1      ILE  11  -5.985  -5.671   2.818
   87   HD12  ILE  11          1HD1      ILE  11  -6.710  -4.157   2.276
   88   HD13  ILE  11          2HD1      ILE  11  -6.125  -4.312   3.933
   89    H    VAL  12           H        VAL  12  -1.402  -6.519   2.252
   90    HA   VAL  12           HA       VAL  12  -0.383  -6.241  -0.320
   91    HB   VAL  12           HB       VAL  12  -0.621  -8.731  -0.531
   92   HG11  VAL  12          1HG1      VAL  12   0.927  -9.267   1.314
   93   HG12  VAL  12          2HG1      VAL  12   0.598  -7.677   2.008
   94   HG13  VAL  12          3HG1      VAL  12   1.370  -7.809   0.431
   95   HG21  VAL  12          3HG2      VAL  12  -1.875  -8.485   2.201
   96   HG22  VAL  12          1HG2      VAL  12  -1.382 -10.001   1.445
   97   HG23  VAL  12          2HG2      VAL  12  -2.677  -9.038   0.734
   98    HA   PRO  13           HA       PRO  13  -3.871  -6.017  -2.988
   99    HB2  PRO  13           2HB      PRO  13  -2.485  -7.773  -4.908
  100    HB3  PRO  13           1HB      PRO  13  -2.995  -6.092  -5.093
  101    HG2  PRO  13           2HG      PRO  13  -0.411  -6.745  -4.833
  102    HG3  PRO  13           1HG      PRO  13  -1.074  -5.261  -4.123
  103    HD2  PRO  13           2HD      PRO  13  -0.430  -7.867  -2.803
  104    HD3  PRO  13           1HD      PRO  13  -0.136  -6.206  -2.243
  105    H    ILE  14           H        ILE  14  -5.499  -7.108  -2.170
  106    HA   ILE  14           HA       ILE  14  -5.871  -9.888  -3.005
  107    HB   ILE  14           HB       ILE  14  -7.315 -10.218  -0.977
  108   HG12  ILE  14          2HG1      ILE  14  -6.081  -7.628  -0.015
  109   HG13  ILE  14          1HG1      ILE  14  -7.759  -7.816  -0.531
  110   HG21  ILE  14          1HG2      ILE  14  -4.438  -9.555  -0.401
  111   HG22  ILE  14          2HG2      ILE  14  -5.069 -11.103  -0.964
  112   HG23  ILE  14          3HG2      ILE  14  -5.487 -10.511   0.645
  113   HD11  ILE  14          3HD1      ILE  14  -7.542  -7.785   1.889
  114   HD12  ILE  14          1HD1      ILE  14  -6.456  -9.172   1.817
  115   HD13  ILE  14          2HD1      ILE  14  -8.141  -9.344   1.324
  116    H    LEU  15           H        LEU  15  -8.549 -10.182  -2.555
  117    HA   LEU  15           HA       LEU  15  -9.587  -8.470  -4.580
  118    HB2  LEU  15           2HB      LEU  15 -10.257 -10.829  -4.377
  119    HB3  LEU  15           1HB      LEU  15 -10.964 -10.492  -2.814
  120    HG   LEU  15           HG       LEU  15 -12.622  -9.011  -3.908
  121   HD11  LEU  15          1HD1      LEU  15 -11.379  -8.365  -5.877
  122   HD12  LEU  15          2HD1      LEU  15 -12.898  -9.130  -6.342
  123   HD13  LEU  15          3HD1      LEU  15 -11.386 -10.029  -6.458
  124   HD21  LEU  15          3HD2      LEU  15 -12.508 -11.830  -4.973
  125   HD22  LEU  15          1HD2      LEU  15 -13.945 -10.810  -4.913
  126   HD23  LEU  15          2HD2      LEU  15 -13.171 -11.332  -3.417
  127    H    GLY  16           H        GLY  16 -10.347  -6.510  -4.241
  128    HA2  GLY  16           2HA      GLY  16 -11.511  -4.758  -3.310
  129    HA3  GLY  16           1HA      GLY  16 -12.231  -5.913  -2.204
  130    H    PHE  17           H        PHE  17  -8.776  -5.231  -2.505
  131    HA   PHE  17           HA       PHE  17  -8.663  -4.800   0.339
  132    HB2  PHE  17           2HB      PHE  17  -6.260  -4.642   0.125
  133    HB3  PHE  17           1HB      PHE  17  -6.808  -5.940  -0.913
  134    HD1  PHE  17           2HD      PHE  17  -6.917  -5.498  -3.428
  135    HD2  PHE  17           1HD      PHE  17  -4.966  -2.875  -0.696
  136    HE1  PHE  17           2HE      PHE  17  -5.639  -4.513  -5.277
  137    HE2  PHE  17           1HE      PHE  17  -3.686  -1.902  -2.540
  138    HZ   PHE  17           HZ       PHE  17  -4.018  -2.715  -4.837
  139    H    VAL  18           H        VAL  18  -7.331  -2.802   1.155
  140    HA   VAL  18           HA       VAL  18  -8.553  -0.466  -0.112
  141    HB   VAL  18           HB       VAL  18  -7.356  -0.759   2.677
  142   HG11  VAL  18          1HG1      VAL  18  -8.379   1.415   3.155
  143   HG12  VAL  18          2HG1      VAL  18  -8.956   1.511   1.494
  144   HG13  VAL  18          3HG1      VAL  18  -7.224   1.536   1.826
  145   HG21  VAL  18          3HG2      VAL  18  -9.413  -2.058   2.454
  146   HG22  VAL  18          1HG2      VAL  18 -10.257  -0.632   1.857
  147   HG23  VAL  18          2HG2      VAL  18  -9.658  -0.672   3.517
  148    H    TYR  19           H        TYR  19  -7.224   0.992  -1.018
  149    HA   TYR  19           HA       TYR  19  -4.380   0.304  -0.953
  150    HB2  TYR  19           2HB      TYR  19  -4.224   1.252  -3.216
  151    HB3  TYR  19           1HB      TYR  19  -5.353  -0.090  -3.147
  152    HD1  TYR  19           1HD      TYR  19  -7.846   0.455  -3.175
  153    HD2  TYR  19           2HD      TYR  19  -4.871   3.374  -4.035
  154    HE1  TYR  19           1HE      TYR  19  -9.527   1.829  -4.297
  155    HE2  TYR  19           2HE      TYR  19  -6.550   4.762  -5.157
  156    HH   TYR  19           HH       TYR  19  -8.792   4.328  -6.330
  157    H    CYS  20           H        CYS  20  -2.903   2.121  -1.370
  158    HA   CYS  20           HA       CYS  20  -3.824   4.390   0.157
  159    HB2  CYS  20           2HB      CYS  20  -1.460   5.138   0.093
  160    HB3  CYS  20           1HB      CYS  20  -1.639   3.537   0.790
  161    H    CYS  21           H        CYS  21  -3.812   6.371  -0.542
  162    HA   CYS  21           HA       CYS  21  -4.956   6.979  -2.937
  163    HB2  CYS  21           2HB      CYS  21  -3.275   8.721  -1.162
  164    HB3  CYS  21           1HB      CYS  21  -4.270   9.329  -2.496
  165    HA   PRO  22           HA       PRO  22  -2.184   6.970  -6.300
  166    HB2  PRO  22           2HB      PRO  22  -2.939   9.261  -7.639
  167    HB3  PRO  22           1HB      PRO  22  -3.816   7.727  -7.704
  168    HG2  PRO  22           2HG      PRO  22  -4.367  10.147  -6.042
  169    HG3  PRO  22           1HG      PRO  22  -5.506   9.097  -6.906
  170    HD2  PRO  22           2HD      PRO  22  -5.111   8.902  -4.251
  171    HD3  PRO  22           1HD      PRO  22  -5.444   7.471  -5.243
  172    H    GLY  23           H        GLY  23  -0.219   7.731  -6.912
  173    HA2  GLY  23           2HA      GLY  23   1.521   9.294  -7.097
  174    HA3  GLY  23           1HA      GLY  23   0.698  10.324  -5.926
  175    H    LEU  24           H        LEU  24   0.707   7.131  -4.940
  176    HA   LEU  24           HA       LEU  24   3.068   7.600  -3.253
  177    HB2  LEU  24           2HB      LEU  24   0.698   5.966  -2.355
  178    HB3  LEU  24           1HB      LEU  24   2.024   6.593  -1.459
  179    HG   LEU  24           HG       LEU  24  -0.014   8.432  -2.663
  180   HD11  LEU  24          1HD1      LEU  24   0.122   7.114  -0.007
  181   HD12  LEU  24          2HD1      LEU  24  -1.206   7.092  -1.184
  182   HD13  LEU  24          3HD1      LEU  24  -0.831   8.576  -0.296
  183   HD21  LEU  24          3HD2      LEU  24   0.912  10.008  -0.982
  184   HD22  LEU  24          1HD2      LEU  24   2.095   9.486  -2.177
  185   HD23  LEU  24          2HD2      LEU  24   2.131   8.809  -0.558
  186    H    ILE  25           H        ILE  25   4.186   5.721  -2.683
  187    HA   ILE  25           HA       ILE  25   3.490   3.321  -4.176
  188    HB   ILE  25           HB       ILE  25   5.934   2.863  -4.440
  189   HG12  ILE  25          2HG1      ILE  25   6.705   4.604  -2.736
  190   HG13  ILE  25          1HG1      ILE  25   7.616   4.529  -4.225
  191   HG21  ILE  25          1HG2      ILE  25   4.868   5.225  -5.949
  192   HG22  ILE  25          2HG2      ILE  25   4.656   3.518  -6.341
  193   HG23  ILE  25          3HG2      ILE  25   6.257   4.252  -6.432
  194   HD11  ILE  25          3HD1      ILE  25   5.551   6.609  -3.519
  195   HD12  ILE  25          1HD1      ILE  25   6.473   6.544  -5.022
  196   HD13  ILE  25          2HD1      ILE  25   7.301   6.822  -3.489
  197    H    CYS  26           H        CYS  26   3.675   1.465  -3.036
  198    HA   CYS  26           HA       CYS  26   4.278   1.728  -0.197
  199    HB2  CYS  26           2HB      CYS  26   2.296   0.440  -1.325
  200    HB3  CYS  26           1HB      CYS  26   3.496  -0.831  -1.574
  201    H    GLY  27           H        GLY  27   6.211   1.428   0.512
  202    HA2  GLY  27           2HA      GLY  27   8.031  -0.311  -1.035
  203    HA3  GLY  27           1HA      GLY  27   8.467   1.354  -0.662
  204    HA   PRO  28           HA       PRO  28  10.413   0.473   3.126
  205    HB2  PRO  28           2HB      PRO  28   8.890   1.919   4.967
  206    HB3  PRO  28           1HB      PRO  28  10.260   2.538   4.045
  207    HG2  PRO  28           2HG      PRO  28   7.335   2.788   3.512
  208    HG3  PRO  28           1HG      PRO  28   8.627   3.974   3.250
  209    HD2  PRO  28           2HD      PRO  28   7.580   2.634   1.210
  210    HD3  PRO  28           1HD      PRO  28   9.326   2.950   1.279
  211    H    PHE  29           H        PHE  29   6.912   0.279   3.346
  212    HA   PHE  29           HA       PHE  29   6.592  -2.204   4.416
  213    HB2  PHE  29           2HB      PHE  29   7.838  -1.205   6.391
  214    HB3  PHE  29           1HB      PHE  29   6.522  -0.050   6.546
  215    HD1  PHE  29           2HD      PHE  29   6.865  -3.666   6.107
  216    HD2  PHE  29           1HD      PHE  29   5.101  -0.493   8.224
  217    HE1  PHE  29           2HE      PHE  29   5.674  -5.324   7.543
  218    HE2  PHE  29           1HE      PHE  29   3.887  -2.090   9.680
  219    HZ   PHE  29           HZ       PHE  29   4.182  -4.516   9.333
  220    H    VAL  30           H        VAL  30   5.836   1.121   4.227
  221    HA   VAL  30           HA       VAL  30   3.016   0.585   3.757
  222    HB   VAL  30           HB       VAL  30   2.565   2.862   4.794
  223   HG11  VAL  30          1HG1      VAL  30   3.800   0.831   6.646
  224   HG12  VAL  30          2HG1      VAL  30   2.132   0.834   6.074
  225   HG13  VAL  30          3HG1      VAL  30   2.707   2.132   7.119
  226   HG21  VAL  30          3HG2      VAL  30   4.253   3.790   6.307
  227   HG22  VAL  30          1HG2      VAL  30   4.803   3.795   4.629
  228   HG23  VAL  30          2HG2      VAL  30   5.408   2.578   5.753
  229    H    CYS  31           H        CYS  31   2.288   3.012   2.898
  230    HA   CYS  31           HA       CYS  31   3.764   3.360   0.433
  231    HB2  CYS  31           2HB      CYS  31   1.199   4.437   1.540
  232    HB3  CYS  31           1HB      CYS  31   1.842   4.915  -0.048
  233    H    VAL  32           H        VAL  32   4.167   5.531  -0.266
  234    HA   VAL  32           HA       VAL  32   4.679   7.541   1.599
  235    HB   VAL  32           HB       VAL  32   6.542   6.050   2.221
  236   HG11  VAL  32          1HG1      VAL  32   8.364   5.558   0.642
  237   HG12  VAL  32          2HG1      VAL  32   7.419   6.290  -0.656
  238   HG13  VAL  32          3HG1      VAL  32   6.834   4.833   0.143
  239   HG21  VAL  32          3HG2      VAL  32   7.423   8.526   0.737
  240   HG22  VAL  32          1HG2      VAL  32   8.396   7.632   1.914
  241   HG23  VAL  32          2HG2      VAL  32   6.905   8.408   2.423
  Start of MODEL    2
    1    H1   ARG   1           H        ARG   1 -10.348  10.192  -3.594
    2    HA   ARG   1           HA       ARG   1 -11.823   8.420  -5.201
    3    HB2  ARG   1           2HB      ARG   1  -9.485   8.486  -6.335
    4    HB3  ARG   1           1HB      ARG   1  -8.891   7.755  -4.854
    5    HG2  ARG   1           2HG      ARG   1 -10.600   5.909  -5.259
    6    HG3  ARG   1           1HG      ARG   1 -10.785   6.585  -6.875
    7    HD2  ARG   1           2HD      ARG   1  -9.178   4.911  -7.174
    8    HD3  ARG   1           1HD      ARG   1  -8.221   6.383  -7.011
    9    HE   ARG   1           HE       ARG   1  -8.728   4.809  -4.622
   10   HH11  ARG   1          1HH1      ARG   1  -6.378   5.730  -7.132
   11   HH12  ARG   1          2HH1      ARG   1  -5.018   5.109  -6.331
   12   HH21  ARG   1          1HH2      ARG   1  -6.819   3.900  -3.510
   13   HH22  ARG   1          2HH2      ARG   1  -5.266   4.081  -4.203
   14    H    ASP   2           H        ASP   2 -12.079   6.437  -3.915
   15    HA   ASP   2           HA       ASP   2 -11.626   6.733  -1.148
   16    HB2  ASP   2           2HB      ASP   2 -13.471   5.345  -1.993
   17    HB3  ASP   2           1HB      ASP   2 -12.315   4.269  -2.771
   18    H    CYS   3           H        CYS   3  -9.724   6.706  -0.383
   19    HA   CYS   3           HA       CYS   3  -7.894   4.575  -0.889
   20    HB2  CYS   3           2HB      CYS   3  -6.074   6.034  -1.630
   21    HB3  CYS   3           1HB      CYS   3  -7.382   5.967  -2.802
   22    H    GLN   4           H        GLN   4  -5.850   5.043   0.376
   23    HA   GLN   4           HA       GLN   4  -6.616   6.451   2.836
   24    HB2  GLN   4           2HB      GLN   4  -5.569   4.750   4.107
   25    HB3  GLN   4           1HB      GLN   4  -6.623   3.968   2.928
   26    HG2  GLN   4           2HG      GLN   4  -4.794   3.381   1.552
   27    HG3  GLN   4           1HG      GLN   4  -3.663   4.269   2.581
   28   HE21  GLN   4          1HE2      GLN   4  -3.594   1.578   1.828
   29   HE22  GLN   4          2HE2      GLN   4  -3.714   0.601   3.242
   30    H    GLU   5           H        GLU   5  -4.788   6.994   4.110
   31    HA   GLU   5           HA       GLU   5  -3.057   8.653   2.709
   32    HB2  GLU   5           2HB      GLU   5  -3.242   7.752   5.527
   33    HB3  GLU   5           1HB      GLU   5  -2.015   8.919   5.015
   34    HG2  GLU   5           2HG      GLU   5  -4.803   9.139   4.338
   35    HG3  GLU   5           1HG      GLU   5  -4.307   9.808   5.920
   36    H    LYS   6           H        LYS   6  -0.782   8.683   3.165
   37    HA   LYS   6           HA       LYS   6   0.221   6.295   1.948
   38    HB2  LYS   6           2HB      LYS   6   2.092   7.448   1.203
   39    HB3  LYS   6           1HB      LYS   6   0.861   8.681   1.283
   40    HG2  LYS   6           2HG      LYS   6   1.956   9.164   3.593
   41    HG3  LYS   6           1HG      LYS   6   3.327   8.352   2.911
   42    HD2  LYS   6           2HD      LYS   6   2.938   9.932   0.808
   43    HD3  LYS   6           1HD      LYS   6   1.972  10.832   2.000
   44    HE2  LYS   6           2HE      LYS   6   3.820  11.141   3.364
   45    HE3  LYS   6           1HE      LYS   6   4.867  10.195   2.299
   46    HZ1  LYS   6           3HZ      LYS   6   5.176  12.536   1.902
   47    HZ2  LYS   6           1HZ      LYS   6   3.540  12.786   1.667
   48    HZ3  LYS   6           2HZ      LYS   6   4.437  11.893   0.555
   49    H    TRP   7           H        TRP   7   0.906   7.920   4.970
   50    HA   TRP   7           HA       TRP   7   2.860   5.950   5.719
   51    HB2  TRP   7           2HB      TRP   7   1.598   8.175   7.299
   52    HB3  TRP   7           1HB      TRP   7   2.935   7.181   7.863
   53    HD1  TRP   7           HD       TRP   7   2.213  10.288   5.967
   54    HE1  TRP   7           1HE      TRP   7   4.355  11.229   4.959
   55    HE3  TRP   7           3HE      TRP   7   5.274   6.265   6.630
   56    HZ2  TRP   7           2HZ      TRP   7   7.001  10.411   4.490
   57    HZ3  TRP   7           3HZ      TRP   7   7.605   6.432   5.834
   58    HH2  TRP   7           HH       TRP   7   8.437   8.460   4.799
   59    H    GLU   8           H        GLU   8   0.044   5.112   5.289
   60    HA   GLU   8           HA       GLU   8  -0.862   4.188   7.882
   61    HB2  GLU   8           2HB      GLU   8  -1.922   3.768   5.096
   62    HB3  GLU   8           1HB      GLU   8  -2.665   3.105   6.541
   63    HG2  GLU   8           2HG      GLU   8  -2.267   6.014   5.939
   64    HG3  GLU   8           1HG      GLU   8  -3.778   5.107   5.792
   65    H    TYR   9           H        TYR   9  -1.692   1.729   7.628
   66    HA   TYR   9           HA       TYR   9   0.709   0.260   7.835
   67    HB2  TYR   9           2HB      TYR   9  -2.124  -0.806   7.766
   68    HB3  TYR   9           1HB      TYR   9  -0.702  -1.704   8.276
   69    HD1  TYR   9           1HD      TYR   9   0.665  -0.638  10.236
   70    HD2  TYR   9           2HD      TYR   9  -3.384   0.307   9.371
   71    HE1  TYR   9           1HE      TYR   9   0.365   0.177  12.529
   72    HE2  TYR   9           2HE      TYR   9  -3.690   1.129  11.654
   73    HH   TYR   9           HH       TYR   9  -2.675   0.845  13.861
   74    H    CYS  10           H        CYS  10  -1.530   0.659   5.242
   75    HA   CYS  10           HA       CYS  10  -1.318   0.352   3.019
   76    HB2  CYS  10           2HB      CYS  10   1.046   0.978   3.241
   77    HB3  CYS  10           1HB      CYS  10   1.481  -0.681   3.626
   78    H    ILE  11           H        ILE  11  -1.688  -2.013   5.112
   79    HA   ILE  11           HA       ILE  11  -1.486  -4.138   3.153
   80    HB   ILE  11           HB       ILE  11  -2.028  -5.669   5.168
   81   HG12  ILE  11          2HG1      ILE  11  -1.074  -4.777   7.339
   82   HG13  ILE  11          1HG1      ILE  11  -1.075  -3.179   6.621
   83   HG21  ILE  11          1HG2      ILE  11   0.063  -5.670   3.979
   84   HG22  ILE  11          2HG2      ILE  11   0.334  -5.845   5.709
   85   HG23  ILE  11          3HG2      ILE  11   0.628  -4.292   4.926
   86   HD11  ILE  11          3HD1      ILE  11  -2.964  -3.464   8.102
   87   HD12  ILE  11          1HD1      ILE  11  -3.494  -4.882   7.195
   88   HD13  ILE  11          2HD1      ILE  11  -3.523  -3.290   6.439
   89    H    VAL  12           H        VAL  12  -3.067  -5.610   2.705
   90    HA   VAL  12           HA       VAL  12  -5.783  -4.887   3.500
   91    HB   VAL  12           HB       VAL  12  -4.957  -5.775   0.703
   92   HG11  VAL  12          1HG1      VAL  12  -7.683  -4.962   1.721
   93   HG12  VAL  12          2HG1      VAL  12  -7.157  -6.594   1.328
   94   HG13  VAL  12          3HG1      VAL  12  -7.273  -5.380   0.059
   95   HG21  VAL  12          3HG2      VAL  12  -4.297  -3.451   1.086
   96   HG22  VAL  12          1HG2      VAL  12  -5.938  -3.059   1.601
   97   HG23  VAL  12          2HG2      VAL  12  -5.627  -3.538  -0.069
   98    HA   PRO  13           HA       PRO  13  -5.062  -9.372   4.161
   99    HB2  PRO  13           2HB      PRO  13  -5.592  -9.506   6.752
  100    HB3  PRO  13           1HB      PRO  13  -4.048  -8.873   6.182
  101    HG2  PRO  13           2HG      PRO  13  -6.410  -7.396   7.256
  102    HG3  PRO  13           1HG      PRO  13  -4.689  -7.031   7.437
  103    HD2  PRO  13           2HD      PRO  13  -6.464  -5.851   5.594
  104    HD3  PRO  13           1HD      PRO  13  -4.695  -5.733   5.563
  105    H    ILE  14           H        ILE  14  -7.651  -7.263   4.609
  106    HA   ILE  14           HA       ILE  14  -9.640  -9.380   4.479
  107    HB   ILE  14           HB       ILE  14  -9.729  -6.988   6.370
  108   HG12  ILE  14          2HG1      ILE  14  -9.628  -9.943   7.033
  109   HG13  ILE  14          1HG1      ILE  14  -8.291  -8.815   7.198
  110   HG21  ILE  14          1HG2      ILE  14 -11.940  -7.463   5.440
  111   HG22  ILE  14          2HG2      ILE  14 -11.879  -7.846   7.159
  112   HG23  ILE  14          3HG2      ILE  14 -11.811  -9.143   5.969
  113   HD11  ILE  14          3HD1      ILE  14  -9.349  -9.281   9.330
  114   HD12  ILE  14          1HD1      ILE  14 -10.891  -8.700   8.702
  115   HD13  ILE  14          2HD1      ILE  14  -9.537  -7.584   8.884
  116    H    LEU  15           H        LEU  15 -11.305  -8.735   3.141
  117    HA   LEU  15           HA       LEU  15 -10.820  -6.590   1.382
  118    HB2  LEU  15           2HB      LEU  15 -12.120  -8.664   0.831
  119    HB3  LEU  15           1HB      LEU  15 -13.407  -8.085   1.866
  120    HG   LEU  15           HG       LEU  15 -13.704  -6.146   0.369
  121   HD11  LEU  15          1HD1      LEU  15 -11.678  -7.552  -1.366
  122   HD12  LEU  15          2HD1      LEU  15 -11.466  -5.995  -0.563
  123   HD13  LEU  15          3HD1      LEU  15 -12.657  -6.168  -1.847
  124   HD21  LEU  15          3HD2      LEU  15 -13.882  -8.840  -0.974
  125   HD22  LEU  15          1HD2      LEU  15 -14.747  -7.387  -1.470
  126   HD23  LEU  15          2HD2      LEU  15 -15.090  -8.125   0.093
  127    H    GLY  16           H        GLY  16 -11.590  -4.525   1.418
  128    HA2  GLY  16           2HA      GLY  16 -13.297  -2.967   2.267
  129    HA3  GLY  16           1HA      GLY  16 -13.072  -3.734   3.838
  130    H    PHE  17           H        PHE  17 -10.139  -3.899   2.785
  131    HA   PHE  17           HA       PHE  17  -9.350  -1.228   3.663
  132    HB2  PHE  17           2HB      PHE  17  -7.777  -3.804   3.290
  133    HB3  PHE  17           1HB      PHE  17  -7.001  -2.258   3.605
  134    HD1  PHE  17           2HD      PHE  17  -9.348  -4.769   5.018
  135    HD2  PHE  17           1HD      PHE  17  -6.798  -1.449   5.791
  136    HE1  PHE  17           2HE      PHE  17  -9.594  -5.139   7.442
  137    HE2  PHE  17           1HE      PHE  17  -7.040  -1.819   8.203
  138    HZ   PHE  17           HZ       PHE  17  -8.442  -3.666   9.030
  139    H    VAL  18           H        VAL  18  -7.980   0.029   2.271
  140    HA   VAL  18           HA       VAL  18  -8.350  -0.769  -0.529
  141    HB   VAL  18           HB       VAL  18  -9.930   0.999   0.246
  142   HG11  VAL  18          1HG1      VAL  18  -7.466   2.675   0.587
  143   HG12  VAL  18          2HG1      VAL  18  -8.556   2.128   1.855
  144   HG13  VAL  18          3HG1      VAL  18  -9.125   3.274   0.637
  145   HG21  VAL  18          3HG2      VAL  18  -7.968   1.882  -1.872
  146   HG22  VAL  18          1HG2      VAL  18  -9.581   2.554  -1.639
  147   HG23  VAL  18          2HG2      VAL  18  -9.389   0.869  -2.118
  148    H    TYR  19           H        TYR  19  -6.842   0.116  -2.000
  149    HA   TYR  19           HA       TYR  19  -4.140   0.202  -1.213
  150    HB2  TYR  19           2HB      TYR  19  -5.483   1.216  -3.735
  151    HB3  TYR  19           1HB      TYR  19  -3.755   0.979  -3.542
  152    HD1  TYR  19           1HD      TYR  19  -2.828  -1.295  -3.433
  153    HD2  TYR  19           2HD      TYR  19  -6.969  -0.643  -4.133
  154    HE1  TYR  19           1HE      TYR  19  -3.050  -3.590  -4.232
  155    HE2  TYR  19           2HE      TYR  19  -7.205  -2.941  -4.918
  156    HH   TYR  19           HH       TYR  19  -4.961  -5.305  -4.401
  157    H    CYS  20           H        CYS  20  -2.741   2.043  -1.139
  158    HA   CYS  20           HA       CYS  20  -3.938   4.307   0.019
  159    HB2  CYS  20           2HB      CYS  20  -1.621   5.285   0.044
  160    HB3  CYS  20           1HB      CYS  20  -1.743   3.714   0.809
  161    H    CYS  21           H        CYS  21  -3.702   6.439  -0.622
  162    HA   CYS  21           HA       CYS  21  -4.960   7.043  -3.015
  163    HB2  CYS  21           2HB      CYS  21  -3.262   8.802  -1.264
  164    HB3  CYS  21           1HB      CYS  21  -4.269   9.408  -2.590
  165    HA   PRO  22           HA       PRO  22  -2.204   6.942  -6.354
  166    HB2  PRO  22           2HB      PRO  22  -2.968   9.160  -7.801
  167    HB3  PRO  22           1HB      PRO  22  -3.824   7.616  -7.803
  168    HG2  PRO  22           2HG      PRO  22  -4.448  10.113  -6.304
  169    HG3  PRO  22           1HG      PRO  22  -5.547   8.962  -7.077
  170    HD2  PRO  22           2HD      PRO  22  -5.121   9.004  -4.407
  171    HD3  PRO  22           1HD      PRO  22  -5.493   7.510  -5.280
  172    H    GLY  23           H        GLY  23  -0.233   7.568  -6.843
  173    HA2  GLY  23           2HA      GLY  23   1.513   9.149  -7.151
  174    HA3  GLY  23           1HA      GLY  23   0.693  10.230  -6.028
  175    H    LEU  24           H        LEU  24   0.466   7.286  -4.699
  176    HA   LEU  24           HA       LEU  24   2.914   7.708  -3.128
  177    HB2  LEU  24           2HB      LEU  24   0.584   6.093  -2.135
  178    HB3  LEU  24           1HB      LEU  24   1.865   6.864  -1.292
  179    HG   LEU  24           HG       LEU  24  -0.219   8.517  -2.673
  180   HD11  LEU  24          1HD1      LEU  24  -1.376   7.219  -1.105
  181   HD12  LEU  24          2HD1      LEU  24  -1.117   8.800  -0.329
  182   HD13  LEU  24          3HD1      LEU  24  -0.090   7.404   0.069
  183   HD21  LEU  24          3HD2      LEU  24   1.799   9.116  -0.515
  184   HD22  LEU  24          1HD2      LEU  24   0.610  10.257  -1.133
  185   HD23  LEU  24          2HD2      LEU  24   1.892   9.660  -2.189
  186    H    ILE  25           H        ILE  25   4.011   5.903  -2.514
  187    HA   ILE  25           HA       ILE  25   3.399   3.400  -3.927
  188    HB   ILE  25           HB       ILE  25   5.843   3.033  -4.332
  189   HG12  ILE  25          2HG1      ILE  25   6.114   5.972  -3.619
  190   HG13  ILE  25          1HG1      ILE  25   6.704   4.635  -2.643
  191   HG21  ILE  25          1HG2      ILE  25   4.425   3.763  -6.154
  192   HG22  ILE  25          2HG2      ILE  25   6.023   4.491  -6.298
  193   HG23  ILE  25          3HG2      ILE  25   4.669   5.449  -5.698
  194   HD11  ILE  25          3HD1      ILE  25   8.250   4.021  -4.441
  195   HD12  ILE  25          1HD1      ILE  25   8.501   5.678  -3.890
  196   HD13  ILE  25          2HD1      ILE  25   7.652   5.371  -5.406
  197    H    CYS  26           H        CYS  26   3.701   1.580  -2.743
  198    HA   CYS  26           HA       CYS  26   4.309   1.948   0.069
  199    HB2  CYS  26           2HB      CYS  26   2.406   0.543  -0.974
  200    HB3  CYS  26           1HB      CYS  26   3.653  -0.661  -1.295
  201    H    GLY  27           H        GLY  27   6.377   2.273   0.316
  202    HA2  GLY  27           2HA      GLY  27   8.365   0.961  -1.288
  203    HA3  GLY  27           1HA      GLY  27   8.680   2.071   0.032
  204    HA   PRO  28           HA       PRO  28   9.724  -1.543   2.314
  205    HB2  PRO  28           2HB      PRO  28   9.293  -0.350   4.891
  206    HB3  PRO  28           1HB      PRO  28  10.819  -0.537   4.036
  207    HG2  PRO  28           2HG      PRO  28   9.599   1.904   4.526
  208    HG3  PRO  28           1HG      PRO  28  10.796   1.598   3.260
  209    HD2  PRO  28           2HD      PRO  28   7.820   1.767   3.050
  210    HD3  PRO  28           1HD      PRO  28   9.073   2.341   1.928
  211    H    PHE  29           H        PHE  29   7.431  -0.138   4.604
  212    HA   PHE  29           HA       PHE  29   5.680  -2.445   4.111
  213    HB2  PHE  29           2HB      PHE  29   6.239  -1.060   6.741
  214    HB3  PHE  29           1HB      PHE  29   5.059  -2.339   6.514
  215    HD1  PHE  29           2HD      PHE  29   8.653  -1.562   6.684
  216    HD2  PHE  29           1HD      PHE  29   5.741  -4.640   6.313
  217    HE1  PHE  29           2HE      PHE  29  10.383  -3.245   7.144
  218    HE2  PHE  29           1HE      PHE  29   7.466  -6.332   6.774
  219    HZ   PHE  29           HZ       PHE  29   9.792  -5.636   7.189
  220    H    VAL  30           H        VAL  30   5.996   0.958   4.293
  221    HA   VAL  30           HA       VAL  30   3.076   1.263   4.269
  222    HB   VAL  30           HB       VAL  30   3.344   3.476   5.256
  223   HG11  VAL  30          1HG1      VAL  30   3.058   1.647   6.803
  224   HG12  VAL  30          2HG1      VAL  30   4.119   2.871   7.503
  225   HG13  VAL  30          3HG1      VAL  30   4.801   1.379   6.852
  226   HG21  VAL  30          3HG2      VAL  30   5.503   4.104   4.352
  227   HG22  VAL  30          1HG2      VAL  30   6.292   2.858   5.321
  228   HG23  VAL  30          2HG2      VAL  30   5.534   4.237   6.113
  229    H    CYS  31           H        CYS  31   2.451   3.365   3.169
  230    HA   CYS  31           HA       CYS  31   3.831   3.636   0.609
  231    HB2  CYS  31           2HB      CYS  31   1.223   4.684   1.686
  232    HB3  CYS  31           1HB      CYS  31   1.844   5.108   0.087
  233    H    VAL  32           H        VAL  32   4.296   5.680  -0.173
  234    HA   VAL  32           HA       VAL  32   4.490   7.917   1.505
  235    HB   VAL  32           HB       VAL  32   6.416   6.757   2.440
  236   HG11  VAL  32          1HG1      VAL  32   8.359   6.101   1.059
  237   HG12  VAL  32          2HG1      VAL  32   7.469   6.557  -0.394
  238   HG13  VAL  32          3HG1      VAL  32   6.904   5.215   0.601
  239   HG21  VAL  32          3HG2      VAL  32   6.651   9.150   2.203
  240   HG22  VAL  32          1HG2      VAL  32   7.283   8.959   0.564
  241   HG23  VAL  32          2HG2      VAL  32   8.205   8.370   1.951
  Start of MODEL    3
    1    H1   ARG   1           H        ARG   1 -11.978  10.784   0.938
    2    HA   ARG   1           HA       ARG   1 -11.740  10.482  -1.857
    3    HB2  ARG   1           2HB      ARG   1  -9.267  10.373  -0.136
    4    HB3  ARG   1           1HB      ARG   1  -9.374   9.834  -1.801
    5    HG2  ARG   1           2HG      ARG   1  -9.771  12.097  -2.547
    6    HG3  ARG   1           1HG      ARG   1  -9.781  12.666  -0.873
    7    HD2  ARG   1           2HD      ARG   1  -7.473  11.350  -2.281
    8    HD3  ARG   1           1HD      ARG   1  -7.609  13.078  -1.926
    9    HE   ARG   1           HE       ARG   1  -7.954  11.574   0.399
   10   HH11  ARG   1          1HH1      ARG   1  -5.331  12.365  -1.847
   11   HH12  ARG   1          2HH1      ARG   1  -4.114  12.444  -0.665
   12   HH21  ARG   1          1HH2      ARG   1  -6.278  11.635   2.052
   13   HH22  ARG   1          2HH2      ARG   1  -4.666  11.982   1.631
   14    H    ASP   2           H        ASP   2 -11.101   8.239  -2.250
   15    HA   ASP   2           HA       ASP   2 -11.651   6.577   0.092
   16    HB2  ASP   2           2HB      ASP   2 -13.521   6.390  -1.533
   17    HB3  ASP   2           1HB      ASP   2 -12.377   5.792  -2.738
   18    H    CYS   3           H        CYS   3  -9.578   6.570   0.558
   19    HA   CYS   3           HA       CYS   3  -8.007   4.486  -0.360
   20    HB2  CYS   3           2HB      CYS   3  -6.151   5.845  -1.332
   21    HB3  CYS   3           1HB      CYS   3  -7.588   5.854  -2.347
   22    H    GLN   4           H        GLN   4  -5.740   4.919   0.654
   23    HA   GLN   4           HA       GLN   4  -6.204   6.374   3.160
   24    HB2  GLN   4           2HB      GLN   4  -5.083   4.612   4.324
   25    HB3  GLN   4           1HB      GLN   4  -6.210   3.906   3.172
   26    HG2  GLN   4           2HG      GLN   4  -4.553   3.371   1.649
   27    HG3  GLN   4           1HG      GLN   4  -3.299   4.141   2.625
   28   HE21  GLN   4          1HE2      GLN   4  -3.585   1.421   1.718
   29   HE22  GLN   4          2HE2      GLN   4  -3.570   0.455   3.179
   30    H    GLU   5           H        GLU   5  -4.405   7.199   4.069
   31    HA   GLU   5           HA       GLU   5  -2.857   8.677   2.234
   32    HB2  GLU   5           2HB      GLU   5  -2.627   8.320   5.184
   33    HB3  GLU   5           1HB      GLU   5  -1.772   9.579   4.265
   34    HG2  GLU   5           2HG      GLU   5  -4.057  10.374   3.569
   35    HG3  GLU   5           1HG      GLU   5  -4.702   9.220   4.727
   36    H    LYS   6           H        LYS   6  -0.337   8.829   3.129
   37    HA   LYS   6           HA       LYS   6   0.637   6.452   1.877
   38    HB2  LYS   6           2HB      LYS   6   2.845   7.574   1.835
   39    HB3  LYS   6           1HB      LYS   6   1.565   8.579   1.177
   40    HG2  LYS   6           2HG      LYS   6   1.408   9.428   3.546
   41    HG3  LYS   6           1HG      LYS   6   3.066   8.883   3.728
   42    HD2  LYS   6           2HD      LYS   6   2.092  10.806   1.596
   43    HD3  LYS   6           1HD      LYS   6   2.826  11.323   3.106
   44    HE2  LYS   6           2HE      LYS   6   4.904  10.153   2.435
   45    HE3  LYS   6           1HE      LYS   6   4.118   9.698   0.921
   46    HZ1  LYS   6           3HZ      LYS   6   3.891  12.005   0.335
   47    HZ2  LYS   6           1HZ      LYS   6   5.498  11.688   0.670
   48    HZ3  LYS   6           2HZ      LYS   6   4.546  12.516   1.790
   49    H    TRP   7           H        TRP   7   1.178   7.855   5.087
   50    HA   TRP   7           HA       TRP   7   2.877   5.622   5.808
   51    HB2  TRP   7           2HB      TRP   7   1.914   7.943   7.488
   52    HB3  TRP   7           1HB      TRP   7   3.164   6.792   7.949
   53    HD1  TRP   7           HD       TRP   7   2.705  10.062   6.295
   54    HE1  TRP   7           1HE      TRP   7   4.899  10.860   5.214
   55    HE3  TRP   7           3HE      TRP   7   5.379   5.724   6.537
   56    HZ2  TRP   7           2HZ      TRP   7   7.398   9.818   4.550
   57    HZ3  TRP   7           3HZ      TRP   7   7.673   5.718   5.640
   58    HH2  TRP   7           HH       TRP   7   8.646   7.736   4.662
   59    H    GLU   8           H        GLU   8   0.111   5.078   5.206
   60    HA   GLU   8           HA       GLU   8  -1.204   4.515   7.725
   61    HB2  GLU   8           2HB      GLU   8  -2.033   3.980   4.879
   62    HB3  GLU   8           1HB      GLU   8  -3.027   3.679   6.294
   63    HG2  GLU   8           2HG      GLU   8  -1.998   6.340   5.427
   64    HG3  GLU   8           1HG      GLU   8  -3.611   5.674   5.145
   65    H    TYR   9           H        TYR   9  -2.480   2.133   6.546
   66    HA   TYR   9           HA       TYR   9  -0.704   0.248   7.710
   67    HB2  TYR   9           2HB      TYR   9  -3.331  -0.251   6.313
   68    HB3  TYR   9           1HB      TYR   9  -2.555  -1.271   7.522
   69    HD1  TYR   9           2HD      TYR   9  -2.077  -0.043   9.839
   70    HD2  TYR   9           1HD      TYR   9  -5.012   1.202   7.016
   71    HE1  TYR   9           2HE      TYR   9  -3.227   1.203  11.590
   72    HE2  TYR   9           1HE      TYR   9  -6.155   2.467   8.758
   73    HH   TYR   9           HH       TYR   9  -6.324   2.428  11.247
   74    H    CYS  10           H        CYS  10  -1.632   1.220   4.526
   75    HA   CYS  10           HA       CYS  10  -1.145   0.615   2.428
   76    HB2  CYS  10           2HB      CYS  10   1.176   1.008   3.004
   77    HB3  CYS  10           1HB      CYS  10   1.338  -0.618   3.672
   78    H    ILE  11           H        ILE  11  -2.561  -0.665   1.561
   79    HA   ILE  11           HA       ILE  11  -2.676  -3.452   2.449
   80    HB   ILE  11           HB       ILE  11  -4.696  -1.805   0.881
   81   HG12  ILE  11          2HG1      ILE  11  -4.807  -2.749   3.757
   82   HG13  ILE  11          1HG1      ILE  11  -4.426  -1.108   3.260
   83   HG21  ILE  11          1HG2      ILE  11  -4.844  -4.169   0.315
   84   HG22  ILE  11          2HG2      ILE  11  -6.237  -3.693   1.292
   85   HG23  ILE  11          3HG2      ILE  11  -4.907  -4.590   2.026
   86   HD11  ILE  11          3HD1      ILE  11  -7.028  -2.547   2.795
   87   HD12  ILE  11          1HD1      ILE  11  -6.662  -0.900   2.281
   88   HD13  ILE  11          2HD1      ILE  11  -6.727  -1.293   3.999
   89    H    VAL  12           H        VAL  12  -2.103  -5.023   1.034
   90    HA   VAL  12           HA       VAL  12  -1.432  -4.210  -1.705
   91    HB   VAL  12           HB       VAL  12  -0.541  -6.707  -0.235
   92   HG11  VAL  12          1HG1      VAL  12   1.188  -6.845  -1.966
   93   HG12  VAL  12          2HG1      VAL  12   0.491  -5.434  -2.760
   94   HG13  VAL  12          3HG1      VAL  12  -0.441  -6.926  -2.638
   95   HG21  VAL  12          3HG2      VAL  12   0.347  -4.770   0.941
   96   HG22  VAL  12          1HG2      VAL  12   0.988  -4.121  -0.566
   97   HG23  VAL  12          2HG2      VAL  12   1.640  -5.618   0.096
   98    HA   PRO  13           HA       PRO  13  -5.168  -6.806  -2.306
   99    HB2  PRO  13           2HB      PRO  13  -5.577  -5.294  -4.747
  100    HB3  PRO  13           1HB      PRO  13  -6.583  -5.345  -3.300
  101    HG2  PRO  13           2HG      PRO  13  -5.166  -3.146  -4.050
  102    HG3  PRO  13           1HG      PRO  13  -5.552  -3.525  -2.363
  103    HD2  PRO  13           2HD      PRO  13  -3.003  -3.967  -3.867
  104    HD3  PRO  13           1HD      PRO  13  -3.257  -3.382  -2.207
  105    H    ILE  14           H        ILE  14  -2.605  -5.994  -4.559
  106    HA   ILE  14           HA       ILE  14  -2.793  -8.630  -5.807
  107    HB   ILE  14           HB       ILE  14  -2.492  -6.030  -7.386
  108   HG12  ILE  14          2HG1      ILE  14  -4.822  -7.965  -7.438
  109   HG13  ILE  14          1HG1      ILE  14  -4.837  -6.391  -6.655
  110   HG21  ILE  14          1HG2      ILE  14  -2.628  -8.871  -8.376
  111   HG22  ILE  14          2HG2      ILE  14  -1.199  -7.840  -8.346
  112   HG23  ILE  14          3HG2      ILE  14  -2.561  -7.429  -9.388
  113   HD11  ILE  14          3HD1      ILE  14  -4.478  -6.888  -9.601
  114   HD12  ILE  14          1HD1      ILE  14  -4.515  -5.309  -8.814
  115   HD13  ILE  14          2HD1      ILE  14  -5.953  -6.333  -8.809
  116    H    LEU  15           H        LEU  15  -0.674  -9.362  -6.246
  117    HA   LEU  15           HA       LEU  15   1.421  -8.084  -4.913
  118    HB2  LEU  15           2HB      LEU  15   2.962  -9.665  -5.949
  119    HB3  LEU  15           1HB      LEU  15   1.528 -10.491  -5.401
  120    HG   LEU  15           HG       LEU  15   2.077  -9.785  -8.299
  121   HD11  LEU  15          1HD1      LEU  15   2.482 -12.389  -6.840
  122   HD12  LEU  15          2HD1      LEU  15   3.750 -11.339  -7.472
  123   HD13  LEU  15          3HD1      LEU  15   2.642 -12.148  -8.579
  124   HD21  LEU  15          3HD2      LEU  15   0.052 -11.651  -7.043
  125   HD22  LEU  15          1HD2      LEU  15   0.340 -11.467  -8.774
  126   HD23  LEU  15          2HD2      LEU  15  -0.297 -10.117  -7.844
  127    H    GLY  16           H        GLY  16   2.541  -6.366  -5.364
  128    HA2  GLY  16           2HA      GLY  16   3.900  -5.016  -6.712
  129    HA3  GLY  16           1HA      GLY  16   3.084  -5.648  -8.134
  130    H    PHE  17           H        PHE  17   0.605  -5.054  -6.137
  131    HA   PHE  17           HA       PHE  17   0.424  -2.226  -6.865
  132    HB2  PHE  17           2HB      PHE  17  -1.012  -3.496  -8.415
  133    HB3  PHE  17           1HB      PHE  17  -1.772  -4.297  -7.043
  134    HD1  PHE  17           1HD      PHE  17  -1.263  -0.941  -8.551
  135    HD2  PHE  17           2HD      PHE  17  -3.698  -3.408  -6.084
  136    HE1  PHE  17           1HE      PHE  17  -2.946   0.843  -8.432
  137    HE2  PHE  17           2HE      PHE  17  -5.388  -1.626  -5.964
  138    HZ   PHE  17           HZ       PHE  17  -5.011   0.506  -7.136
  139    H    VAL  18           H        VAL  18  -0.247  -0.930  -5.262
  140    HA   VAL  18           HA       VAL  18  -1.182  -2.243  -2.838
  141    HB   VAL  18           HB       VAL  18  -0.007  -0.523  -1.514
  142   HG11  VAL  18          1HG1      VAL  18   2.245  -1.420  -1.797
  143   HG12  VAL  18          2HG1      VAL  18   1.812  -2.021  -3.395
  144   HG13  VAL  18          3HG1      VAL  18   1.040  -2.697  -1.965
  145   HG21  VAL  18          3HG2      VAL  18   0.076   1.263  -3.191
  146   HG22  VAL  18          1HG2      VAL  18   1.177   0.303  -4.172
  147   HG23  VAL  18          2HG2      VAL  18   1.703   0.916  -2.608
  148    H    TYR  19           H        TYR  19  -2.692  -1.121  -1.650
  149    HA   TYR  19           HA       TYR  19  -4.034   0.902  -3.256
  150    HB2  TYR  19           2HB      TYR  19  -5.286  -1.224  -2.671
  151    HB3  TYR  19           1HB      TYR  19  -5.275  -0.669  -1.001
  152    HD1  TYR  19           1HD      TYR  19  -6.346   0.292  -4.423
  153    HD2  TYR  19           2HD      TYR  19  -6.966   0.826  -0.243
  154    HE1  TYR  19           1HE      TYR  19  -8.371   1.570  -4.896
  155    HE2  TYR  19           2HE      TYR  19  -8.997   2.119  -0.711
  156    HH   TYR  19           HH       TYR  19 -10.093   3.387  -2.534
  157    H    CYS  20           H        CYS  20  -3.392   2.704  -2.705
  158    HA   CYS  20           HA       CYS  20  -3.889   3.821  -0.102
  159    HB2  CYS  20           2HB      CYS  20  -1.182   3.994  -1.538
  160    HB3  CYS  20           1HB      CYS  20  -1.674   5.072  -0.246
  161    H    CYS  21           H        CYS  21  -3.468   6.290  -0.580
  162    HA   CYS  21           HA       CYS  21  -5.029   6.966  -2.797
  163    HB2  CYS  21           2HB      CYS  21  -3.185   8.629  -1.097
  164    HB3  CYS  21           1HB      CYS  21  -4.270   9.313  -2.323
  165    HA   PRO  22           HA       PRO  22  -2.400   6.831  -6.242
  166    HB2  PRO  22           2HB      PRO  22  -3.188   9.080  -7.622
  167    HB3  PRO  22           1HB      PRO  22  -4.091   7.561  -7.596
  168    HG2  PRO  22           2HG      PRO  22  -4.528  10.056  -6.022
  169    HG3  PRO  22           1HG      PRO  22  -5.720   8.975  -6.766
  170    HD2  PRO  22           2HD      PRO  22  -5.150   8.935  -4.123
  171    HD3  PRO  22           1HD      PRO  22  -5.614   7.471  -5.007
  172    H    GLY  23           H        GLY  23  -0.443   7.522  -6.901
  173    HA2  GLY  23           2HA      GLY  23   1.297   9.067  -7.228
  174    HA3  GLY  23           1HA      GLY  23   0.488  10.170  -6.118
  175    H    LEU  24           H        LEU  24   0.517   7.092  -4.852
  176    HA   LEU  24           HA       LEU  24   2.932   7.721  -3.294
  177    HB2  LEU  24           2HB      LEU  24   0.661   6.023  -2.239
  178    HB3  LEU  24           1HB      LEU  24   1.992   6.733  -1.419
  179    HG   LEU  24           HG       LEU  24  -0.132   8.454  -2.643
  180   HD11  LEU  24          1HD1      LEU  24  -1.170   7.117  -0.974
  181   HD12  LEU  24          2HD1      LEU  24  -0.939   8.747  -0.335
  182   HD13  LEU  24          3HD1      LEU  24   0.145   7.432   0.155
  183   HD21  LEU  24          3HD2      LEU  24   1.945   9.601  -2.353
  184   HD22  LEU  24          1HD2      LEU  24   2.118   8.989  -0.706
  185   HD23  LEU  24          2HD2      LEU  24   0.829  10.126  -1.094
  186    H    ILE  25           H        ILE  25   4.085   5.903  -2.549
  187    HA   ILE  25           HA       ILE  25   3.595   3.413  -4.008
  188    HB   ILE  25           HB       ILE  25   6.073   3.104  -4.230
  189   HG12  ILE  25          2HG1      ILE  25   6.214   6.058  -3.546
  190   HG13  ILE  25          1HG1      ILE  25   6.777   4.748  -2.519
  191   HG21  ILE  25          1HG2      ILE  25   6.355   4.543  -6.207
  192   HG22  ILE  25          2HG2      ILE  25   4.920   5.451  -5.727
  193   HG23  ILE  25          3HG2      ILE  25   4.779   3.749  -6.165
  194   HD11  ILE  25          3HD1      ILE  25   8.623   5.840  -3.660
  195   HD12  ILE  25          1HD1      ILE  25   7.888   5.480  -5.221
  196   HD13  ILE  25          2HD1      ILE  25   8.462   4.167  -4.193
  197    H    CYS  26           H        CYS  26   4.060   1.563  -2.817
  198    HA   CYS  26           HA       CYS  26   4.522   2.062   0.029
  199    HB2  CYS  26           2HB      CYS  26   2.642   0.563  -0.942
  200    HB3  CYS  26           1HB      CYS  26   3.946  -0.614  -1.187
  201    H    GLY  27           H        GLY  27   6.497   2.442   0.330
  202    HA2  GLY  27           2HA      GLY  27   8.586   1.138  -1.131
  203    HA3  GLY  27           1HA      GLY  27   8.801   2.300   0.164
  204    HA   PRO  28           HA       PRO  28  10.021  -1.060   2.660
  205    HB2  PRO  28           2HB      PRO  28   9.011   0.082   5.112
  206    HB3  PRO  28           1HB      PRO  28  10.674   0.033   4.535
  207    HG2  PRO  28           2HG      PRO  28   9.191   2.338   4.741
  208    HG3  PRO  28           1HG      PRO  28  10.557   2.128   3.635
  209    HD2  PRO  28           2HD      PRO  28   7.625   2.005   3.079
  210    HD3  PRO  28           1HD      PRO  28   8.936   2.663   2.087
  211    H    PHE  29           H        PHE  29   7.240  -0.089   4.623
  212    HA   PHE  29           HA       PHE  29   5.865  -2.550   3.801
  213    HB2  PHE  29           2HB      PHE  29   7.093  -2.745   6.019
  214    HB3  PHE  29           1HB      PHE  29   6.024  -1.499   6.637
  215    HD1  PHE  29           2HD      PHE  29   6.134  -4.894   5.256
  216    HD2  PHE  29           1HD      PHE  29   3.893  -2.056   7.458
  217    HE1  PHE  29           2HE      PHE  29   4.539  -6.663   5.887
  218    HE2  PHE  29           1HE      PHE  29   2.288  -3.818   8.100
  219    HZ   PHE  29           HZ       PHE  29   2.615  -6.123   7.311
  220    H    VAL  30           H        VAL  30   5.870   0.752   4.021
  221    HA   VAL  30           HA       VAL  30   2.976   0.928   4.019
  222    HB   VAL  30           HB       VAL  30   3.092   3.076   5.260
  223   HG11  VAL  30          1HG1      VAL  30   3.545   2.157   7.503
  224   HG12  VAL  30          2HG1      VAL  30   4.240   0.718   6.745
  225   HG13  VAL  30          3HG1      VAL  30   2.535   1.108   6.514
  226   HG21  VAL  30          3HG2      VAL  30   5.365   3.753   4.781
  227   HG22  VAL  30          1HG2      VAL  30   5.996   2.357   5.660
  228   HG23  VAL  30          2HG2      VAL  30   5.148   3.630   6.530
  229    H    CYS  31           H        CYS  31   2.308   3.080   3.071
  230    HA   CYS  31           HA       CYS  31   3.779   3.559   0.637
  231    HB2  CYS  31           2HB      CYS  31   1.134   4.585   1.692
  232    HB3  CYS  31           1HB      CYS  31   1.833   5.075   0.138
  233    H    VAL  32           H        VAL  32   3.969   5.848  -0.056
  234    HA   VAL  32           HA       VAL  32   4.755   7.872   1.637
  235    HB   VAL  32           HB       VAL  32   6.513   6.355   2.446
  236   HG11  VAL  32          1HG1      VAL  32   6.659   4.831   0.541
  237   HG12  VAL  32          2HG1      VAL  32   8.252   5.460   0.953
  238   HG13  VAL  32          3HG1      VAL  32   7.383   6.106  -0.441
  239   HG21  VAL  32          3HG2      VAL  32   7.098   8.701   2.251
  240   HG22  VAL  32          1HG2      VAL  32   7.632   8.450   0.591
  241   HG23  VAL  32          2HG2      VAL  32   8.507   7.693   1.919
  Start of MODEL    4
    1    H1   ARG   1           H        ARG   1  -9.438  10.448  -2.537
    2    HA   ARG   1           HA       ARG   1 -11.833   9.844  -3.617
    3    HB2  ARG   1           2HB      ARG   1 -11.399   7.619  -4.561
    4    HB3  ARG   1           1HB      ARG   1 -10.685   8.895  -5.549
    5    HG2  ARG   1           2HG      ARG   1  -8.500   8.351  -4.728
    6    HG3  ARG   1           1HG      ARG   1  -9.177   7.237  -3.542
    7    HD2  ARG   1           2HD      ARG   1  -9.368   6.931  -6.535
    8    HD3  ARG   1           1HD      ARG   1  -8.232   6.072  -5.493
    9    HE   ARG   1           HE       ARG   1 -10.902   5.688  -4.626
   10   HH11  ARG   1          1HH1      ARG   1  -8.663   4.624  -7.176
   11   HH12  ARG   1          2HH1      ARG   1  -9.439   3.134  -7.399
   12   HH21  ARG   1          1HH2      ARG   1 -11.933   3.658  -4.935
   13   HH22  ARG   1          2HH2      ARG   1 -11.356   2.568  -6.116
   14    H    ASP   2           H        ASP   2 -12.297   7.367  -2.772
   15    HA   ASP   2           HA       ASP   2 -11.517   7.505  -0.018
   16    HB2  ASP   2           2HB      ASP   2 -13.826   6.825  -0.594
   17    HB3  ASP   2           1HB      ASP   2 -13.189   5.384  -1.386
   18    H    CYS   3           H        CYS   3  -9.424   7.252  -0.119
   19    HA   CYS   3           HA       CYS   3  -8.440   4.512  -0.253
   20    HB2  CYS   3           2HB      CYS   3  -6.377   5.427  -1.398
   21    HB3  CYS   3           1HB      CYS   3  -7.819   5.367  -2.408
   22    H    GLN   4           H        GLN   4  -5.935   4.809   0.549
   23    HA   GLN   4           HA       GLN   4  -6.303   6.272   3.065
   24    HB2  GLN   4           2HB      GLN   4  -5.168   4.514   4.218
   25    HB3  GLN   4           1HB      GLN   4  -6.293   3.774   3.097
   26    HG2  GLN   4           2HG      GLN   4  -4.643   3.264   1.555
   27    HG3  GLN   4           1HG      GLN   4  -3.394   4.082   2.494
   28   HE21  GLN   4          1HE2      GLN   4  -3.553   1.331   1.609
   29   HE22  GLN   4          2HE2      GLN   4  -3.486   0.361   3.019
   30    H    GLU   5           H        GLU   5  -4.408   7.097   3.997
   31    HA   GLU   5           HA       GLU   5  -2.864   8.487   2.096
   32    HB2  GLU   5           2HB      GLU   5  -2.875   8.392   5.069
   33    HB3  GLU   5           1HB      GLU   5  -1.819   9.465   4.143
   34    HG2  GLU   5           2HG      GLU   5  -4.687   9.263   3.754
   35    HG3  GLU   5           1HG      GLU   5  -4.061  10.426   4.939
   36    H    LYS   6           H        LYS   6  -0.580   8.832   2.990
   37    HA   LYS   6           HA       LYS   6   0.756   6.549   1.971
   38    HB2  LYS   6           2HB      LYS   6   2.855   7.879   2.169
   39    HB3  LYS   6           1HB      LYS   6   1.561   8.680   1.287
   40    HG2  LYS   6           2HG      LYS   6   0.977   9.766   3.417
   41    HG3  LYS   6           1HG      LYS   6   2.532   9.261   4.062
   42    HD2  LYS   6           2HD      LYS   6   2.124  10.974   1.599
   43    HD3  LYS   6           1HD      LYS   6   2.503  11.623   3.185
   44    HE2  LYS   6           2HE      LYS   6   4.636  10.254   3.088
   45    HE3  LYS   6           1HE      LYS   6   4.213   9.895   1.412
   46    HZ1  LYS   6           3HZ      LYS   6   4.242  12.274   0.930
   47    HZ2  LYS   6           1HZ      LYS   6   5.732  11.765   1.533
   48    HZ3  LYS   6           2HZ      LYS   6   4.675  12.603   2.528
   49    H    TRP   7           H        TRP   7   0.910   8.088   5.161
   50    HA   TRP   7           HA       TRP   7   2.694   6.005   6.058
   51    HB2  TRP   7           2HB      TRP   7   1.546   8.374   7.494
   52    HB3  TRP   7           1HB      TRP   7   2.722   7.263   8.211
   53    HD1  TRP   7           HD       TRP   7   2.578  10.454   6.445
   54    HE1  TRP   7           1HE      TRP   7   4.849  11.093   5.431
   55    HE3  TRP   7           3HE      TRP   7   4.943   5.943   6.834
   56    HZ2  TRP   7           2HZ      TRP   7   7.312   9.857   4.874
   57    HZ3  TRP   7           3HZ      TRP   7   7.270   5.772   6.009
   58    HH2  TRP   7           HH       TRP   7   8.408   7.685   5.063
   59    H    GLU   8           H        GLU   8  -0.008   5.301   5.339
   60    HA   GLU   8           HA       GLU   8  -1.211   4.378   7.812
   61    HB2  GLU   8           2HB      GLU   8  -1.964   4.036   4.917
   62    HB3  GLU   8           1HB      GLU   8  -2.850   3.307   6.249
   63    HG2  GLU   8           2HG      GLU   8  -2.445   6.245   5.788
   64    HG3  GLU   8           1HG      GLU   8  -3.910   5.306   5.473
   65    H    TYR   9           H        TYR   9  -1.990   1.878   7.331
   66    HA   TYR   9           HA       TYR   9   0.330   0.348   7.662
   67    HB2  TYR   9           2HB      TYR   9  -2.486  -0.479   6.992
   68    HB3  TYR   9           1HB      TYR   9  -1.195  -1.631   7.297
   69    HD1  TYR   9           1HD      TYR   9  -0.158  -1.731   9.527
   70    HD2  TYR   9           2HD      TYR   9  -3.606   0.636   8.788
   71    HE1  TYR   9           1HE      TYR   9  -0.597  -1.648  11.928
   72    HE2  TYR   9           2HE      TYR   9  -4.064   0.733  11.185
   73    HH   TYR   9           HH       TYR   9  -3.545  -0.551  13.217
   74    H    CYS  10           H        CYS  10  -1.672   0.920   4.862
   75    HA   CYS  10           HA       CYS  10  -1.552   0.433   2.688
   76    HB2  CYS  10           2HB      CYS  10   0.720   1.451   2.679
   77    HB3  CYS  10           1HB      CYS  10   1.408  -0.099   3.155
   78    H    ILE  11           H        ILE  11   0.871  -1.916   3.734
   79    HA   ILE  11           HA       ILE  11  -0.882  -3.999   2.684
   80    HB   ILE  11           HB       ILE  11   2.078  -4.102   3.394
   81   HG12  ILE  11          2HG1      ILE  11   0.789  -3.951   0.661
   82   HG13  ILE  11          1HG1      ILE  11   1.585  -2.609   1.471
   83   HG21  ILE  11          1HG2      ILE  11   0.343  -6.089   1.910
   84   HG22  ILE  11          2HG2      ILE  11   0.990  -6.293   3.538
   85   HG23  ILE  11          3HG2      ILE  11   2.084  -6.229   2.154
   86   HD11  ILE  11          3HD1      ILE  11   3.693  -3.832   1.419
   87   HD12  ILE  11          1HD1      ILE  11   3.025  -3.619  -0.199
   88   HD13  ILE  11          2HD1      ILE  11   2.890  -5.180   0.614
   89    H    VAL  12           H        VAL  12  -1.473  -5.655   4.058
   90    HA   VAL  12           HA       VAL  12  -0.395  -5.557   6.744
   91    HB   VAL  12           HB       VAL  12  -2.593  -6.337   7.673
   92   HG11  VAL  12          1HG1      VAL  12  -3.762  -4.190   7.580
   93   HG12  VAL  12          2HG1      VAL  12  -2.701  -3.682   6.264
   94   HG13  VAL  12          3HG1      VAL  12  -2.032  -4.003   7.864
   95   HG21  VAL  12          3HG2      VAL  12  -3.731  -5.582   4.992
   96   HG22  VAL  12          1HG2      VAL  12  -4.643  -6.122   6.392
   97   HG23  VAL  12          2HG2      VAL  12  -3.549  -7.242   5.569
   98    HA   PRO  13           HA       PRO  13   0.602  -9.744   6.003
   99    HB2  PRO  13           2HB      PRO  13  -0.190 -10.621   8.674
  100    HB3  PRO  13           1HB      PRO  13   1.431 -10.457   7.993
  101    HG2  PRO  13           2HG      PRO  13   0.515  -8.809   9.922
  102    HG3  PRO  13           1HG      PRO  13   1.630  -8.258   8.660
  103    HD2  PRO  13           2HD      PRO  13  -1.336  -7.909   8.850
  104    HD3  PRO  13           1HD      PRO  13  -0.091  -6.729   8.386
  105    H    ILE  14           H        ILE  14  -2.537  -8.973   6.667
  106    HA   ILE  14           HA       ILE  14  -3.529 -11.704   6.232
  107    HB   ILE  14           HB       ILE  14  -4.943  -9.266   7.380
  108   HG12  ILE  14          2HG1      ILE  14  -3.366 -10.190   8.968
  109   HG13  ILE  14          1HG1      ILE  14  -5.008 -10.555   9.485
  110   HG21  ILE  14          1HG2      ILE  14  -6.516 -10.670   6.134
  111   HG22  ILE  14          2HG2      ILE  14  -6.837 -10.708   7.868
  112   HG23  ILE  14          3HG2      ILE  14  -6.019 -12.065   7.097
  113   HD11  ILE  14          3HD1      ILE  14  -4.741 -12.843   8.586
  114   HD12  ILE  14          1HD1      ILE  14  -3.573 -12.459   9.852
  115   HD13  ILE  14          2HD1      ILE  14  -3.074 -12.451   8.166
  116    H    LEU  15           H        LEU  15  -4.935 -12.027   4.468
  117    HA   LEU  15           HA       LEU  15  -4.595 -10.308   2.259
  118    HB2  LEU  15           2HB      LEU  15  -6.596 -12.522   2.688
  119    HB3  LEU  15           1HB      LEU  15  -6.321 -11.718   1.158
  120    HG   LEU  15           HG       LEU  15  -4.315 -13.410   2.651
  121   HD11  LEU  15          1HD1      LEU  15  -5.839 -13.926   0.106
  122   HD12  LEU  15          2HD1      LEU  15  -6.104 -14.719   1.659
  123   HD13  LEU  15          3HD1      LEU  15  -4.588 -14.964   0.792
  124   HD21  LEU  15          3HD2      LEU  15  -2.944 -13.170   0.619
  125   HD22  LEU  15          1HD2      LEU  15  -3.194 -11.626   1.431
  126   HD23  LEU  15          2HD2      LEU  15  -4.113 -12.017  -0.020
  127    H    GLY  16           H        GLY  16  -5.939  -8.897   1.268
  128    HA2  GLY  16           2HA      GLY  16  -8.027  -7.793   1.018
  129    HA3  GLY  16           1HA      GLY  16  -8.381  -8.144   2.707
  130    H    PHE  17           H        PHE  17  -5.334  -6.845   1.449
  131    HA   PHE  17           HA       PHE  17  -5.661  -4.675   3.312
  132    HB2  PHE  17           2HB      PHE  17  -3.359  -4.048   2.926
  133    HB3  PHE  17           1HB      PHE  17  -3.429  -5.790   3.069
  134    HD1  PHE  17           2HD      PHE  17  -2.840  -2.980   0.802
  135    HD2  PHE  17           1HD      PHE  17  -2.806  -7.205   1.229
  136    HE1  PHE  17           2HE      PHE  17  -1.527  -3.170  -1.248
  137    HE2  PHE  17           1HE      PHE  17  -1.473  -7.404  -0.814
  138    HZ   PHE  17           HZ       PHE  17  -0.830  -5.385  -2.061
  139    H    VAL  18           H        VAL  18  -5.011  -2.433   2.585
  140    HA   VAL  18           HA       VAL  18  -6.778  -1.810   0.326
  141    HB   VAL  18           HB       VAL  18  -5.883  -0.021   2.613
  142   HG11  VAL  18          1HG1      VAL  18  -7.740   1.432   1.957
  143   HG12  VAL  18          2HG1      VAL  18  -8.095   0.351   0.609
  144   HG13  VAL  18          3HG1      VAL  18  -6.568   1.231   0.650
  145   HG21  VAL  18          3HG2      VAL  18  -8.128  -0.341   3.575
  146   HG22  VAL  18          1HG2      VAL  18  -7.203  -1.843   3.516
  147   HG23  VAL  18          2HG2      VAL  18  -8.468  -1.543   2.328
  148    H    TYR  19           H        TYR  19  -5.995  -0.347  -1.265
  149    HA   TYR  19           HA       TYR  19  -3.122  -0.020  -1.260
  150    HB2  TYR  19           2HB      TYR  19  -5.200   0.622  -3.369
  151    HB3  TYR  19           1HB      TYR  19  -3.471   0.890  -3.560
  152    HD1  TYR  19           2HD      TYR  19  -1.965  -1.210  -3.191
  153    HD2  TYR  19           1HD      TYR  19  -6.110  -1.389  -4.092
  154    HE1  TYR  19           2HE      TYR  19  -1.685  -3.493  -3.984
  155    HE2  TYR  19           1HE      TYR  19  -5.845  -3.688  -4.891
  156    HH   TYR  19           HH       TYR  19  -3.161  -5.536  -4.237
  157    H    CYS  20           H        CYS  20  -2.132   1.992  -1.272
  158    HA   CYS  20           HA       CYS  20  -3.710   3.993   0.046
  159    HB2  CYS  20           2HB      CYS  20  -1.590   5.272   0.155
  160    HB3  CYS  20           1HB      CYS  20  -1.446   3.660   0.836
  161    H    CYS  21           H        CYS  21  -3.652   6.186  -0.686
  162    HA   CYS  21           HA       CYS  21  -4.927   6.556  -3.059
  163    HB2  CYS  21           2HB      CYS  21  -3.324   8.437  -1.384
  164    HB3  CYS  21           1HB      CYS  21  -4.373   8.968  -2.720
  165    HA   PRO  22           HA       PRO  22  -2.085   6.498  -6.362
  166    HB2  PRO  22           2HB      PRO  22  -3.101   8.523  -7.940
  167    HB3  PRO  22           1HB      PRO  22  -3.774   6.892  -7.858
  168    HG2  PRO  22           2HG      PRO  22  -4.687   9.388  -6.507
  169    HG3  PRO  22           1HG      PRO  22  -5.645   8.063  -7.189
  170    HD2  PRO  22           2HD      PRO  22  -5.151   8.352  -4.505
  171    HD3  PRO  22           1HD      PRO  22  -5.424   6.774  -5.272
  172    H    GLY  23           H        GLY  23  -0.124   7.289  -6.674
  173    HA2  GLY  23           2HA      GLY  23   1.409   9.093  -7.059
  174    HA3  GLY  23           1HA      GLY  23   0.411  10.107  -6.019
  175    H    LEU  24           H        LEU  24   0.579   7.115  -4.650
  176    HA   LEU  24           HA       LEU  24   2.880   7.915  -3.002
  177    HB2  LEU  24           2HB      LEU  24   0.704   6.082  -2.038
  178    HB3  LEU  24           1HB      LEU  24   1.924   6.912  -1.170
  179    HG   LEU  24           HG       LEU  24  -0.250   8.428  -2.556
  180   HD11  LEU  24          1HD1      LEU  24  -0.020   7.439   0.238
  181   HD12  LEU  24          2HD1      LEU  24  -1.286   7.073  -0.967
  182   HD13  LEU  24          3HD1      LEU  24  -1.163   8.690  -0.274
  183   HD21  LEU  24          3HD2      LEU  24   1.691   9.757  -2.180
  184   HD22  LEU  24          1HD2      LEU  24   1.856   9.163  -0.530
  185   HD23  LEU  24          2HD2      LEU  24   0.495  10.196  -0.960
  186    H    ILE  25           H        ILE  25   4.214   6.355  -2.397
  187    HA   ILE  25           HA       ILE  25   4.039   3.907  -4.002
  188    HB   ILE  25           HB       ILE  25   6.539   3.772  -3.876
  189   HG12  ILE  25          2HG1      ILE  25   6.328   6.608  -2.807
  190   HG13  ILE  25          1HG1      ILE  25   6.879   5.210  -1.897
  191   HG21  ILE  25          1HG2      ILE  25   5.464   4.598  -5.869
  192   HG22  ILE  25          2HG2      ILE  25   6.957   5.493  -5.587
  193   HG23  ILE  25          3HG2      ILE  25   5.402   6.226  -5.199
  194   HD11  ILE  25          3HD1      ILE  25   8.240   6.396  -4.309
  195   HD12  ILE  25          1HD1      ILE  25   8.804   5.001  -3.389
  196   HD13  ILE  25          2HD1      ILE  25   8.742   6.592  -2.628
  197    H    CYS  26           H        CYS  26   4.047   2.029  -2.988
  198    HA   CYS  26           HA       CYS  26   4.246   2.126  -0.082
  199    HB2  CYS  26           2HB      CYS  26   2.272   1.080  -1.277
  200    HB3  CYS  26           1HB      CYS  26   3.353  -0.217  -1.792
  201    H    GLY  27           H        GLY  27   6.316   2.284   0.248
  202    HA2  GLY  27           2HA      GLY  27   8.249   0.758  -1.267
  203    HA3  GLY  27           1HA      GLY  27   8.578   1.957  -0.031
  204    HA   PRO  28           HA       PRO  28   9.886  -1.138   2.691
  205    HB2  PRO  28           2HB      PRO  28   8.921  -0.185   5.103
  206    HB3  PRO  28           1HB      PRO  28  10.391   0.395   4.316
  207    HG2  PRO  28           2HG      PRO  28   7.652   1.579   4.324
  208    HG3  PRO  28           1HG      PRO  28   9.225   2.392   4.413
  209    HD2  PRO  28           2HD      PRO  28   7.782   2.313   2.145
  210    HD3  PRO  28           1HD      PRO  28   9.555   2.259   2.128
  211    H    PHE  29           H        PHE  29   6.588  -0.102   3.381
  212    HA   PHE  29           HA       PHE  29   5.406  -2.639   3.312
  213    HB2  PHE  29           2HB      PHE  29   6.755  -2.825   5.431
  214    HB3  PHE  29           1HB      PHE  29   5.896  -1.421   6.042
  215    HD1  PHE  29           2HD      PHE  29   5.583  -4.916   5.052
  216    HD2  PHE  29           1HD      PHE  29   3.780  -1.623   6.966
  217    HE1  PHE  29           2HE      PHE  29   3.878  -6.440   5.995
  218    HE2  PHE  29           1HE      PHE  29   2.051  -3.118   7.947
  219    HZ   PHE  29           HZ       PHE  29   2.106  -5.527   7.454
  220    H    VAL  30           H        VAL  30   5.651   0.648   4.459
  221    HA   VAL  30           HA       VAL  30   2.792   1.059   4.133
  222    HB   VAL  30           HB       VAL  30   3.123   3.143   5.371
  223   HG11  VAL  30          1HG1      VAL  30   3.712   2.250   7.551
  224   HG12  VAL  30          2HG1      VAL  30   4.372   0.796   6.785
  225   HG13  VAL  30          3HG1      VAL  30   2.647   1.173   6.655
  226   HG21  VAL  30          3HG2      VAL  30   5.388   3.693   4.633
  227   HG22  VAL  30          1HG2      VAL  30   6.033   2.350   5.581
  228   HG23  VAL  30          2HG2      VAL  30   5.273   3.723   6.391
  229    H    CYS  31           H        CYS  31   2.426   3.402   3.321
  230    HA   CYS  31           HA       CYS  31   3.920   3.722   0.840
  231    HB2  CYS  31           2HB      CYS  31   1.284   4.749   1.822
  232    HB3  CYS  31           1HB      CYS  31   2.034   5.325   0.317
  233    H    VAL  32           H        VAL  32   3.938   6.136   0.240
  234    HA   VAL  32           HA       VAL  32   4.752   8.057   1.969
  235    HB   VAL  32           HB       VAL  32   6.532   6.551   2.759
  236   HG11  VAL  32          1HG1      VAL  32   7.445   6.405  -0.119
  237   HG12  VAL  32          2HG1      VAL  32   6.730   5.086   0.808
  238   HG13  VAL  32          3HG1      VAL  32   8.307   5.733   1.266
  239   HG21  VAL  32          3HG2      VAL  32   8.495   7.924   2.310
  240   HG22  VAL  32          1HG2      VAL  32   7.068   8.902   2.633
  241   HG23  VAL  32          2HG2      VAL  32   7.648   8.712   0.972
  Start of MODEL    5
    1    H1   ARG   1           H        ARG   1 -12.677   7.554  -5.617
    2    HA   ARG   1           HA       ARG   1 -13.069   4.874  -5.186
    3    HB2  ARG   1           2HB      ARG   1 -10.144   5.638  -5.349
    4    HB3  ARG   1           1HB      ARG   1 -10.777   4.103  -4.798
    5    HG2  ARG   1           2HG      ARG   1 -11.614   3.643  -7.057
    6    HG3  ARG   1           1HG      ARG   1 -10.965   5.193  -7.601
    7    HD2  ARG   1           2HD      ARG   1  -9.395   3.474  -8.198
    8    HD3  ARG   1           1HD      ARG   1  -8.703   4.429  -6.893
    9    HE   ARG   1           HE       ARG   1 -10.110   2.091  -5.994
   10   HH11  ARG   1          1HH1      ARG   1  -6.953   3.319  -7.020
   11   HH12  ARG   1          2HH1      ARG   1  -6.077   1.980  -6.437
   12   HH21  ARG   1          1HH2      ARG   1  -8.891   0.249  -5.171
   13   HH22  ARG   1          2HH2      ARG   1  -7.193   0.201  -5.369
   14    H    ASP   2           H        ASP   2 -12.004   4.326  -3.006
   15    HA   ASP   2           HA       ASP   2 -11.754   6.689  -1.306
   16    HB2  ASP   2           2HB      ASP   2 -13.640   5.179  -0.641
   17    HB3  ASP   2           1HB      ASP   2 -12.524   3.820  -0.610
   18    H    CYS   3           H        CYS   3  -9.770   6.846  -0.421
   19    HA   CYS   3           HA       CYS   3  -8.027   4.520  -0.657
   20    HB2  CYS   3           2HB      CYS   3  -6.182   5.958  -1.488
   21    HB3  CYS   3           1HB      CYS   3  -7.517   5.803  -2.621
   22    H    GLN   4           H        GLN   4  -5.841   5.057   0.429
   23    HA   GLN   4           HA       GLN   4  -6.455   6.339   3.021
   24    HB2  GLN   4           2HB      GLN   4  -5.305   4.558   4.145
   25    HB3  GLN   4           1HB      GLN   4  -6.382   3.836   2.956
   26    HG2  GLN   4           2HG      GLN   4  -4.617   3.435   1.440
   27    HG3  GLN   4           1HG      GLN   4  -3.447   4.218   2.508
   28   HE21  GLN   4          1HE2      GLN   4  -3.455   1.597   1.416
   29   HE22  GLN   4          2HE2      GLN   4  -3.485   0.446   2.685
   30    H    GLU   5           H        GLU   5  -4.613   7.033   4.144
   31    HA   GLU   5           HA       GLU   5  -2.960   8.652   2.558
   32    HB2  GLU   5           2HB      GLU   5  -3.041   7.968   5.460
   33    HB3  GLU   5           1HB      GLU   5  -1.835   9.074   4.795
   34    HG2  GLU   5           2HG      GLU   5  -4.634   9.387   4.167
   35    HG3  GLU   5           1HG      GLU   5  -4.135   9.983   5.767
   36    H    LYS   6           H        LYS   6  -0.674   8.692   3.015
   37    HA   LYS   6           HA       LYS   6   0.375   6.315   1.907
   38    HB2  LYS   6           2HB      LYS   6   2.569   7.487   1.784
   39    HB3  LYS   6           1HB      LYS   6   1.246   8.439   1.131
   40    HG2  LYS   6           2HG      LYS   6   1.132   9.296   3.523
   41    HG3  LYS   6           1HG      LYS   6   2.821   8.843   3.595
   42    HD2  LYS   6           2HD      LYS   6   1.635  10.644   1.488
   43    HD3  LYS   6           1HD      LYS   6   2.400  11.244   2.949
   44    HE2  LYS   6           2HE      LYS   6   4.491  10.103   2.234
   45    HE3  LYS   6           1HE      LYS   6   3.676   9.640   0.739
   46    HZ1  LYS   6           3HZ      LYS   6   3.349  12.042   0.289
   47    HZ2  LYS   6           1HZ      LYS   6   4.968  11.590   0.368
   48    HZ3  LYS   6           2HZ      LYS   6   4.276  12.392   1.662
   49    H    TRP   7           H        TRP   7   0.889   7.874   5.020
   50    HA   TRP   7           HA       TRP   7   2.702   5.796   5.893
   51    HB2  TRP   7           2HB      TRP   7   1.573   8.139   7.436
   52    HB3  TRP   7           1HB      TRP   7   2.883   7.094   7.975
   53    HD1  TRP   7           HD       TRP   7   2.282  10.264   6.174
   54    HE1  TRP   7           1HE      TRP   7   4.436  11.120   5.062
   55    HE3  TRP   7           3HE      TRP   7   5.134   6.068   6.589
   56    HZ2  TRP   7           2HZ      TRP   7   6.985  10.155   4.439
   57    HZ3  TRP   7           3HZ      TRP   7   7.440   6.119   5.684
   58    HH2  TRP   7           HH       TRP   7   8.324   8.128   4.637
   59    H    GLU   8           H        GLU   8  -0.024   5.055   5.300
   60    HA   GLU   8           HA       GLU   8  -1.248   4.285   7.816
   61    HB2  GLU   8           2HB      GLU   8  -1.949   3.861   4.929
   62    HB3  GLU   8           1HB      GLU   8  -2.861   3.133   6.245
   63    HG2  GLU   8           2HG      GLU   8  -2.366   6.068   6.031
   64    HG3  GLU   8           1HG      GLU   8  -3.768   5.275   5.313
   65    H    TYR   9           H        TYR   9  -2.153   1.747   7.260
   66    HA   TYR   9           HA       TYR   9   0.182   0.201   7.774
   67    HB2  TYR   9           2HB      TYR   9  -2.688  -0.625   7.329
   68    HB3  TYR   9           1HB      TYR   9  -1.401  -1.741   7.773
   69    HD1  TYR   9           1HD      TYR   9  -0.275  -1.501   9.966
   70    HD2  TYR   9           2HD      TYR   9  -3.733   0.772   8.969
   71    HE1  TYR   9           1HE      TYR   9  -0.619  -1.008  12.324
   72    HE2  TYR   9           2HE      TYR   9  -4.086   1.280  11.334
   73    HH   TYR   9           HH       TYR   9  -3.499   0.302  13.500
   74    H    CYS  10           H        CYS  10  -1.478   1.096   4.976
   75    HA   CYS  10           HA       CYS  10  -1.240   0.729   2.810
   76    HB2  CYS  10           2HB      CYS  10   1.144   1.016   3.089
   77    HB3  CYS  10           1HB      CYS  10   1.349  -0.659   3.601
   78    H    ILE  11           H        ILE  11  -0.008  -2.393   4.027
   79    HA   ILE  11           HA       ILE  11  -2.347  -3.570   2.770
   80    HB   ILE  11           HB       ILE  11  -1.078  -5.635   2.255
   81   HG12  ILE  11          2HG1      ILE  11   0.895  -5.250   3.806
   82   HG13  ILE  11          1HG1      ILE  11   1.332  -5.778   2.194
   83   HG21  ILE  11          1HG2      ILE  11   0.022  -4.835   0.222
   84   HG22  ILE  11          2HG2      ILE  11  -0.157  -3.183   0.819
   85   HG23  ILE  11          3HG2      ILE  11  -1.587  -4.161   0.487
   86   HD11  ILE  11          3HD1      ILE  11   1.962  -3.466   1.639
   87   HD12  ILE  11          1HD1      ILE  11   2.864  -4.092   3.018
   88   HD13  ILE  11          2HD1      ILE  11   1.533  -2.967   3.274
   89    H    VAL  12           H        VAL  12  -3.451  -4.992   3.872
   90    HA   VAL  12           HA       VAL  12  -2.701  -5.311   6.673
   91    HB   VAL  12           HB       VAL  12  -5.145  -5.854   7.019
   92   HG11  VAL  12          1HG1      VAL  12  -5.940  -3.553   6.751
   93   HG12  VAL  12          2HG1      VAL  12  -4.556  -3.199   5.715
   94   HG13  VAL  12          3HG1      VAL  12  -4.307  -3.602   7.414
   95   HG21  VAL  12          3HG2      VAL  12  -5.653  -6.625   4.741
   96   HG22  VAL  12          1HG2      VAL  12  -5.396  -4.990   4.130
   97   HG23  VAL  12          2HG2      VAL  12  -6.734  -5.323   5.232
   98    HA   PRO  13           HA       PRO  13  -2.133  -9.673   6.142
   99    HB2  PRO  13           2HB      PRO  13  -2.713 -10.662   8.557
  100    HB3  PRO  13           1HB      PRO  13  -1.340  -9.572   8.321
  101    HG2  PRO  13           2HG      PRO  13  -4.089  -8.940   9.343
  102    HG3  PRO  13           1HG      PRO  13  -2.522  -8.448  10.007
  103    HD2  PRO  13           2HD      PRO  13  -4.028  -6.829   8.448
  104    HD3  PRO  13           1HD      PRO  13  -2.256  -6.764   8.461
  105    H    ILE  14           H        ILE  14  -5.092  -8.424   6.262
  106    HA   ILE  14           HA       ILE  14  -6.484 -10.995   6.026
  107    HB   ILE  14           HB       ILE  14  -8.535  -9.799   6.844
  108   HG12  ILE  14          2HG1      ILE  14  -6.546  -7.626   7.546
  109   HG13  ILE  14          1HG1      ILE  14  -7.831  -7.507   6.354
  110   HG21  ILE  14          1HG2      ILE  14  -7.929  -9.836   9.229
  111   HG22  ILE  14          2HG2      ILE  14  -6.224  -9.913   8.783
  112   HG23  ILE  14          3HG2      ILE  14  -7.308 -11.239   8.363
  113   HD11  ILE  14          3HD1      ILE  14  -8.425  -6.348   8.378
  114   HD12  ILE  14          1HD1      ILE  14  -8.165  -7.817   9.322
  115   HD13  ILE  14          2HD1      ILE  14  -9.478  -7.750   8.151
  116    H    LEU  15           H        LEU  15  -8.737 -10.397   4.829
  117    HA   LEU  15           HA       LEU  15  -7.829  -9.153   2.376
  118    HB2  LEU  15           2HB      LEU  15 -10.284 -10.796   2.970
  119    HB3  LEU  15           1HB      LEU  15 -10.023 -10.011   1.434
  120    HG   LEU  15           HG       LEU  15  -7.932 -11.419   1.181
  121   HD11  LEU  15          1HD1      LEU  15  -9.083 -12.940   3.508
  122   HD12  LEU  15          2HD1      LEU  15  -7.577 -12.024   3.501
  123   HD13  LEU  15          3HD1      LEU  15  -7.740 -13.460   2.487
  124   HD21  LEU  15          3HD2      LEU  15 -10.571 -12.852   1.392
  125   HD22  LEU  15          1HD2      LEU  15  -9.159 -13.420   0.504
  126   HD23  LEU  15          2HD2      LEU  15  -9.980 -11.944   0.001
  127    H    GLY  16           H        GLY  16  -9.737  -8.004   1.165
  128    HA2  GLY  16           2HA      GLY  16 -11.253  -6.239   1.177
  129    HA3  GLY  16           1HA      GLY  16 -11.184  -6.216   2.939
  130    H    PHE  17           H        PHE  17  -8.505  -6.205   0.716
  131    HA   PHE  17           HA       PHE  17  -6.964  -4.396   2.118
  132    HB2  PHE  17           2HB      PHE  17  -6.827  -5.056  -0.823
  133    HB3  PHE  17           1HB      PHE  17  -5.605  -4.180   0.075
  134    HD1  PHE  17           1HD      PHE  17  -7.267  -7.433  -0.312
  135    HD2  PHE  17           2HD      PHE  17  -4.027  -5.292   1.411
  136    HE1  PHE  17           1HE      PHE  17  -6.196  -9.547   0.276
  137    HE2  PHE  17           2HE      PHE  17  -2.942  -7.413   2.002
  138    HZ   PHE  17           HZ       PHE  17  -4.034  -9.546   1.426
  139    H    VAL  18           H        VAL  18  -6.764  -2.331   2.212
  140    HA   VAL  18           HA       VAL  18  -8.319  -0.665   0.419
  141    HB   VAL  18           HB       VAL  18  -7.978   1.138   2.141
  142   HG11  VAL  18          1HG1      VAL  18 -10.021  -0.206   2.200
  143   HG12  VAL  18          2HG1      VAL  18  -9.522   0.258   3.825
  144   HG13  VAL  18          3HG1      VAL  18  -9.224  -1.381   3.245
  145   HG21  VAL  18          3HG2      VAL  18  -7.153   0.552   4.377
  146   HG22  VAL  18          1HG2      VAL  18  -5.907   0.299   3.154
  147   HG23  VAL  18          2HG2      VAL  18  -6.785  -1.080   3.818
  148    H    TYR  19           H        TYR  19  -7.178   1.011  -0.624
  149    HA   TYR  19           HA       TYR  19  -4.319   0.407  -0.761
  150    HB2  TYR  19           2HB      TYR  19  -6.156   1.283  -2.993
  151    HB3  TYR  19           1HB      TYR  19  -4.431   0.963  -3.145
  152    HD1  TYR  19           2HD      TYR  19  -3.586  -1.365  -2.916
  153    HD2  TYR  19           1HD      TYR  19  -7.752  -0.525  -2.939
  154    HE1  TYR  19           2HE      TYR  19  -4.050  -3.724  -3.365
  155    HE2  TYR  19           1HE      TYR  19  -8.233  -2.885  -3.385
  156    HH   TYR  19           HH       TYR  19  -5.874  -5.339  -3.125
  157    H    CYS  20           H        CYS  20  -2.904   2.111  -1.194
  158    HA   CYS  20           HA       CYS  20  -3.607   4.509   0.171
  159    HB2  CYS  20           2HB      CYS  20  -1.129   3.898  -1.464
  160    HB3  CYS  20           1HB      CYS  20  -1.324   5.228  -0.333
  161    H    CYS  21           H        CYS  21  -3.724   6.561  -0.628
  162    HA   CYS  21           HA       CYS  21  -5.053   7.022  -3.013
  163    HB2  CYS  21           2HB      CYS  21  -3.418   8.884  -1.295
  164    HB3  CYS  21           1HB      CYS  21  -4.467   9.439  -2.607
  165    HA   PRO  22           HA       PRO  22  -2.230   6.885  -6.332
  166    HB2  PRO  22           2HB      PRO  22  -2.951   9.082  -7.810
  167    HB3  PRO  22           1HB      PRO  22  -3.857   7.563  -7.781
  168    HG2  PRO  22           2HG      PRO  22  -4.355  10.094  -6.272
  169    HG3  PRO  22           1HG      PRO  22  -5.514   9.029  -7.091
  170    HD2  PRO  22           2HD      PRO  22  -5.147   8.958  -4.416
  171    HD3  PRO  22           1HD      PRO  22  -5.505   7.482  -5.339
  172    H    GLY  23           H        GLY  23  -0.237   7.602  -6.936
  173    HA2  GLY  23           2HA      GLY  23   1.428   9.237  -7.221
  174    HA3  GLY  23           1HA      GLY  23   0.597  10.257  -6.056
  175    H    LEU  24           H        LEU  24   0.643   7.156  -4.919
  176    HA   LEU  24           HA       LEU  24   3.032   7.735  -3.305
  177    HB2  LEU  24           2HB      LEU  24   0.761   6.025  -2.273
  178    HB3  LEU  24           1HB      LEU  24   2.051   6.791  -1.451
  179    HG   LEU  24           HG       LEU  24  -0.068   8.463  -2.750
  180   HD11  LEU  24          1HD1      LEU  24  -0.964   8.740  -0.452
  181   HD12  LEU  24          2HD1      LEU  24   0.027   7.340   0.028
  182   HD13  LEU  24          3HD1      LEU  24  -1.227   7.178  -1.203
  183   HD21  LEU  24          3HD2      LEU  24   2.012   9.620  -2.318
  184   HD22  LEU  24          1HD2      LEU  24   2.023   9.036  -0.652
  185   HD23  LEU  24          2HD2      LEU  24   0.776  10.164  -1.183
  186    H    ILE  25           H        ILE  25   4.096   5.878  -2.541
  187    HA   ILE  25           HA       ILE  25   3.667   3.423  -4.082
  188    HB   ILE  25           HB       ILE  25   6.169   3.122  -4.131
  189   HG12  ILE  25          2HG1      ILE  25   6.207   6.072  -3.413
  190   HG13  ILE  25          1HG1      ILE  25   6.737   4.761  -2.371
  191   HG21  ILE  25          1HG2      ILE  25   6.550   4.571  -6.080
  192   HG22  ILE  25          2HG2      ILE  25   5.076   5.457  -5.688
  193   HG23  ILE  25          3HG2      ILE  25   4.986   3.757  -6.140
  194   HD11  ILE  25          3HD1      ILE  25   8.611   5.924  -3.391
  195   HD12  ILE  25          1HD1      ILE  25   7.982   5.550  -4.994
  196   HD13  ILE  25          2HD1      ILE  25   8.537   4.250  -3.938
  197    H    CYS  26           H        CYS  26   4.012   1.562  -2.907
  198    HA   CYS  26           HA       CYS  26   4.423   1.984  -0.035
  199    HB2  CYS  26           2HB      CYS  26   2.374   0.722  -0.966
  200    HB3  CYS  26           1HB      CYS  26   3.504  -0.559  -1.382
  201    H    GLY  27           H        GLY  27   6.536   2.254  -0.029
  202    HA2  GLY  27           2HA      GLY  27   8.326   0.590  -1.509
  203    HA3  GLY  27           1HA      GLY  27   8.787   1.850  -0.387
  204    HA   PRO  28           HA       PRO  28   9.845  -1.362   2.355
  205    HB2  PRO  28           2HB      PRO  28   9.409   0.068   4.794
  206    HB3  PRO  28           1HB      PRO  28  10.910  -0.085   3.894
  207    HG2  PRO  28           2HG      PRO  28   9.464   2.283   4.186
  208    HG3  PRO  28           1HG      PRO  28  10.705   1.979   2.965
  209    HD2  PRO  28           2HD      PRO  28   7.733   1.884   2.713
  210    HD3  PRO  28           1HD      PRO  28   8.951   2.408   1.536
  211    H    PHE  29           H        PHE  29   7.627   0.027   4.716
  212    HA   PHE  29           HA       PHE  29   6.017  -2.413   4.462
  213    HB2  PHE  29           2HB      PHE  29   6.433  -0.674   6.905
  214    HB3  PHE  29           1HB      PHE  29   5.437  -2.114   6.823
  215    HD1  PHE  29           2HD      PHE  29   6.663  -4.318   6.178
  216    HD2  PHE  29           1HD      PHE  29   8.639  -0.823   7.589
  217    HE1  PHE  29           2HE      PHE  29   8.593  -5.684   6.835
  218    HE2  PHE  29           1HE      PHE  29  10.576  -2.180   8.250
  219    HZ   PHE  29           HZ       PHE  29  10.559  -4.617   7.879
  220    H    VAL  30           H        VAL  30   6.037   1.000   4.285
  221    HA   VAL  30           HA       VAL  30   3.110   1.030   4.199
  222    HB   VAL  30           HB       VAL  30   3.083   3.211   5.285
  223   HG11  VAL  30          1HG1      VAL  30   2.916   1.296   6.747
  224   HG12  VAL  30          2HG1      VAL  30   3.799   2.595   7.548
  225   HG13  VAL  30          3HG1      VAL  30   4.672   1.212   6.883
  226   HG21  VAL  30          3HG2      VAL  30   5.180   4.096   6.347
  227   HG22  VAL  30          1HG2      VAL  30   5.168   4.160   4.577
  228   HG23  VAL  30          2HG2      VAL  30   6.072   2.904   5.399
  229    H    CYS  31           H        CYS  31   2.458   3.295   3.228
  230    HA   CYS  31           HA       CYS  31   3.862   3.610   0.692
  231    HB2  CYS  31           2HB      CYS  31   1.266   4.683   1.764
  232    HB3  CYS  31           1HB      CYS  31   1.910   5.056   0.153
  233    H    VAL  32           H        VAL  32   3.975   5.894  -0.028
  234    HA   VAL  32           HA       VAL  32   4.568   7.976   1.643
  235    HB   VAL  32           HB       VAL  32   6.456   6.662   2.493
  236   HG11  VAL  32          1HG1      VAL  32   6.705   5.068   0.642
  237   HG12  VAL  32          2HG1      VAL  32   8.249   5.835   1.009
  238   HG13  VAL  32          3HG1      VAL  32   7.318   6.355  -0.396
  239   HG21  VAL  32          3HG2      VAL  32   7.395   8.736   0.518
  240   HG22  VAL  32          1HG2      VAL  32   8.329   8.122   1.884
  241   HG23  VAL  32          2HG2      VAL  32   6.847   9.032   2.170
  Start of MODEL    6
    1    H1   ARG   1           H        ARG   1 -12.033   9.564  -4.796
    2    HA   ARG   1           HA       ARG   1 -12.514   6.867  -5.167
    3    HB2  ARG   1           2HB      ARG   1 -10.566   6.986  -6.706
    4    HB3  ARG   1           1HB      ARG   1  -9.630   7.654  -5.357
    5    HG2  ARG   1           2HG      ARG   1  -9.996   5.572  -4.128
    6    HG3  ARG   1           1HG      ARG   1 -10.800   4.909  -5.551
    7    HD2  ARG   1           2HD      ARG   1  -8.771   5.229  -6.854
    8    HD3  ARG   1           1HD      ARG   1  -7.960   5.912  -5.441
    9    HE   ARG   1           HE       ARG   1  -9.116   3.335  -5.064
   10   HH11  ARG   1          1HH1      ARG   1  -6.129   5.024  -6.036
   11   HH12  ARG   1          2HH1      ARG   1  -5.092   3.749  -5.643
   12   HH21  ARG   1          1HH2      ARG   1  -7.697   1.565  -4.549
   13   HH22  ARG   1          2HH2      ARG   1  -6.010   1.717  -4.797
   14    H    ASP   2           H        ASP   2 -12.479   5.985  -3.242
   15    HA   ASP   2           HA       ASP   2 -11.601   7.627  -1.015
   16    HB2  ASP   2           2HB      ASP   2 -13.858   6.560  -0.933
   17    HB3  ASP   2           1HB      ASP   2 -13.073   4.988  -0.934
   18    H    CYS   3           H        CYS   3  -9.502   7.464  -0.890
   19    HA   CYS   3           HA       CYS   3  -8.323   4.799  -0.739
   20    HB2  CYS   3           2HB      CYS   3  -6.241   5.966  -1.572
   21    HB3  CYS   3           1HB      CYS   3  -7.548   5.803  -2.739
   22    H    GLN   4           H        GLN   4  -5.991   5.180   0.349
   23    HA   GLN   4           HA       GLN   4  -6.611   6.537   2.900
   24    HB2  GLN   4           2HB      GLN   4  -5.656   4.729   4.090
   25    HB3  GLN   4           1HB      GLN   4  -6.607   4.015   2.791
   26    HG2  GLN   4           2HG      GLN   4  -4.692   3.585   1.485
   27    HG3  GLN   4           1HG      GLN   4  -3.626   4.338   2.672
   28   HE21  GLN   4          1HE2      GLN   4  -3.486   1.732   1.655
   29   HE22  GLN   4          2HE2      GLN   4  -3.741   0.602   2.926
   30    H    GLU   5           H        GLU   5  -4.751   7.013   4.138
   31    HA   GLU   5           HA       GLU   5  -2.999   8.689   2.779
   32    HB2  GLU   5           2HB      GLU   5  -3.237   7.705   5.569
   33    HB3  GLU   5           1HB      GLU   5  -1.940   8.792   5.087
   34    HG2  GLU   5           2HG      GLU   5  -4.701   9.236   4.396
   35    HG3  GLU   5           1HG      GLU   5  -4.155   9.830   5.984
   36    H    LYS   6           H        LYS   6  -0.735   8.648   3.238
   37    HA   LYS   6           HA       LYS   6   0.174   6.246   1.989
   38    HB2  LYS   6           2HB      LYS   6   2.101   7.353   1.284
   39    HB3  LYS   6           1HB      LYS   6   0.882   8.601   1.320
   40    HG2  LYS   6           2HG      LYS   6   1.885   9.108   3.641
   41    HG3  LYS   6           1HG      LYS   6   3.270   8.238   3.052
   42    HD2  LYS   6           2HD      LYS   6   3.005   9.799   0.903
   43    HD3  LYS   6           1HD      LYS   6   2.062  10.757   2.074
   44    HE2  LYS   6           2HE      LYS   6   3.868  10.895   3.510
   45    HE3  LYS   6           1HE      LYS   6   4.896   9.934   2.445
   46    HZ1  LYS   6           3HZ      LYS   6   3.732  12.603   1.881
   47    HZ2  LYS   6           1HZ      LYS   6   4.640  11.717   0.766
   48    HZ3  LYS   6           2HZ      LYS   6   5.349  12.266   2.201
   49    H    TRP   7           H        TRP   7   0.803   7.851   5.011
   50    HA   TRP   7           HA       TRP   7   2.700   5.860   5.820
   51    HB2  TRP   7           2HB      TRP   7   1.420   8.090   7.388
   52    HB3  TRP   7           1HB      TRP   7   2.726   7.066   7.978
   53    HD1  TRP   7           HD       TRP   7   2.113  10.190   6.049
   54    HE1  TRP   7           1HE      TRP   7   4.313  11.102   5.118
   55    HE3  TRP   7           3HE      TRP   7   5.076   6.125   6.826
   56    HZ2  TRP   7           2HZ      TRP   7   6.939  10.237   4.735
   57    HZ3  TRP   7           3HZ      TRP   7   7.426   6.245   6.093
   58    HH2  TRP   7           HH       TRP   7   8.330   8.259   5.088
   59    H    GLU   8           H        GLU   8  -0.075   4.948   5.262
   60    HA   GLU   8           HA       GLU   8  -1.020   4.029   7.843
   61    HB2  GLU   8           2HB      GLU   8  -2.016   3.608   5.026
   62    HB3  GLU   8           1HB      GLU   8  -2.736   2.826   6.424
   63    HG2  GLU   8           2HG      GLU   8  -2.520   5.802   6.046
   64    HG3  GLU   8           1HG      GLU   8  -3.943   4.815   5.684
   65    H    TYR   9           H        TYR   9  -1.747   1.481   7.470
   66    HA   TYR   9           HA       TYR   9   0.819   0.248   7.605
   67    HB2  TYR   9           2HB      TYR   9  -1.953  -0.864   7.982
   68    HB3  TYR   9           1HB      TYR   9  -0.524  -1.892   8.011
   69    HD1  TYR   9           1HD      TYR   9  -2.286   0.851   9.757
   70    HD2  TYR   9           2HD      TYR   9   0.969  -1.888   9.883
   71    HE1  TYR   9           1HE      TYR   9  -1.922   1.398  12.101
   72    HE2  TYR   9           2HE      TYR   9   1.340  -1.348  12.233
   73    HH   TYR   9           HH       TYR   9  -0.881   0.349  14.124
   74    H    CYS  10           H        CYS  10  -1.408   0.685   5.108
   75    HA   CYS  10           HA       CYS  10  -1.399   0.136   2.898
   76    HB2  CYS  10           2HB      CYS  10   0.958   0.879   3.017
   77    HB3  CYS  10           1HB      CYS  10   1.471  -0.733   3.491
   78    H    ILE  11           H        ILE  11  -2.382  -1.687   4.831
   79    HA   ILE  11           HA       ILE  11  -1.675  -4.309   3.706
   80    HB   ILE  11           HB       ILE  11  -2.767  -5.279   5.715
   81   HG12  ILE  11          2HG1      ILE  11  -2.862  -2.408   6.682
   82   HG13  ILE  11          1HG1      ILE  11  -4.260  -3.366   6.213
   83   HG21  ILE  11          1HG2      ILE  11  -0.494  -3.372   6.243
   84   HG22  ILE  11          2HG2      ILE  11  -0.364  -5.035   5.670
   85   HG23  ILE  11          3HG2      ILE  11  -0.963  -4.706   7.296
   86   HD11  ILE  11          3HD1      ILE  11  -4.044  -3.253   8.614
   87   HD12  ILE  11          1HD1      ILE  11  -2.413  -3.920   8.516
   88   HD13  ILE  11          2HD1      ILE  11  -3.797  -4.906   8.048
   89    H    VAL  12           H        VAL  12  -3.456  -5.858   3.532
   90    HA   VAL  12           HA       VAL  12  -6.036  -4.624   3.136
   91    HB   VAL  12           HB       VAL  12  -5.102  -4.738   0.890
   92   HG11  VAL  12          1HG1      VAL  12  -4.619  -7.672   1.344
   93   HG12  VAL  12          2HG1      VAL  12  -3.395  -6.415   1.158
   94   HG13  VAL  12          3HG1      VAL  12  -4.441  -6.836  -0.199
   95   HG21  VAL  12          3HG2      VAL  12  -6.771  -6.148  -0.253
   96   HG22  VAL  12          1HG2      VAL  12  -7.476  -5.195   1.055
   97   HG23  VAL  12          2HG2      VAL  12  -7.153  -6.912   1.291
   98    HA   PRO  13           HA       PRO  13  -6.437  -8.192   5.945
   99    HB2  PRO  13           2HB      PRO  13  -8.788  -6.674   6.847
  100    HB3  PRO  13           1HB      PRO  13  -7.408  -7.252   7.784
  101    HG2  PRO  13           2HG      PRO  13  -7.750  -4.645   7.246
  102    HG3  PRO  13           1HG      PRO  13  -6.136  -5.376   7.314
  103    HD2  PRO  13           2HD      PRO  13  -7.802  -4.663   4.932
  104    HD3  PRO  13           1HD      PRO  13  -6.059  -4.441   5.205
  105    H    ILE  14           H        ILE  14  -9.043  -6.519   4.238
  106    HA   ILE  14           HA       ILE  14 -10.200  -9.095   3.523
  107    HB   ILE  14           HB       ILE  14 -12.482  -8.249   3.913
  108   HG12  ILE  14          2HG1      ILE  14 -11.172  -5.912   5.331
  109   HG13  ILE  14          1HG1      ILE  14 -11.955  -5.825   3.759
  110   HG21  ILE  14          1HG2      ILE  14 -11.470  -9.628   5.629
  111   HG22  ILE  14          2HG2      ILE  14 -12.543  -8.422   6.348
  112   HG23  ILE  14          3HG2      ILE  14 -10.795  -8.191   6.400
  113   HD11  ILE  14          3HD1      ILE  14 -13.402  -4.981   5.507
  114   HD12  ILE  14          1HD1      ILE  14 -13.285  -6.516   6.367
  115   HD13  ILE  14          2HD1      ILE  14 -14.080  -6.444   4.795
  116    H    LEU  15           H        LEU  15 -11.768  -8.785   1.744
  117    HA   LEU  15           HA       LEU  15 -10.773  -6.941  -0.193
  118    HB2  LEU  15           2HB      LEU  15 -13.203  -8.725  -0.235
  119    HB3  LEU  15           1HB      LEU  15 -12.609  -7.816  -1.608
  120    HG   LEU  15           HG       LEU  15 -11.092 -10.009  -0.206
  121   HD11  LEU  15          1HD1      LEU  15 -13.012 -10.888  -1.360
  122   HD12  LEU  15          2HD1      LEU  15 -11.538 -11.297  -2.242
  123   HD13  LEU  15          3HD1      LEU  15 -12.577  -9.991  -2.811
  124   HD21  LEU  15          3HD2      LEU  15  -9.586  -9.868  -2.144
  125   HD22  LEU  15          1HD2      LEU  15  -9.604  -8.367  -1.218
  126   HD23  LEU  15          2HD2      LEU  15 -10.492  -8.478  -2.737
  127    H    GLY  16           H        GLY  16 -11.779  -5.169  -1.027
  128    HA2  GLY  16           2HA      GLY  16 -13.412  -3.498  -1.184
  129    HA3  GLY  16           1HA      GLY  16 -14.259  -4.225   0.181
  130    H    PHE  17           H        PHE  17 -10.926  -3.953   0.591
  131    HA   PHE  17           HA       PHE  17 -11.330  -1.870   2.567
  132    HB2  PHE  17           2HB      PHE  17 -10.039  -4.032   3.070
  133    HB3  PHE  17           1HB      PHE  17  -8.785  -3.435   1.994
  134    HD1  PHE  17           1HD      PHE  17 -10.692  -2.494   5.060
  135    HD2  PHE  17           2HD      PHE  17  -7.049  -2.134   2.875
  136    HE1  PHE  17           1HE      PHE  17  -9.682  -1.289   6.943
  137    HE2  PHE  17           2HE      PHE  17  -6.039  -0.932   4.752
  138    HZ   PHE  17           HZ       PHE  17  -7.351  -0.501   6.795
  139    H    VAL  18           H        VAL  18  -9.164  -0.372   2.591
  140    HA   VAL  18           HA       VAL  18  -9.319   0.850  -0.047
  141    HB   VAL  18           HB       VAL  18  -8.670   2.971   1.080
  142   HG11  VAL  18          1HG1      VAL  18 -11.006   2.459   0.667
  143   HG12  VAL  18          2HG1      VAL  18 -10.829   3.337   2.188
  144   HG13  VAL  18          3HG1      VAL  18 -11.104   1.594   2.199
  145   HG21  VAL  18          3HG2      VAL  18  -9.028   1.380   3.628
  146   HG22  VAL  18          1HG2      VAL  18  -8.776   3.122   3.528
  147   HG23  VAL  18          2HG2      VAL  18  -7.499   2.010   3.023
  148    H    TYR  19           H        TYR  19  -7.547   1.768  -0.952
  149    HA   TYR  19           HA       TYR  19  -4.988   0.660  -0.080
  150    HB2  TYR  19           2HB      TYR  19  -5.963   1.239  -2.888
  151    HB3  TYR  19           1HB      TYR  19  -4.353   0.666  -2.461
  152    HD1  TYR  19           2HD      TYR  19  -4.176  -1.562  -1.268
  153    HD2  TYR  19           1HD      TYR  19  -7.696  -0.312  -3.283
  154    HE1  TYR  19           2HE      TYR  19  -4.922  -3.875  -1.364
  155    HE2  TYR  19           1HE      TYR  19  -8.460  -2.624  -3.396
  156    HH   TYR  19           HH       TYR  19  -7.484  -4.854  -3.346
  157    H    CYS  20           H        CYS  20  -3.134   2.053  -0.911
  158    HA   CYS  20           HA       CYS  20  -3.563   4.605   0.227
  159    HB2  CYS  20           2HB      CYS  20  -1.173   3.645  -1.375
  160    HB3  CYS  20           1HB      CYS  20  -1.233   5.053  -0.319
  161    H    CYS  21           H        CYS  21  -3.703   6.557  -0.701
  162    HA   CYS  21           HA       CYS  21  -4.964   6.939  -3.132
  163    HB2  CYS  21           2HB      CYS  21  -3.325   8.806  -1.451
  164    HB3  CYS  21           1HB      CYS  21  -4.278   9.349  -2.837
  165    HA   PRO  22           HA       PRO  22  -2.114   6.827  -6.456
  166    HB2  PRO  22           2HB      PRO  22  -2.798   9.074  -7.884
  167    HB3  PRO  22           1HB      PRO  22  -3.732   7.570  -7.896
  168    HG2  PRO  22           2HG      PRO  22  -4.182  10.055  -6.290
  169    HG3  PRO  22           1HG      PRO  22  -5.362   9.078  -7.188
  170    HD2  PRO  22           2HD      PRO  22  -5.099   8.835  -4.540
  171    HD3  PRO  22           1HD      PRO  22  -5.394   7.407  -5.545
  172    H    GLY  23           H        GLY  23  -0.099   7.556  -6.949
  173    HA2  GLY  23           2HA      GLY  23   1.610   9.176  -7.137
  174    HA3  GLY  23           1HA      GLY  23   0.729  10.196  -6.004
  175    H    LEU  24           H        LEU  24   0.518   7.263  -4.698
  176    HA   LEU  24           HA       LEU  24   2.955   7.684  -3.117
  177    HB2  LEU  24           2HB      LEU  24   0.640   6.029  -2.140
  178    HB3  LEU  24           1HB      LEU  24   1.906   6.796  -1.290
  179    HG   LEU  24           HG       LEU  24  -0.170   8.475  -2.656
  180   HD11  LEU  24          1HD1      LEU  24  -1.143   8.718  -0.370
  181   HD12  LEU  24          2HD1      LEU  24  -0.126   7.326   0.094
  182   HD13  LEU  24          3HD1      LEU  24  -1.358   7.151  -1.150
  183   HD21  LEU  24          3HD2      LEU  24   0.634  10.179  -1.048
  184   HD22  LEU  24          1HD2      LEU  24   1.916   9.623  -2.126
  185   HD23  LEU  24          2HD2      LEU  24   1.835   9.036  -0.466
  186    H    ILE  25           H        ILE  25   3.999   5.843  -2.486
  187    HA   ILE  25           HA       ILE  25   3.322   3.419  -3.931
  188    HB   ILE  25           HB       ILE  25   5.866   3.006  -4.148
  189   HG12  ILE  25          2HG1      ILE  25   7.073   5.228  -4.714
  190   HG13  ILE  25          1HG1      ILE  25   5.801   5.977  -3.762
  191   HG21  ILE  25          1HG2      ILE  25   4.481   4.957  -5.950
  192   HG22  ILE  25          2HG2      ILE  25   4.431   3.196  -6.044
  193   HG23  ILE  25          3HG2      ILE  25   5.940   4.053  -6.355
  194   HD11  ILE  25          3HD1      ILE  25   7.847   5.670  -2.467
  195   HD12  ILE  25          1HD1      ILE  25   7.759   3.930  -2.740
  196   HD13  ILE  25          2HD1      ILE  25   6.506   4.738  -1.799
  197    H    CYS  26           H        CYS  26   3.802   1.548  -2.929
  198    HA   CYS  26           HA       CYS  26   4.223   1.869  -0.064
  199    HB2  CYS  26           2HB      CYS  26   2.273   0.563  -1.079
  200    HB3  CYS  26           1HB      CYS  26   3.457  -0.671  -1.510
  201    H    GLY  27           H        GLY  27   6.290   2.025   0.320
  202    HA2  GLY  27           2HA      GLY  27   8.163   0.437  -1.260
  203    HA3  GLY  27           1HA      GLY  27   8.589   1.787  -0.223
  204    HA   PRO  28           HA       PRO  28  10.265  -1.039   2.699
  205    HB2  PRO  28           2HB      PRO  28   9.484   0.345   5.016
  206    HB3  PRO  28           1HB      PRO  28  10.990   0.586   4.125
  207    HG2  PRO  28           2HG      PRO  28   8.439   2.129   4.012
  208    HG3  PRO  28           1HG      PRO  28  10.108   2.710   3.880
  209    HD2  PRO  28           2HD      PRO  28   8.547   2.501   1.736
  210    HD3  PRO  28           1HD      PRO  28  10.273   2.085   1.644
  211    H    PHE  29           H        PHE  29   7.170   0.257   3.694
  212    HA   PHE  29           HA       PHE  29   5.955  -2.321   3.955
  213    HB2  PHE  29           2HB      PHE  29   7.224  -2.223   6.082
  214    HB3  PHE  29           1HB      PHE  29   6.501  -0.662   6.436
  215    HD1  PHE  29           2HD      PHE  29   4.162  -0.514   7.102
  216    HD2  PHE  29           1HD      PHE  29   6.036  -4.250   6.416
  217    HE1  PHE  29           2HE      PHE  29   2.334  -1.627   8.306
  218    HE2  PHE  29           1HE      PHE  29   4.215  -5.390   7.620
  219    HZ   PHE  29           HZ       PHE  29   2.358  -4.082   8.569
  220    H    VAL  30           H        VAL  30   6.055   1.096   4.580
  221    HA   VAL  30           HA       VAL  30   3.159   1.287   4.435
  222    HB   VAL  30           HB       VAL  30   3.500   3.579   5.308
  223   HG11  VAL  30          1HG1      VAL  30   3.183   1.755   6.903
  224   HG12  VAL  30          2HG1      VAL  30   4.262   2.989   7.556
  225   HG13  VAL  30          3HG1      VAL  30   4.926   1.478   6.937
  226   HG21  VAL  30          3HG2      VAL  30   5.694   4.051   4.350
  227   HG22  VAL  30          1HG2      VAL  30   6.427   2.826   5.385
  228   HG23  VAL  30          2HG2      VAL  30   5.733   4.275   6.100
  229    H    CYS  31           H        CYS  31   2.471   3.345   3.300
  230    HA   CYS  31           HA       CYS  31   3.797   3.546   0.721
  231    HB2  CYS  31           2HB      CYS  31   1.204   4.657   1.788
  232    HB3  CYS  31           1HB      CYS  31   1.777   4.883   0.131
  233    H    VAL  32           H        VAL  32   4.258   5.619  -0.076
  234    HA   VAL  32           HA       VAL  32   4.467   7.815   1.627
  235    HB   VAL  32           HB       VAL  32   6.307   6.591   2.624
  236   HG11  VAL  32          1HG1      VAL  32   6.842   5.063   0.804
  237   HG12  VAL  32          2HG1      VAL  32   8.293   5.899   1.351
  238   HG13  VAL  32          3HG1      VAL  32   7.500   6.396  -0.144
  239   HG21  VAL  32          3HG2      VAL  32   7.277   8.826   0.848
  240   HG22  VAL  32          1HG2      VAL  32   8.179   8.159   2.213
  241   HG23  VAL  32          2HG2      VAL  32   6.639   8.950   2.491
  Start of MODEL    7
    1    H1   ARG   1           H        ARG   1 -11.974  11.409  -1.594
    2    HA   ARG   1           HA       ARG   1 -11.414   9.618  -3.809
    3    HB2  ARG   1           2HB      ARG   1  -9.304  10.925  -2.100
    4    HB3  ARG   1           1HB      ARG   1  -9.036   9.576  -3.181
    5    HG2  ARG   1           2HG      ARG   1  -9.950  12.297  -4.065
    6    HG3  ARG   1           1HG      ARG   1  -8.268  11.785  -4.023
    7    HD2  ARG   1           2HD      ARG   1  -9.009  11.525  -6.253
    8    HD3  ARG   1           1HD      ARG   1  -8.901   9.910  -5.573
    9    HE   ARG   1           HE       ARG   1 -11.541  10.866  -5.306
   10   HH11  ARG   1          1HH1      ARG   1  -9.288   9.686  -7.763
   11   HH12  ARG   1          2HH1      ARG   1 -10.476   9.262  -8.886
   12   HH21  ARG   1          1HH2      ARG   1 -13.193  10.254  -6.818
   13   HH22  ARG   1          2HH2      ARG   1 -12.804   9.582  -8.332
   14    H    ASP   2           H        ASP   2 -11.764   7.716  -3.184
   15    HA   ASP   2           HA       ASP   2 -11.608   7.193  -0.345
   16    HB2  ASP   2           2HB      ASP   2 -12.867   5.172  -0.744
   17    HB3  ASP   2           1HB      ASP   2 -13.701   6.491  -1.532
   18    H    CYS   3           H        CYS   3  -9.674   6.728   0.287
   19    HA   CYS   3           HA       CYS   3  -8.183   4.534  -0.610
   20    HB2  CYS   3           2HB      CYS   3  -6.210   5.839  -1.442
   21    HB3  CYS   3           1HB      CYS   3  -7.591   5.907  -2.529
   22    H    GLN   4           H        GLN   4  -5.862   4.842   0.427
   23    HA   GLN   4           HA       GLN   4  -6.393   5.996   3.071
   24    HB2  GLN   4           2HB      GLN   4  -5.232   4.219   4.069
   25    HB3  GLN   4           1HB      GLN   4  -6.168   3.461   2.796
   26    HG2  GLN   4           2HG      GLN   4  -4.226   3.395   1.356
   27    HG3  GLN   4           1HG      GLN   4  -3.248   4.121   2.629
   28   HE21  GLN   4          1HE2      GLN   4  -4.811   1.341   1.520
   29   HE22  GLN   4          2HE2      GLN   4  -4.219   0.251   2.737
   30    H    GLU   5           H        GLU   5  -4.692   6.956   4.081
   31    HA   GLU   5           HA       GLU   5  -3.068   8.504   2.398
   32    HB2  GLU   5           2HB      GLU   5  -3.120   8.120   5.355
   33    HB3  GLU   5           1HB      GLU   5  -2.032   9.276   4.570
   34    HG2  GLU   5           2HG      GLU   5  -4.074  10.319   3.569
   35    HG3  GLU   5           1HG      GLU   5  -5.031   9.252   4.592
   36    H    LYS   6           H        LYS   6  -0.679   8.726   3.009
   37    HA   LYS   6           HA       LYS   6   0.291   6.296   1.970
   38    HB2  LYS   6           2HB      LYS   6   2.297   7.389   1.383
   39    HB3  LYS   6           1HB      LYS   6   0.998   8.545   1.198
   40    HG2  LYS   6           2HG      LYS   6   1.735   9.255   3.576
   41    HG3  LYS   6           1HG      LYS   6   3.259   8.539   3.102
   42    HD2  LYS   6           2HD      LYS   6   2.917   9.980   0.879
   43    HD3  LYS   6           1HD      LYS   6   1.784  10.827   1.965
   44    HE2  LYS   6           2HE      LYS   6   3.452  11.335   3.454
   45    HE3  LYS   6           1HE      LYS   6   4.676  10.460   2.520
   46    HZ1  LYS   6           3HZ      LYS   6   4.188  12.073   0.686
   47    HZ2  LYS   6           1HZ      LYS   6   4.841  12.790   2.068
   48    HZ3  LYS   6           2HZ      LYS   6   3.202  12.913   1.740
   49    H    TRP   7           H        TRP   7   0.809   7.932   4.987
   50    HA   TRP   7           HA       TRP   7   2.738   5.996   5.884
   51    HB2  TRP   7           2HB      TRP   7   1.403   8.268   7.336
   52    HB3  TRP   7           1HB      TRP   7   2.740   7.308   7.961
   53    HD1  TRP   7           HD       TRP   7   2.049  10.375   5.994
   54    HE1  TRP   7           1HE      TRP   7   4.175  11.280   4.979
   55    HE3  TRP   7           3HE      TRP   7   5.092   6.327   6.708
   56    HZ2  TRP   7           2HZ      TRP   7   6.809  10.443   4.505
   57    HZ3  TRP   7           3HZ      TRP   7   7.417   6.481   5.885
   58    HH2  TRP   7           HH       TRP   7   8.242   8.504   4.822
   59    H    GLU   8           H        GLU   8   0.010   5.114   5.286
   60    HA   GLU   8           HA       GLU   8  -1.049   4.303   7.848
   61    HB2  GLU   8           2HB      GLU   8  -1.909   3.806   5.016
   62    HB3  GLU   8           1HB      GLU   8  -2.709   3.078   6.394
   63    HG2  GLU   8           2HG      GLU   8  -2.484   6.006   5.768
   64    HG3  GLU   8           1HG      GLU   8  -3.916   4.968   5.659
   65    H    TYR   9           H        TYR   9  -1.808   1.738   7.504
   66    HA   TYR   9           HA       TYR   9   0.768   0.509   7.751
   67    HB2  TYR   9           2HB      TYR   9  -1.999  -0.582   8.250
   68    HB3  TYR   9           1HB      TYR   9  -0.522  -1.514   8.490
   69    HD1  TYR   9           2HD      TYR   9   1.242  -0.506  10.045
   70    HD2  TYR   9           1HD      TYR   9  -2.807   0.776  10.005
   71    HE1  TYR   9           2HE      TYR   9   1.540   0.461  12.272
   72    HE2  TYR   9           1HE      TYR   9  -2.521   1.756  12.238
   73    HH   TYR   9           HH       TYR   9   0.535   2.177  13.670
   74    H    CYS  10           H        CYS  10  -1.126   1.072   5.215
   75    HA   CYS  10           HA       CYS  10  -1.278   0.363   3.097
   76    HB2  CYS  10           2HB      CYS  10   1.103   0.974   3.220
   77    HB3  CYS  10           1HB      CYS  10   1.516  -0.678   3.670
   78    H    ILE  11           H        ILE  11  -2.862  -1.136   4.282
   79    HA   ILE  11           HA       ILE  11  -2.150  -3.946   3.924
   80    HB   ILE  11           HB       ILE  11  -4.739  -2.744   4.995
   81   HG12  ILE  11          2HG1      ILE  11  -2.411  -3.862   6.576
   82   HG13  ILE  11          1HG1      ILE  11  -2.732  -2.146   6.374
   83   HG21  ILE  11          1HG2      ILE  11  -3.624  -5.542   5.185
   84   HG22  ILE  11          2HG2      ILE  11  -4.976  -5.030   4.175
   85   HG23  ILE  11          3HG2      ILE  11  -5.117  -4.977   5.933
   86   HD11  ILE  11          3HD1      ILE  11  -4.533  -4.142   7.735
   87   HD12  ILE  11          1HD1      ILE  11  -4.875  -2.424   7.527
   88   HD13  ILE  11          2HD1      ILE  11  -3.517  -2.935   8.528
   89    H    VAL  12           H        VAL  12  -2.962  -5.110   2.238
   90    HA   VAL  12           HA       VAL  12  -4.652  -3.617   0.397
   91    HB   VAL  12           HB       VAL  12  -3.491  -4.757  -1.483
   92   HG11  VAL  12          1HG1      VAL  12  -2.811  -2.520  -0.847
   93   HG12  VAL  12          2HG1      VAL  12  -1.413  -3.455  -1.380
   94   HG13  VAL  12          3HG1      VAL  12  -1.686  -3.179   0.340
   95   HG21  VAL  12          3HG2      VAL  12  -1.344  -5.883  -1.105
   96   HG22  VAL  12          1HG2      VAL  12  -2.654  -6.735  -0.289
   97   HG23  VAL  12          2HG2      VAL  12  -1.554  -5.712   0.636
   98    HA   PRO  13           HA       PRO  13  -7.425  -7.058   0.611
   99    HB2  PRO  13           2HB      PRO  13  -8.714  -6.624  -1.784
  100    HB3  PRO  13           1HB      PRO  13  -9.094  -5.762  -0.293
  101    HG2  PRO  13           2HG      PRO  13  -7.448  -4.896  -2.619
  102    HG3  PRO  13           1HG      PRO  13  -8.560  -3.953  -1.614
  103    HD2  PRO  13           2HD      PRO  13  -5.875  -3.815  -1.337
  104    HD3  PRO  13           1HD      PRO  13  -6.989  -3.606   0.025
  105    H    ILE  14           H        ILE  14  -5.654  -6.399  -2.396
  106    HA   ILE  14           HA       ILE  14  -5.429  -9.297  -2.772
  107    HB   ILE  14           HB       ILE  14  -5.400  -7.210  -4.987
  108   HG12  ILE  14          2HG1      ILE  14  -7.592  -9.185  -4.271
  109   HG13  ILE  14          1HG1      ILE  14  -7.653  -7.459  -3.943
  110   HG21  ILE  14          1HG2      ILE  14  -4.075  -9.221  -5.468
  111   HG22  ILE  14          2HG2      ILE  14  -5.514  -9.160  -6.486
  112   HG23  ILE  14          3HG2      ILE  14  -5.466 -10.236  -5.089
  113   HD11  ILE  14          3HD1      ILE  14  -7.536  -8.743  -6.666
  114   HD12  ILE  14          1HD1      ILE  14  -7.596  -7.009  -6.348
  115   HD13  ILE  14          2HD1      ILE  14  -8.960  -8.033  -5.904
  116    H    LEU  15           H        LEU  15  -3.433  -9.951  -2.494
  117    HA   LEU  15           HA       LEU  15  -1.277  -8.158  -2.074
  118    HB2  LEU  15           2HB      LEU  15  -1.514 -10.300  -0.877
  119    HB3  LEU  15           1HB      LEU  15  -1.266 -11.165  -2.375
  120    HG   LEU  15           HG       LEU  15   1.034 -10.222  -2.491
  121   HD11  LEU  15          1HD1      LEU  15   0.399  -9.177   0.260
  122   HD12  LEU  15          2HD1      LEU  15   0.731  -8.215  -1.180
  123   HD13  LEU  15          3HD1      LEU  15   1.999  -9.216  -0.477
  124   HD21  LEU  15          3HD2      LEU  15   1.964 -11.645  -0.725
  125   HD22  LEU  15          1HD2      LEU  15   0.648 -12.448  -1.583
  126   HD23  LEU  15          2HD2      LEU  15   0.368 -11.759   0.017
  127    H    GLY  16           H        GLY  16   0.386  -7.616  -3.354
  128    HA2  GLY  16           2HA      GLY  16   1.862  -7.977  -5.211
  129    HA3  GLY  16           1HA      GLY  16   0.529  -8.753  -6.062
  130    H    PHE  17           H        PHE  17  -0.952  -6.392  -4.628
  131    HA   PHE  17           HA       PHE  17  -0.348  -4.358  -6.656
  132    HB2  PHE  17           2HB      PHE  17  -3.059  -5.121  -5.523
  133    HB3  PHE  17           1HB      PHE  17  -2.760  -3.776  -6.612
  134    HD1  PHE  17           2HD      PHE  17  -2.202  -4.202  -8.975
  135    HD2  PHE  17           1HD      PHE  17  -3.186  -7.368  -6.313
  136    HE1  PHE  17           2HE      PHE  17  -2.576  -5.690 -10.890
  137    HE2  PHE  17           1HE      PHE  17  -3.564  -8.864  -8.226
  138    HZ   PHE  17           HZ       PHE  17  -3.259  -8.028 -10.520
  139    H    VAL  18           H        VAL  18  -0.778  -2.171  -5.863
  140    HA   VAL  18           HA       VAL  18  -0.617  -2.085  -2.946
  141    HB   VAL  18           HB       VAL  18   0.591  -0.196  -4.996
  142   HG11  VAL  18          1HG1      VAL  18   1.512   1.049  -3.101
  143   HG12  VAL  18          2HG1      VAL  18   0.611   0.016  -1.989
  144   HG13  VAL  18          3HG1      VAL  18  -0.252   1.083  -3.096
  145   HG21  VAL  18          3HG2      VAL  18   1.844  -2.263  -4.678
  146   HG22  VAL  18          1HG2      VAL  18   1.851  -2.003  -2.935
  147   HG23  VAL  18          2HG2      VAL  18   2.726  -0.898  -3.990
  148    H    TYR  19           H        TYR  19  -2.156  -1.019  -1.890
  149    HA   TYR  19           HA       TYR  19  -3.853   0.718  -3.476
  150    HB2  TYR  19           2HB      TYR  19  -5.148  -1.257  -2.957
  151    HB3  TYR  19           1HB      TYR  19  -4.723  -1.137  -1.252
  152    HD1  TYR  19           2HD      TYR  19  -6.228   1.058  -3.895
  153    HD2  TYR  19           1HD      TYR  19  -6.369  -0.276   0.146
  154    HE1  TYR  19           2HE      TYR  19  -8.163   2.486  -3.503
  155    HE2  TYR  19           1HE      TYR  19  -8.316   1.160   0.554
  156    HH   TYR  19           HH       TYR  19 -10.062   2.614  -1.964
  157    H    CYS  20           H        CYS  20  -3.273   2.642  -2.991
  158    HA   CYS  20           HA       CYS  20  -4.048   3.726  -0.562
  159    HB2  CYS  20           2HB      CYS  20  -1.837   4.872  -0.015
  160    HB3  CYS  20           1HB      CYS  20  -1.845   3.155   0.320
  161    H    CYS  21           H        CYS  21  -3.664   6.165  -0.705
  162    HA   CYS  21           HA       CYS  21  -4.977   7.067  -2.957
  163    HB2  CYS  21           2HB      CYS  21  -3.190   8.583  -1.070
  164    HB3  CYS  21           1HB      CYS  21  -4.231   9.364  -2.271
  165    HA   PRO  22           HA       PRO  22  -2.369   7.277  -6.440
  166    HB2  PRO  22           2HB      PRO  22  -3.066   9.676  -7.557
  167    HB3  PRO  22           1HB      PRO  22  -4.032   8.205  -7.680
  168    HG2  PRO  22           2HG      PRO  22  -4.354  10.525  -5.824
  169    HG3  PRO  22           1HG      PRO  22  -5.598   9.615  -6.699
  170    HD2  PRO  22           2HD      PRO  22  -5.116   9.205  -4.102
  171    HD3  PRO  22           1HD      PRO  22  -5.557   7.863  -5.163
  172    H    GLY  23           H        GLY  23  -0.315   7.700  -6.760
  173    HA2  GLY  23           2HA      GLY  23   1.485   9.189  -7.091
  174    HA3  GLY  23           1HA      GLY  23   0.741  10.307  -5.952
  175    H    LEU  24           H        LEU  24   0.435   7.305  -4.666
  176    HA   LEU  24           HA       LEU  24   2.847   7.740  -3.049
  177    HB2  LEU  24           2HB      LEU  24   0.536   6.029  -2.193
  178    HB3  LEU  24           1HB      LEU  24   1.819   6.743  -1.285
  179    HG   LEU  24           HG       LEU  24  -0.297   8.426  -2.562
  180   HD11  LEU  24          1HD1      LEU  24  -1.367   7.035  -1.003
  181   HD12  LEU  24          2HD1      LEU  24  -1.121   8.603  -0.191
  182   HD13  LEU  24          3HD1      LEU  24  -0.048   7.226   0.133
  183   HD21  LEU  24          3HD2      LEU  24   0.572  10.106  -0.928
  184   HD22  LEU  24          1HD2      LEU  24   1.748   9.612  -2.147
  185   HD23  LEU  24          2HD2      LEU  24   1.860   8.972  -0.520
  186    H    ILE  25           H        ILE  25   4.072   6.045  -2.531
  187    HA   ILE  25           HA       ILE  25   3.641   3.551  -4.026
  188    HB   ILE  25           HB       ILE  25   6.200   3.403  -4.176
  189   HG12  ILE  25          2HG1      ILE  25   5.943   6.384  -3.666
  190   HG13  ILE  25          1HG1      ILE  25   6.707   5.232  -2.585
  191   HG21  ILE  25          1HG2      ILE  25   4.827   3.743  -6.125
  192   HG22  ILE  25          2HG2      ILE  25   6.272   4.750  -6.239
  193   HG23  ILE  25          3HG2      ILE  25   4.726   5.471  -5.790
  194   HD11  ILE  25          3HD1      ILE  25   8.346   6.517  -3.836
  195   HD12  ILE  25          1HD1      ILE  25   7.641   5.962  -5.352
  196   HD13  ILE  25          2HD1      ILE  25   8.429   4.811  -4.274
  197    H    CYS  26           H        CYS  26   3.856   1.703  -2.903
  198    HA   CYS  26           HA       CYS  26   4.520   1.958  -0.047
  199    HB2  CYS  26           2HB      CYS  26   2.287   0.962  -0.817
  200    HB3  CYS  26           1HB      CYS  26   3.211  -0.400  -1.429
  201    H    GLY  27           H        GLY  27   6.588   1.723   0.200
  202    HA2  GLY  27           2HA      GLY  27   7.997  -0.311  -1.386
  203    HA3  GLY  27           1HA      GLY  27   8.751   1.090  -0.646
  204    HA   PRO  28           HA       PRO  28   9.910  -1.319   2.789
  205    HB2  PRO  28           2HB      PRO  28   9.316   0.244   4.981
  206    HB3  PRO  28           1HB      PRO  28  10.735   0.477   3.958
  207    HG2  PRO  28           2HG      PRO  28   8.142   1.951   3.969
  208    HG3  PRO  28           1HG      PRO  28   9.777   2.562   3.671
  209    HD2  PRO  28           2HD      PRO  28   7.975   2.096   1.683
  210    HD3  PRO  28           1HD      PRO  28   9.729   1.962   1.458
  211    H    PHE  29           H        PHE  29   7.298   0.245   4.561
  212    HA   PHE  29           HA       PHE  29   5.723  -2.228   4.432
  213    HB2  PHE  29           2HB      PHE  29   6.356  -0.685   6.973
  214    HB3  PHE  29           1HB      PHE  29   5.256  -2.046   6.858
  215    HD1  PHE  29           2HD      PHE  29   6.153  -4.317   6.417
  216    HD2  PHE  29           1HD      PHE  29   8.711  -0.997   7.135
  217    HE1  PHE  29           2HE      PHE  29   8.008  -5.855   6.880
  218    HE2  PHE  29           1HE      PHE  29  10.576  -2.528   7.597
  219    HZ   PHE  29           HZ       PHE  29  10.227  -4.965   7.471
  220    H    VAL  30           H        VAL  30   5.879   0.959   3.805
  221    HA   VAL  30           HA       VAL  30   3.041   1.431   4.209
  222    HB   VAL  30           HB       VAL  30   3.454   3.696   5.092
  223   HG11  VAL  30          1HG1      VAL  30   3.085   1.962   6.740
  224   HG12  VAL  30          2HG1      VAL  30   4.236   3.151   7.354
  225   HG13  VAL  30          3HG1      VAL  30   4.808   1.590   6.766
  226   HG21  VAL  30          3HG2      VAL  30   5.638   4.141   4.130
  227   HG22  VAL  30          1HG2      VAL  30   6.367   2.905   5.156
  228   HG23  VAL  30          2HG2      VAL  30   5.701   4.366   5.879
  229    H    CYS  31           H        CYS  31   2.477   3.515   3.048
  230    HA   CYS  31           HA       CYS  31   3.890   3.719   0.502
  231    HB2  CYS  31           2HB      CYS  31   1.232   4.734   1.513
  232    HB3  CYS  31           1HB      CYS  31   1.888   5.225  -0.050
  233    H    VAL  32           H        VAL  32   4.198   5.988  -0.272
  234    HA   VAL  32           HA       VAL  32   4.413   8.118   1.523
  235    HB   VAL  32           HB       VAL  32   6.355   6.905   2.381
  236   HG11  VAL  32          1HG1      VAL  32   7.409   6.954  -0.450
  237   HG12  VAL  32          2HG1      VAL  32   6.885   5.531   0.451
  238   HG13  VAL  32          3HG1      VAL  32   8.318   6.422   0.967
  239   HG21  VAL  32          3HG2      VAL  32   7.176   9.265   0.694
  240   HG22  VAL  32          1HG2      VAL  32   8.104   8.584   2.035
  241   HG23  VAL  32          2HG2      VAL  32   6.529   9.300   2.342
  Start of MODEL    8
    1    H1   ARG   1           H        ARG   1 -12.781   7.895  -4.520
    2    HA   ARG   1           HA       ARG   1 -13.950   5.471  -3.806
    3    HB2  ARG   1           2HB      ARG   1 -11.214   5.351  -5.014
    4    HB3  ARG   1           1HB      ARG   1 -11.914   4.097  -4.003
    5    HG2  ARG   1           2HG      ARG   1 -13.709   3.856  -5.709
    6    HG3  ARG   1           1HG      ARG   1 -12.796   4.967  -6.738
    7    HD2  ARG   1           2HD      ARG   1 -12.247   2.649  -7.281
    8    HD3  ARG   1           1HD      ARG   1 -10.856   3.499  -6.604
    9    HE   ARG   1           HE       ARG   1 -12.513   2.004  -4.757
   10   HH11  ARG   1          1HH1      ARG   1  -9.546   2.009  -6.682
   11   HH12  ARG   1          2HH1      ARG   1  -8.739   0.867  -5.713
   12   HH21  ARG   1          1HH2      ARG   1 -11.438   0.483  -3.425
   13   HH22  ARG   1          2HH2      ARG   1  -9.855  -0.036  -3.790
   14    H    ASP   2           H        ASP   2 -12.893   4.549  -2.019
   15    HA   ASP   2           HA       ASP   2 -11.934   6.660  -0.283
   16    HB2  ASP   2           2HB      ASP   2 -12.740   3.806   0.331
   17    HB3  ASP   2           1HB      ASP   2 -12.283   5.029   1.502
   18    H    CYS   3           H        CYS   3  -9.787   6.921  -0.471
   19    HA   CYS   3           HA       CYS   3  -8.147   4.492  -0.354
   20    HB2  CYS   3           2HB      CYS   3  -6.342   5.804  -1.398
   21    HB3  CYS   3           1HB      CYS   3  -7.753   5.686  -2.437
   22    H    GLN   4           H        GLN   4  -5.914   5.051   0.652
   23    HA   GLN   4           HA       GLN   4  -6.457   6.596   3.118
   24    HB2  GLN   4           2HB      GLN   4  -5.383   4.900   4.401
   25    HB3  GLN   4           1HB      GLN   4  -6.422   4.089   3.237
   26    HG2  GLN   4           2HG      GLN   4  -4.604   3.581   1.819
   27    HG3  GLN   4           1HG      GLN   4  -3.467   4.384   2.911
   28   HE21  GLN   4          1HE2      GLN   4  -3.461   1.721   2.005
   29   HE22  GLN   4          2HE2      GLN   4  -3.691   0.662   3.339
   30    H    GLU   5           H        GLU   5  -4.560   7.330   4.185
   31    HA   GLU   5           HA       GLU   5  -2.919   8.762   2.394
   32    HB2  GLU   5           2HB      GLU   5  -2.930   8.406   5.341
   33    HB3  GLU   5           1HB      GLU   5  -1.744   9.460   4.542
   34    HG2  GLU   5           2HG      GLU   5  -3.680  10.731   3.615
   35    HG3  GLU   5           1HG      GLU   5  -4.743   9.703   4.570
   36    H    LYS   6           H        LYS   6  -0.453   8.803   3.009
   37    HA   LYS   6           HA       LYS   6   0.323   6.336   1.906
   38    HB2  LYS   6           2HB      LYS   6   2.453   7.268   1.454
   39    HB3  LYS   6           1HB      LYS   6   1.228   8.480   1.156
   40    HG2  LYS   6           2HG      LYS   6   1.878   9.122   3.627
   41    HG3  LYS   6           1HG      LYS   6   3.411   8.441   3.130
   42    HD2  LYS   6           2HD      LYS   6   3.048   9.952   0.956
   43    HD3  LYS   6           1HD      LYS   6   1.869  10.702   2.063
   44    HE2  LYS   6           2HE      LYS   6   3.506  11.245   3.579
   45    HE3  LYS   6           1HE      LYS   6   4.778  10.505   2.590
   46    HZ1  LYS   6           3HZ      LYS   6   4.655  12.917   2.303
   47    HZ2  LYS   6           1HZ      LYS   6   3.057  12.798   1.828
   48    HZ3  LYS   6           2HZ      LYS   6   4.274  12.147   0.858
   49    H    TRP   7           H        TRP   7   0.974   7.795   5.019
   50    HA   TRP   7           HA       TRP   7   2.822   5.700   5.757
   51    HB2  TRP   7           2HB      TRP   7   1.621   7.889   7.450
   52    HB3  TRP   7           1HB      TRP   7   2.994   6.877   7.880
   53    HD1  TRP   7           HD       TRP   7   2.097  10.055   6.079
   54    HE1  TRP   7           1HE      TRP   7   4.195  11.124   5.133
   55    HE3  TRP   7           3HE      TRP   7   5.361   6.174   6.675
   56    HZ2  TRP   7           2HZ      TRP   7   6.878  10.464   4.673
   57    HZ3  TRP   7           3HZ      TRP   7   7.677   6.476   5.912
   58    HH2  TRP   7           HH       TRP   7   8.418   8.584   4.939
   59    H    GLU   8           H        GLU   8  -0.016   5.085   5.190
   60    HA   GLU   8           HA       GLU   8  -1.117   4.242   7.745
   61    HB2  GLU   8           2HB      GLU   8  -2.159   4.056   4.931
   62    HB3  GLU   8           1HB      GLU   8  -3.020   3.453   6.337
   63    HG2  GLU   8           2HG      GLU   8  -2.228   6.306   5.846
   64    HG3  GLU   8           1HG      GLU   8  -3.841   5.630   5.638
   65    H    TYR   9           H        TYR   9  -2.384   1.881   6.913
   66    HA   TYR   9           HA       TYR   9  -0.364  -0.004   7.410
   67    HB2  TYR   9           2HB      TYR   9  -3.200  -0.394   6.458
   68    HB3  TYR   9           1HB      TYR   9  -2.130  -1.710   6.919
   69    HD1  TYR   9           2HD      TYR   9  -1.542  -2.071   9.261
   70    HD2  TYR   9           1HD      TYR   9  -4.160   1.083   8.127
   71    HE1  TYR   9           2HE      TYR   9  -2.243  -1.825  11.590
   72    HE2  TYR   9           1HE      TYR   9  -4.868   1.342  10.452
   73    HH   TYR   9           HH       TYR   9  -3.230  -0.090  13.038
   74    H    CYS  10           H        CYS  10  -1.600   1.273   4.452
   75    HA   CYS  10           HA       CYS  10  -1.154   0.961   2.285
   76    HB2  CYS  10           2HB      CYS  10   1.174   1.127   2.744
   77    HB3  CYS  10           1HB      CYS  10   1.268  -0.522   3.356
   78    H    ILE  11           H        ILE  11  -0.251  -2.230   3.581
   79    HA   ILE  11           HA       ILE  11  -2.597  -3.358   2.346
   80    HB   ILE  11           HB       ILE  11  -1.329  -5.332   1.518
   81   HG12  ILE  11          2HG1      ILE  11   1.168  -3.684   1.997
   82   HG13  ILE  11          1HG1      ILE  11   0.672  -5.070   2.962
   83   HG21  ILE  11          1HG2      ILE  11  -0.377  -4.337  -0.508
   84   HG22  ILE  11          2HG2      ILE  11  -0.474  -2.744   0.243
   85   HG23  ILE  11          3HG2      ILE  11  -1.949  -3.653  -0.091
   86   HD11  ILE  11          3HD1      ILE  11   0.893  -6.509   0.999
   87   HD12  ILE  11          1HD1      ILE  11   2.404  -5.676   1.362
   88   HD13  ILE  11          2HD1      ILE  11   1.385  -5.118   0.035
   89    H    VAL  12           H        VAL  12  -3.259  -5.244   3.429
   90    HA   VAL  12           HA       VAL  12  -1.792  -6.099   5.751
   91    HB   VAL  12           HB       VAL  12  -2.997  -4.042   6.505
   92   HG11  VAL  12          1HG1      VAL  12  -5.435  -3.992   6.702
   93   HG12  VAL  12          2HG1      VAL  12  -5.513  -5.486   5.765
   94   HG13  VAL  12          3HG1      VAL  12  -4.867  -4.020   5.030
   95   HG21  VAL  12          3HG2      VAL  12  -4.081  -6.577   7.727
   96   HG22  VAL  12          1HG2      VAL  12  -4.162  -4.981   8.471
   97   HG23  VAL  12          2HG2      VAL  12  -2.598  -5.734   8.178
   98    HA   PRO  13           HA       PRO  13  -3.940  -9.825   4.414
   99    HB2  PRO  13           2HB      PRO  13  -3.826 -11.275   6.746
  100    HB3  PRO  13           1HB      PRO  13  -2.480 -11.122   5.613
  101    HG2  PRO  13           2HG      PRO  13  -3.006  -9.634   8.147
  102    HG3  PRO  13           1HG      PRO  13  -1.477 -10.287   7.535
  103    HD2  PRO  13           2HD      PRO  13  -2.077  -7.676   7.360
  104    HD3  PRO  13           1HD      PRO  13  -1.158  -8.506   6.090
  105    H    ILE  14           H        ILE  14  -5.745  -8.042   4.664
  106    HA   ILE  14           HA       ILE  14  -8.004  -9.350   5.997
  107    HB   ILE  14           HB       ILE  14  -7.489  -6.343   5.869
  108   HG12  ILE  14          2HG1      ILE  14  -7.725  -8.136   8.301
  109   HG13  ILE  14          1HG1      ILE  14  -6.227  -7.450   7.686
  110   HG21  ILE  14          1HG2      ILE  14  -9.894  -7.795   6.961
  111   HG22  ILE  14          2HG2      ILE  14  -9.837  -6.835   5.486
  112   HG23  ILE  14          3HG2      ILE  14  -9.612  -6.057   7.054
  113   HD11  ILE  14          3HD1      ILE  14  -7.057  -5.207   8.187
  114   HD12  ILE  14          1HD1      ILE  14  -7.051  -6.229   9.624
  115   HD13  ILE  14          2HD1      ILE  14  -8.566  -5.898   8.783
  116    H    LEU  15           H        LEU  15  -9.381  -9.850   4.341
  117    HA   LEU  15           HA       LEU  15  -8.954  -8.606   1.813
  118    HB2  LEU  15           2HB      LEU  15 -10.774  -9.942   0.897
  119    HB3  LEU  15           1HB      LEU  15  -9.652 -10.947   1.775
  120    HG   LEU  15           HG       LEU  15 -12.325 -10.069   2.893
  121   HD11  LEU  15          1HD1      LEU  15 -12.666 -11.346   0.838
  122   HD12  LEU  15          2HD1      LEU  15 -13.128 -12.298   2.248
  123   HD13  LEU  15          3HD1      LEU  15 -11.594 -12.610   1.437
  124   HD21  LEU  15          3HD2      LEU  15 -10.413 -12.283   3.650
  125   HD22  LEU  15          1HD2      LEU  15 -12.007 -12.030   4.357
  126   HD23  LEU  15          2HD2      LEU  15 -10.753 -10.824   4.586
  127    H    GLY  16           H        GLY  16 -10.150  -7.167   0.728
  128    HA2  GLY  16           2HA      GLY  16 -11.682  -5.489   0.441
  129    HA3  GLY  16           1HA      GLY  16 -12.461  -5.971   1.947
  130    H    PHE  17           H        PHE  17  -9.041  -5.292   1.651
  131    HA   PHE  17           HA       PHE  17  -9.320  -3.308   3.728
  132    HB2  PHE  17           2HB      PHE  17  -6.900  -3.293   3.889
  133    HB3  PHE  17           1HB      PHE  17  -7.450  -4.955   3.817
  134    HD1  PHE  17           2HD      PHE  17  -7.024  -6.292   1.774
  135    HD2  PHE  17           1HD      PHE  17  -5.489  -2.356   2.215
  136    HE1  PHE  17           2HE      PHE  17  -5.416  -6.703  -0.052
  137    HE2  PHE  17           1HE      PHE  17  -3.898  -2.758   0.418
  138    HZ   PHE  17           HZ       PHE  17  -3.855  -4.939  -0.732
  139    H    VAL  18           H        VAL  18  -7.770  -1.301   3.430
  140    HA   VAL  18           HA       VAL  18  -8.659  -0.039   0.950
  141    HB   VAL  18           HB       VAL  18  -7.661   1.244   3.522
  142   HG11  VAL  18          1HG1      VAL  18  -9.044   2.475   1.146
  143   HG12  VAL  18          2HG1      VAL  18  -7.346   2.663   1.578
  144   HG13  VAL  18          3HG1      VAL  18  -8.601   3.317   2.631
  145   HG21  VAL  18          3HG2      VAL  18 -10.000   1.840   3.971
  146   HG22  VAL  18          1HG2      VAL  18  -9.758   0.092   3.943
  147   HG23  VAL  18          2HG2      VAL  18 -10.500   0.902   2.563
  148    H    TYR  19           H        TYR  19  -7.120   0.908  -0.355
  149    HA   TYR  19           HA       TYR  19  -4.334   0.333   0.332
  150    HB2  TYR  19           2HB      TYR  19  -5.230  -0.812  -1.725
  151    HB3  TYR  19           1HB      TYR  19  -5.527   0.769  -2.431
  152    HD1  TYR  19           2HD      TYR  19  -2.790  -1.375  -1.072
  153    HD2  TYR  19           1HD      TYR  19  -3.832   1.809  -3.702
  154    HE1  TYR  19           2HE      TYR  19  -0.508  -1.368  -1.955
  155    HE2  TYR  19           1HE      TYR  19  -1.554   1.829  -4.587
  156    HH   TYR  19           HH       TYR  19   0.693  -0.666  -3.961
  157    H    CYS  20           H        CYS  20  -2.779   1.981  -0.546
  158    HA   CYS  20           HA       CYS  20  -3.459   4.499   0.531
  159    HB2  CYS  20           2HB      CYS  20  -1.116   3.815  -1.254
  160    HB3  CYS  20           1HB      CYS  20  -1.248   5.184  -0.157
  161    H    CYS  21           H        CYS  21  -3.679   6.459  -0.498
  162    HA   CYS  21           HA       CYS  21  -5.053   6.643  -2.903
  163    HB2  CYS  21           2HB      CYS  21  -3.451   8.694  -1.381
  164    HB3  CYS  21           1HB      CYS  21  -4.538   9.100  -2.712
  165    HA   PRO  22           HA       PRO  22  -2.006   6.461  -6.086
  166    HB2  PRO  22           2HB      PRO  22  -2.898   8.387  -7.808
  167    HB3  PRO  22           1HB      PRO  22  -3.652   6.796  -7.636
  168    HG2  PRO  22           2HG      PRO  22  -4.448   9.405  -6.415
  169    HG3  PRO  22           1HG      PRO  22  -5.478   8.162  -7.155
  170    HD2  PRO  22           2HD      PRO  22  -5.165   8.406  -4.466
  171    HD3  PRO  22           1HD      PRO  22  -5.407   6.824  -5.246
  172    H    GLY  23           H        GLY  23  -0.195   7.486  -6.897
  173    HA2  GLY  23           2HA      GLY  23   1.244   9.355  -7.251
  174    HA3  GLY  23           1HA      GLY  23   0.408  10.196  -5.945
  175    H    LEU  24           H        LEU  24   0.590   7.313  -4.733
  176    HA   LEU  24           HA       LEU  24   3.096   7.893  -3.300
  177    HB2  LEU  24           2HB      LEU  24   0.909   6.105  -2.271
  178    HB3  LEU  24           1HB      LEU  24   2.190   6.896  -1.447
  179    HG   LEU  24           HG       LEU  24   0.019   8.521  -2.704
  180   HD11  LEU  24          1HD1      LEU  24   0.175   7.243  -0.025
  181   HD12  LEU  24          2HD1      LEU  24  -1.137   7.165  -1.233
  182   HD13  LEU  24          3HD1      LEU  24  -0.841   8.652  -0.339
  183   HD21  LEU  24          3HD2      LEU  24   0.810  10.189  -1.028
  184   HD22  LEU  24          1HD2      LEU  24   2.044   9.741  -2.204
  185   HD23  LEU  24          2HD2      LEU  24   2.095   9.080  -0.574
  186    H    ILE  25           H        ILE  25   4.321   6.089  -2.684
  187    HA   ILE  25           HA       ILE  25   3.776   3.638  -4.160
  188    HB   ILE  25           HB       ILE  25   6.228   3.277  -4.358
  189   HG12  ILE  25          2HG1      ILE  25   6.899   4.973  -2.575
  190   HG13  ILE  25          1HG1      ILE  25   7.858   4.986  -4.037
  191   HG21  ILE  25          1HG2      ILE  25   5.009   3.963  -6.287
  192   HG22  ILE  25          2HG2      ILE  25   6.592   4.741  -6.291
  193   HG23  ILE  25          3HG2      ILE  25   5.160   5.659  -5.830
  194   HD11  ILE  25          3HD1      ILE  25   7.442   7.224  -3.209
  195   HD12  ILE  25          1HD1      ILE  25   5.703   6.968  -3.326
  196   HD13  ILE  25          2HD1      ILE  25   6.688   6.995  -4.787
  197    H    CYS  26           H        CYS  26   4.234   1.757  -3.064
  198    HA   CYS  26           HA       CYS  26   4.607   2.135  -0.182
  199    HB2  CYS  26           2HB      CYS  26   2.569   0.881  -1.173
  200    HB3  CYS  26           1HB      CYS  26   3.713  -0.396  -1.564
  201    H    GLY  27           H        GLY  27   6.659   2.205   0.186
  202    HA2  GLY  27           2HA      GLY  27   8.518   0.599  -1.351
  203    HA3  GLY  27           1HA      GLY  27   8.931   1.810  -0.145
  204    HA   PRO  28           HA       PRO  28   9.747  -1.476   2.602
  205    HB2  PRO  28           2HB      PRO  28   9.292  -0.275   5.032
  206    HB3  PRO  28           1HB      PRO  28  10.744  -0.025   4.064
  207    HG2  PRO  28           2HG      PRO  28   8.377   1.746   4.388
  208    HG3  PRO  28           1HG      PRO  28  10.074   2.168   4.127
  209    HD2  PRO  28           2HD      PRO  28   8.103   2.217   2.199
  210    HD3  PRO  28           1HD      PRO  28   9.840   2.103   1.870
  211    H    PHE  29           H        PHE  29   7.351  -0.072   4.773
  212    HA   PHE  29           HA       PHE  29   5.647  -2.397   4.222
  213    HB2  PHE  29           2HB      PHE  29   6.061  -1.005   6.890
  214    HB3  PHE  29           1HB      PHE  29   4.986  -2.356   6.589
  215    HD1  PHE  29           2HD      PHE  29   5.863  -4.571   6.184
  216    HD2  PHE  29           1HD      PHE  29   8.445  -1.326   7.078
  217    HE1  PHE  29           2HE      PHE  29   7.686  -6.156   6.662
  218    HE2  PHE  29           1HE      PHE  29  10.268  -2.899   7.553
  219    HZ   PHE  29           HZ       PHE  29   9.892  -5.315   7.346
  220    H    VAL  30           H        VAL  30   5.903   0.968   4.337
  221    HA   VAL  30           HA       VAL  30   3.001   1.235   4.129
  222    HB   VAL  30           HB       VAL  30   3.126   3.421   5.193
  223   HG11  VAL  30          1HG1      VAL  30   3.713   2.775   7.495
  224   HG12  VAL  30          2HG1      VAL  30   4.428   1.284   6.870
  225   HG13  VAL  30          3HG1      VAL  30   2.700   1.592   6.673
  226   HG21  VAL  30          3HG2      VAL  30   5.229   4.178   6.310
  227   HG22  VAL  30          1HG2      VAL  30   5.326   4.159   4.545
  228   HG23  VAL  30          2HG2      VAL  30   6.079   2.876   5.476
  229    H    CYS  31           H        CYS  31   2.552   3.491   3.117
  230    HA   CYS  31           HA       CYS  31   4.060   3.696   0.616
  231    HB2  CYS  31           2HB      CYS  31   1.456   4.879   1.533
  232    HB3  CYS  31           1HB      CYS  31   2.126   5.025  -0.094
  233    H    VAL  32           H        VAL  32   4.421   5.856  -0.160
  234    HA   VAL  32           HA       VAL  32   4.562   8.025   1.585
  235    HB   VAL  32           HB       VAL  32   6.517   6.862   2.481
  236   HG11  VAL  32          1HG1      VAL  32   8.503   6.402   1.085
  237   HG12  VAL  32          2HG1      VAL  32   7.594   6.888  -0.346
  238   HG13  VAL  32          3HG1      VAL  32   7.101   5.465   0.569
  239   HG21  VAL  32          3HG2      VAL  32   6.637   9.257   2.433
  240   HG22  VAL  32          1HG2      VAL  32   7.242   9.241   0.776
  241   HG23  VAL  32          2HG2      VAL  32   8.233   8.601   2.086
  Start of MODEL    9
    1    H1   ARG   1           H        ARG   1 -11.493  11.607  -2.472
    2    HA   ARG   1           HA       ARG   1 -12.733   9.550  -4.015
    3    HB2  ARG   1           2HB      ARG   1  -9.738   9.905  -4.159
    4    HB3  ARG   1           1HB      ARG   1 -10.634   8.521  -4.753
    5    HG2  ARG   1           2HG      ARG   1 -10.827  11.333  -5.807
    6    HG3  ARG   1           1HG      ARG   1  -9.973   9.992  -6.567
    7    HD2  ARG   1           2HD      ARG   1 -12.936  10.157  -6.045
    8    HD3  ARG   1           1HD      ARG   1 -12.139  10.356  -7.603
    9    HE   ARG   1           HE       ARG   1 -11.313   7.947  -7.000
   10   HH11  ARG   1          1HH1      ARG   1 -14.581   9.311  -6.703
   11   HH12  ARG   1          2HH1      ARG   1 -15.365   7.811  -6.845
   12   HH21  ARG   1          1HH2      ARG   1 -12.386   5.908  -7.221
   13   HH22  ARG   1          2HH2      ARG   1 -14.082   5.801  -7.116
   14    H    ASP   2           H        ASP   2 -12.651   7.593  -2.912
   15    HA   ASP   2           HA       ASP   2 -11.701   7.770  -0.193
   16    HB2  ASP   2           2HB      ASP   2 -13.906   6.761  -0.532
   17    HB3  ASP   2           1HB      ASP   2 -13.208   5.553  -1.605
   18    H    CYS   3           H        CYS   3  -9.702   7.469   0.098
   19    HA   CYS   3           HA       CYS   3  -8.456   4.993  -0.584
   20    HB2  CYS   3           2HB      CYS   3  -6.467   6.110  -1.615
   21    HB3  CYS   3           1HB      CYS   3  -7.908   6.240  -2.612
   22    H    GLN   4           H        GLN   4  -6.048   5.223   0.411
   23    HA   GLN   4           HA       GLN   4  -6.478   6.669   2.919
   24    HB2  GLN   4           2HB      GLN   4  -5.646   4.856   4.163
   25    HB3  GLN   4           1HB      GLN   4  -6.661   4.145   2.915
   26    HG2  GLN   4           2HG      GLN   4  -4.826   3.470   1.638
   27    HG3  GLN   4           1HG      GLN   4  -3.687   4.292   2.718
   28   HE21  GLN   4          1HE2      GLN   4  -3.760   1.600   2.008
   29   HE22  GLN   4          2HE2      GLN   4  -4.015   0.667   3.469
   30    H    GLU   5           H        GLU   5  -4.538   7.258   3.993
   31    HA   GLU   5           HA       GLU   5  -2.838   8.498   2.101
   32    HB2  GLU   5           2HB      GLU   5  -2.999   8.581   5.064
   33    HB3  GLU   5           1HB      GLU   5  -1.763   9.471   4.163
   34    HG2  GLU   5           2HG      GLU   5  -3.555  10.625   2.940
   35    HG3  GLU   5           1HG      GLU   5  -4.743   9.755   3.902
   36    H    LYS   6           H        LYS   6  -0.457   8.695   3.014
   37    HA   LYS   6           HA       LYS   6   0.606   6.336   1.959
   38    HB2  LYS   6           2HB      LYS   6   2.805   7.506   2.171
   39    HB3  LYS   6           1HB      LYS   6   1.587   8.388   1.258
   40    HG2  LYS   6           2HG      LYS   6   1.037   9.513   3.358
   41    HG3  LYS   6           1HG      LYS   6   2.532   8.912   4.063
   42    HD2  LYS   6           2HD      LYS   6   2.286  10.680   1.610
   43    HD3  LYS   6           1HD      LYS   6   2.687  11.262   3.224
   44    HE2  LYS   6           2HE      LYS   6   4.720   9.736   3.099
   45    HE3  LYS   6           1HE      LYS   6   4.268   9.510   1.401
   46    HZ1  LYS   6           3HZ      LYS   6   5.937  11.222   1.675
   47    HZ2  LYS   6           1HZ      LYS   6   4.871  12.140   2.602
   48    HZ3  LYS   6           2HZ      LYS   6   4.527  11.811   0.989
   49    H    TRP   7           H        TRP   7   0.903   7.810   5.153
   50    HA   TRP   7           HA       TRP   7   2.685   5.718   6.009
   51    HB2  TRP   7           2HB      TRP   7   1.553   8.058   7.534
   52    HB3  TRP   7           1HB      TRP   7   2.748   6.929   8.164
   53    HD1  TRP   7           HD       TRP   7   2.523  10.143   6.381
   54    HE1  TRP   7           1HE      TRP   7   4.819  10.811   5.420
   55    HE3  TRP   7           3HE      TRP   7   4.979   5.715   6.905
   56    HZ2  TRP   7           2HZ      TRP   7   7.297   9.657   4.949
   57    HZ3  TRP   7           3HZ      TRP   7   7.318   5.585   6.153
   58    HH2  TRP   7           HH       TRP   7   8.446   7.519   5.201
   59    H    GLU   8           H        GLU   8  -0.097   5.022   5.359
   60    HA   GLU   8           HA       GLU   8  -1.168   4.152   7.915
   61    HB2  GLU   8           2HB      GLU   8  -2.094   3.691   5.071
   62    HB3  GLU   8           1HB      GLU   8  -2.911   3.039   6.482
   63    HG2  GLU   8           2HG      GLU   8  -2.511   5.952   5.865
   64    HG3  GLU   8           1HG      GLU   8  -4.009   5.042   5.666
   65    H    TYR   9           H        TYR   9  -2.023   1.550   7.320
   66    HA   TYR   9           HA       TYR   9   0.449   0.200   7.731
   67    HB2  TYR   9           2HB      TYR   9  -2.378  -0.810   7.469
   68    HB3  TYR   9           1HB      TYR   9  -1.008  -1.889   7.638
   69    HD1  TYR   9           2HD      TYR   9  -3.002   0.725   9.335
   70    HD2  TYR   9           1HD      TYR   9   0.051  -2.210   9.735
   71    HE1  TYR   9           2HE      TYR   9  -3.150   0.912  11.766
   72    HE2  TYR   9           1HE      TYR   9  -0.091  -2.040  12.163
   73    HH   TYR   9           HH       TYR   9  -0.818  -0.390  13.842
   74    H    CYS  10           H        CYS  10  -1.541   0.806   5.022
   75    HA   CYS  10           HA       CYS  10  -1.354   0.435   2.805
   76    HB2  CYS  10           2HB      CYS  10   1.003   1.063   2.943
   77    HB3  CYS  10           1HB      CYS  10   1.450  -0.550   3.488
   78    H    ILE  11           H        ILE  11  -2.715  -1.022   2.089
   79    HA   ILE  11           HA       ILE  11  -2.235  -3.798   2.889
   80    HB   ILE  11           HB       ILE  11  -4.669  -4.168   2.751
   81   HG12  ILE  11          2HG1      ILE  11  -4.847  -1.156   2.428
   82   HG13  ILE  11          1HG1      ILE  11  -5.184  -2.355   1.183
   83   HG21  ILE  11          1HG2      ILE  11  -3.832  -1.989   4.658
   84   HG22  ILE  11          2HG2      ILE  11  -3.669  -3.728   4.908
   85   HG23  ILE  11          3HG2      ILE  11  -5.270  -2.995   4.828
   86   HD11  ILE  11          3HD1      ILE  11  -6.703  -2.031   3.750
   87   HD12  ILE  11          1HD1      ILE  11  -7.052  -3.192   2.468
   88   HD13  ILE  11          2HD1      ILE  11  -7.220  -1.461   2.161
   89    H    VAL  12           H        VAL  12  -2.980  -5.400   1.398
   90    HA   VAL  12           HA       VAL  12  -3.099  -4.407  -1.323
   91    HB   VAL  12           HB       VAL  12  -1.841  -6.522  -2.036
   92   HG11  VAL  12          1HG1      VAL  12   0.371  -5.564  -1.490
   93   HG12  VAL  12          2HG1      VAL  12  -0.419  -4.452  -0.368
   94   HG13  VAL  12          3HG1      VAL  12  -0.774  -4.370  -2.094
   95   HG21  VAL  12          3HG2      VAL  12  -1.078  -6.553   0.885
   96   HG22  VAL  12          1HG2      VAL  12  -0.373  -7.557  -0.383
   97   HG23  VAL  12          2HG2      VAL  12  -2.070  -7.760   0.067
   98    HA   PRO  13           HA       PRO  13  -6.977  -6.738  -0.801
   99    HB2  PRO  13           2HB      PRO  13  -7.483  -5.182  -3.281
  100    HB3  PRO  13           1HB      PRO  13  -8.500  -5.361  -1.846
  101    HG2  PRO  13           2HG      PRO  13  -7.215  -3.081  -2.289
  102    HG3  PRO  13           1HG      PRO  13  -7.318  -3.750  -0.651
  103    HD2  PRO  13           2HD      PRO  13  -5.016  -3.817  -2.571
  104    HD3  PRO  13           1HD      PRO  13  -5.023  -3.528  -0.822
  105    H    ILE  14           H        ILE  14  -4.938  -6.143  -3.562
  106    HA   ILE  14           HA       ILE  14  -5.431  -8.826  -4.592
  107    HB   ILE  14           HB       ILE  14  -5.284  -6.242  -6.208
  108   HG12  ILE  14          2HG1      ILE  14  -7.518  -6.622  -5.308
  109   HG13  ILE  14          1HG1      ILE  14  -7.515  -6.826  -7.054
  110   HG21  ILE  14          1HG2      ILE  14  -5.393  -9.038  -7.293
  111   HG22  ILE  14          2HG2      ILE  14  -4.016  -7.939  -7.357
  112   HG23  ILE  14          3HG2      ILE  14  -5.496  -7.551  -8.237
  113   HD11  ILE  14          3HD1      ILE  14  -7.504  -9.260  -6.751
  114   HD12  ILE  14          1HD1      ILE  14  -8.896  -8.502  -5.978
  115   HD13  ILE  14          2HD1      ILE  14  -7.529  -9.034  -5.003
  116    H    LEU  15           H        LEU  15  -3.476  -9.758  -5.361
  117    HA   LEU  15           HA       LEU  15  -1.097  -8.678  -4.247
  118    HB2  LEU  15           2HB      LEU  15  -1.430 -10.913  -6.250
  119    HB3  LEU  15           1HB      LEU  15   0.037 -10.558  -5.366
  120    HG   LEU  15           HG       LEU  15  -2.562 -11.547  -4.188
  121   HD11  LEU  15          1HD1      LEU  15  -1.340 -13.246  -5.419
  122   HD12  LEU  15          2HD1      LEU  15  -1.292 -13.561  -3.685
  123   HD13  LEU  15          3HD1      LEU  15   0.117 -12.881  -4.496
  124   HD21  LEU  15          3HD2      LEU  15  -1.334 -11.704  -2.075
  125   HD22  LEU  15          1HD2      LEU  15  -1.424 -10.035  -2.633
  126   HD23  LEU  15          2HD2      LEU  15   0.070 -10.951  -2.826
  127    H    GLY  16           H        GLY  16   0.174  -7.210  -5.058
  128    HA2  GLY  16           2HA      GLY  16   1.440  -6.178  -6.758
  129    HA3  GLY  16           1HA      GLY  16   0.340  -6.860  -7.954
  130    H    PHE  17           H        PHE  17  -1.518  -5.730  -5.510
  131    HA   PHE  17           HA       PHE  17  -1.746  -3.059  -6.678
  132    HB2  PHE  17           2HB      PHE  17  -3.636  -4.410  -7.458
  133    HB3  PHE  17           1HB      PHE  17  -3.936  -4.933  -5.804
  134    HD1  PHE  17           2HD      PHE  17  -3.828  -1.850  -7.883
  135    HD2  PHE  17           1HD      PHE  17  -5.503  -3.828  -4.527
  136    HE1  PHE  17           2HE      PHE  17  -5.369   0.038  -7.547
  137    HE2  PHE  17           1HE      PHE  17  -7.052  -1.939  -4.178
  138    HZ   PHE  17           HZ       PHE  17  -6.982  -0.007  -5.691
  139    H    VAL  18           H        VAL  18  -1.151  -1.659  -5.172
  140    HA   VAL  18           HA       VAL  18  -1.645  -2.389  -2.393
  141    HB   VAL  18           HB       VAL  18   0.010  -0.676  -1.750
  142   HG11  VAL  18          1HG1      VAL  18   1.054  -2.576  -3.836
  143   HG12  VAL  18          2HG1      VAL  18   0.849  -2.899  -2.112
  144   HG13  VAL  18          3HG1      VAL  18   2.045  -1.725  -2.654
  145   HG21  VAL  18          3HG2      VAL  18  -0.302   0.914  -3.585
  146   HG22  VAL  18          1HG2      VAL  18   0.425  -0.228  -4.714
  147   HG23  VAL  18          2HG2      VAL  18   1.397   0.474  -3.421
  148    H    TYR  19           H        TYR  19  -2.960  -1.273  -1.194
  149    HA   TYR  19           HA       TYR  19  -4.587   0.676  -2.595
  150    HB2  TYR  19           2HB      TYR  19  -5.729  -1.216  -1.556
  151    HB3  TYR  19           1HB      TYR  19  -5.030  -0.776  -0.003
  152    HD1  TYR  19           1HD      TYR  19  -7.305   0.467  -2.657
  153    HD2  TYR  19           2HD      TYR  19  -6.172   0.697   1.434
  154    HE1  TYR  19           1HE      TYR  19  -9.254   1.844  -2.195
  155    HE2  TYR  19           2HE      TYR  19  -8.126   2.085   1.906
  156    HH   TYR  19           HH       TYR  19  -9.719   3.507   0.766
  157    H    CYS  20           H        CYS  20  -3.764   2.594  -2.450
  158    HA   CYS  20           HA       CYS  20  -3.884   4.021   0.012
  159    HB2  CYS  20           2HB      CYS  20  -1.255   3.832  -1.550
  160    HB3  CYS  20           1HB      CYS  20  -1.606   5.096  -0.388
  161    H    CYS  21           H        CYS  21  -3.576   6.357  -0.628
  162    HA   CYS  21           HA       CYS  21  -5.024   6.953  -2.963
  163    HB2  CYS  21           2HB      CYS  21  -3.235   8.744  -1.297
  164    HB3  CYS  21           1HB      CYS  21  -4.270   9.327  -2.598
  165    HA   PRO  22           HA       PRO  22  -2.164   6.608  -6.218
  166    HB2  PRO  22           2HB      PRO  22  -2.976   8.585  -7.915
  167    HB3  PRO  22           1HB      PRO  22  -3.861   7.075  -7.693
  168    HG2  PRO  22           2HG      PRO  22  -4.372   9.757  -6.491
  169    HG3  PRO  22           1HG      PRO  22  -5.530   8.578  -7.133
  170    HD2  PRO  22           2HD      PRO  22  -5.031   8.853  -4.454
  171    HD3  PRO  22           1HD      PRO  22  -5.493   7.306  -5.192
  172    H    GLY  23           H        GLY  23  -0.230   7.325  -6.832
  173    HA2  GLY  23           2HA      GLY  23   1.423   8.992  -7.224
  174    HA3  GLY  23           1HA      GLY  23   0.551  10.047  -6.112
  175    H    LEU  24           H        LEU  24   0.489   7.172  -4.657
  176    HA   LEU  24           HA       LEU  24   2.915   7.793  -3.124
  177    HB2  LEU  24           2HB      LEU  24   0.615   6.088  -2.174
  178    HB3  LEU  24           1HB      LEU  24   1.905   6.801  -1.268
  179    HG   LEU  24           HG       LEU  24  -0.205   8.464  -2.608
  180   HD11  LEU  24          1HD1      LEU  24  -1.074   8.774  -0.331
  181   HD12  LEU  24          2HD1      LEU  24   0.025   7.472   0.197
  182   HD13  LEU  24          3HD1      LEU  24  -1.253   7.149  -0.984
  183   HD21  LEU  24          3HD2      LEU  24   1.950   9.127  -0.594
  184   HD22  LEU  24          1HD2      LEU  24   0.660  10.223  -1.105
  185   HD23  LEU  24          2HD2      LEU  24   1.854   9.662  -2.269
  186    H    ILE  25           H        ILE  25   4.127   6.032  -2.421
  187    HA   ILE  25           HA       ILE  25   3.729   3.572  -3.973
  188    HB   ILE  25           HB       ILE  25   6.223   3.327  -4.127
  189   HG12  ILE  25          2HG1      ILE  25   6.264   6.246  -3.292
  190   HG13  ILE  25          1HG1      ILE  25   6.825   4.904  -2.305
  191   HG21  ILE  25          1HG2      ILE  25   4.958   4.043  -6.053
  192   HG22  ILE  25          2HG2      ILE  25   6.513   4.873  -6.012
  193   HG23  ILE  25          3HG2      ILE  25   5.047   5.723  -5.523
  194   HD11  ILE  25          3HD1      ILE  25   8.001   5.778  -4.936
  195   HD12  ILE  25          1HD1      ILE  25   8.576   4.437  -3.946
  196   HD13  ILE  25          2HD1      ILE  25   8.679   6.090  -3.338
  197    H    CYS  26           H        CYS  26   3.955   1.712  -2.873
  198    HA   CYS  26           HA       CYS  26   4.388   1.963  -0.000
  199    HB2  CYS  26           2HB      CYS  26   2.404   0.711  -1.061
  200    HB3  CYS  26           1HB      CYS  26   3.569  -0.536  -1.502
  201    H    GLY  27           H        GLY  27   6.458   2.329   0.110
  202    HA2  GLY  27           2HA      GLY  27   8.383   0.740  -1.343
  203    HA3  GLY  27           1HA      GLY  27   8.743   2.051  -0.230
  204    HA   PRO  28           HA       PRO  28  10.139  -0.864   2.690
  205    HB2  PRO  28           2HB      PRO  28   9.326   0.284   5.071
  206    HB3  PRO  28           1HB      PRO  28  10.766   0.760   4.169
  207    HG2  PRO  28           2HG      PRO  28   8.076   2.046   4.248
  208    HG3  PRO  28           1HG      PRO  28   9.679   2.792   4.148
  209    HD2  PRO  28           2HD      PRO  28   8.033   2.550   2.010
  210    HD3  PRO  28           1HD      PRO  28   9.800   2.520   1.867
  211    H    PHE  29           H        PHE  29   7.365   0.088   4.663
  212    HA   PHE  29           HA       PHE  29   6.045  -2.438   3.936
  213    HB2  PHE  29           2HB      PHE  29   6.268  -1.319   6.755
  214    HB3  PHE  29           1HB      PHE  29   5.408  -2.771   6.282
  215    HD1  PHE  29           1HD      PHE  29   6.757  -4.714   5.363
  216    HD2  PHE  29           2HD      PHE  29   8.523  -1.387   7.337
  217    HE1  PHE  29           1HE      PHE  29   8.779  -6.048   5.803
  218    HE2  PHE  29           2HE      PHE  29  10.542  -2.709   7.776
  219    HZ   PHE  29           HZ       PHE  29  10.674  -5.046   7.012
  220    H    VAL  30           H        VAL  30   5.912   0.711   3.691
  221    HA   VAL  30           HA       VAL  30   3.035   0.947   4.058
  222    HB   VAL  30           HB       VAL  30   3.278   3.148   5.145
  223   HG11  VAL  30          1HG1      VAL  30   4.004   2.426   7.360
  224   HG12  VAL  30          2HG1      VAL  30   4.692   0.964   6.646
  225   HG13  VAL  30          3HG1      VAL  30   2.952   1.242   6.586
  226   HG21  VAL  30          3HG2      VAL  30   5.467   3.829   6.097
  227   HG22  VAL  30          1HG2      VAL  30   5.454   3.809   4.331
  228   HG23  VAL  30          2HG2      VAL  30   6.218   2.498   5.218
  229    H    CYS  31           H        CYS  31   2.346   3.082   3.096
  230    HA   CYS  31           HA       CYS  31   3.723   3.554   0.599
  231    HB2  CYS  31           2HB      CYS  31   1.138   4.530   1.788
  232    HB3  CYS  31           1HB      CYS  31   1.748   5.093   0.220
  233    H    VAL  32           H        VAL  32   3.896   5.922   0.014
  234    HA   VAL  32           HA       VAL  32   4.646   7.773   1.846
  235    HB   VAL  32           HB       VAL  32   6.337   6.236   2.637
  236   HG11  VAL  32          1HG1      VAL  32   6.652   4.838   0.644
  237   HG12  VAL  32          2HG1      VAL  32   8.208   5.458   1.197
  238   HG13  VAL  32          3HG1      VAL  32   7.414   6.188  -0.199
  239   HG21  VAL  32          3HG2      VAL  32   8.304   7.595   2.430
  240   HG22  VAL  32          1HG2      VAL  32   6.874   8.602   2.595
  241   HG23  VAL  32          2HG2      VAL  32   7.641   8.402   1.009
  Start of MODEL   10
    1    H1   ARG   1           H        ARG   1 -12.206   9.324  -5.027
    2    HA   ARG   1           HA       ARG   1 -11.611   6.562  -5.409
    3    HB2  ARG   1           2HB      ARG   1  -9.423   8.636  -5.514
    4    HB3  ARG   1           1HB      ARG   1  -9.144   6.937  -5.188
    5    HG2  ARG   1           2HG      ARG   1 -10.333   8.065  -7.713
    6    HG3  ARG   1           1HG      ARG   1  -8.669   7.507  -7.511
    7    HD2  ARG   1           2HD      ARG   1 -11.169   5.830  -7.257
    8    HD3  ARG   1           1HD      ARG   1 -10.015   5.790  -8.585
    9    HE   ARG   1           HE       ARG   1  -8.375   5.168  -6.746
   10   HH11  ARG   1          1HH1      ARG   1 -11.747   4.082  -6.926
   11   HH12  ARG   1          2HH1      ARG   1 -11.512   2.678  -6.011
   12   HH21  ARG   1          1HH2      ARG   1  -8.046   3.190  -5.457
   13   HH22  ARG   1          2HH2      ARG   1  -9.342   2.134  -5.189
   14    H    ASP   2           H        ASP   2 -12.176   5.878  -3.485
   15    HA   ASP   2           HA       ASP   2 -11.474   7.428  -1.128
   16    HB2  ASP   2           2HB      ASP   2 -13.734   6.421  -1.214
   17    HB3  ASP   2           1HB      ASP   2 -13.014   4.826  -1.386
   18    H    CYS   3           H        CYS   3  -9.392   7.246  -0.862
   19    HA   CYS   3           HA       CYS   3  -8.179   4.577  -0.924
   20    HB2  CYS   3           2HB      CYS   3  -6.123   5.816  -1.621
   21    HB3  CYS   3           1HB      CYS   3  -7.430   5.823  -2.805
   22    H    GLN   4           H        GLN   4  -5.880   4.853   0.210
   23    HA   GLN   4           HA       GLN   4  -6.468   6.012   2.842
   24    HB2  GLN   4           2HB      GLN   4  -5.489   4.135   3.881
   25    HB3  GLN   4           1HB      GLN   4  -6.407   3.499   2.520
   26    HG2  GLN   4           2HG      GLN   4  -4.500   3.168   1.219
   27    HG3  GLN   4           1HG      GLN   4  -3.451   3.945   2.416
   28   HE21  GLN   4          1HE2      GLN   4  -3.239   1.324   1.327
   29   HE22  GLN   4          2HE2      GLN   4  -3.432   0.223   2.660
   30    H    GLU   5           H        GLU   5  -4.678   6.677   4.020
   31    HA   GLU   5           HA       GLU   5  -3.034   8.383   2.581
   32    HB2  GLU   5           2HB      GLU   5  -3.374   7.600   5.402
   33    HB3  GLU   5           1HB      GLU   5  -2.043   8.644   4.906
   34    HG2  GLU   5           2HG      GLU   5  -4.791   9.109   4.042
   35    HG3  GLU   5           1HG      GLU   5  -4.271   9.726   5.616
   36    H    LYS   6           H        LYS   6  -0.805   8.612   3.118
   37    HA   LYS   6           HA       LYS   6   0.560   6.356   2.093
   38    HB2  LYS   6           2HB      LYS   6   2.632   7.840   2.283
   39    HB3  LYS   6           1HB      LYS   6   1.343   8.404   1.229
   40    HG2  LYS   6           2HG      LYS   6   0.520   9.695   3.061
   41    HG3  LYS   6           1HG      LYS   6   1.989   9.389   4.000
   42    HD2  LYS   6           2HD      LYS   6   1.768  10.788   1.313
   43    HD3  LYS   6           1HD      LYS   6   1.987  11.610   2.853
   44    HE2  LYS   6           2HE      LYS   6   4.176  10.349   3.065
   45    HE3  LYS   6           1HE      LYS   6   3.892   9.807   1.406
   46    HZ1  LYS   6           3HZ      LYS   6   5.332  11.757   1.525
   47    HZ2  LYS   6           1HZ      LYS   6   4.086  12.646   2.207
   48    HZ3  LYS   6           2HZ      LYS   6   3.949  12.052   0.632
   49    H    TRP   7           H        TRP   7   0.740   8.098   5.160
   50    HA   TRP   7           HA       TRP   7   2.627   6.185   6.180
   51    HB2  TRP   7           2HB      TRP   7   1.391   8.596   7.498
   52    HB3  TRP   7           1HB      TRP   7   2.662   7.599   8.203
   53    HD1  TRP   7           HD       TRP   7   2.253  10.642   6.216
   54    HE1  TRP   7           1HE      TRP   7   4.457  11.304   5.066
   55    HE3  TRP   7           3HE      TRP   7   4.884   6.306   6.837
   56    HZ2  TRP   7           2HZ      TRP   7   6.919  10.190   4.509
   57    HZ3  TRP   7           3HZ      TRP   7   7.186   6.210   5.922
   58    HH2  TRP   7           HH       TRP   7   8.161   8.105   4.796
   59    H    GLU   8           H        GLU   8   0.021   5.140   5.582
   60    HA   GLU   8           HA       GLU   8  -1.131   4.463   8.170
   61    HB2  GLU   8           2HB      GLU   8  -1.737   3.456   5.369
   62    HB3  GLU   8           1HB      GLU   8  -2.635   3.032   6.818
   63    HG2  GLU   8           2HG      GLU   8  -2.394   5.776   5.649
   64    HG3  GLU   8           1HG      GLU   8  -3.788   4.709   5.505
   65    H    TYR   9           H        TYR   9  -1.626   1.642   7.423
   66    HA   TYR   9           HA       TYR   9   1.082   0.651   7.856
   67    HB2  TYR   9           2HB      TYR   9  -1.616  -0.661   8.235
   68    HB3  TYR   9           1HB      TYR   9  -0.093  -1.536   8.372
   69    HD1  TYR   9           1HD      TYR   9  -2.127   1.175   9.850
   70    HD2  TYR   9           2HD      TYR   9   1.260  -1.353  10.316
   71    HE1  TYR   9           1HE      TYR   9  -1.913   1.901  12.166
   72    HE2  TYR   9           2HE      TYR   9   1.483  -0.637  12.638
   73    HH   TYR   9           HH       TYR   9  -0.952   1.140  14.251
   74    H    CYS  10           H        CYS  10  -1.230   1.022   5.529
   75    HA   CYS  10           HA       CYS  10  -1.291   0.707   3.338
   76    HB2  CYS  10           2HB      CYS  10   1.082   1.133   3.248
   77    HB3  CYS  10           1HB      CYS  10   1.456  -0.543   3.654
   78    H    ILE  11           H        ILE  11  -2.042  -0.834   1.829
   79    HA   ILE  11           HA       ILE  11  -2.647  -3.408   3.110
   80    HB   ILE  11           HB       ILE  11  -4.339  -1.764   1.201
   81   HG12  ILE  11          2HG1      ILE  11  -4.860  -2.635   4.051
   82   HG13  ILE  11          1HG1      ILE  11  -4.376  -1.019   3.563
   83   HG21  ILE  11          1HG2      ILE  11  -6.051  -3.525   1.381
   84   HG22  ILE  11          2HG2      ILE  11  -4.918  -4.514   2.300
   85   HG23  ILE  11          3HG2      ILE  11  -4.572  -4.113   0.618
   86   HD11  ILE  11          3HD1      ILE  11  -6.478  -0.790   2.319
   87   HD12  ILE  11          1HD1      ILE  11  -6.748  -1.123   4.030
   88   HD13  ILE  11          2HD1      ILE  11  -6.945  -2.409   2.839
   89    H    VAL  12           H        VAL  12  -2.137  -5.196   1.985
   90    HA   VAL  12           HA       VAL  12  -1.375  -4.872  -0.786
   91    HB   VAL  12           HB       VAL  12   0.721  -4.645   0.341
   92   HG11  VAL  12          1HG1      VAL  12   0.083  -7.147   1.878
   93   HG12  VAL  12          2HG1      VAL  12   0.162  -5.504   2.516
   94   HG13  VAL  12          3HG1      VAL  12   1.624  -6.289   1.915
   95   HG21  VAL  12          3HG2      VAL  12   2.002  -6.595  -0.453
   96   HG22  VAL  12          1HG2      VAL  12   0.830  -6.032  -1.646
   97   HG23  VAL  12          2HG2      VAL  12   0.490  -7.469  -0.687
   98    HA   PRO  13           HA       PRO  13  -4.128  -8.512  -0.700
   99    HB2  PRO  13           2HB      PRO  13  -4.122  -7.886  -3.602
  100    HB3  PRO  13           1HB      PRO  13  -5.498  -8.111  -2.517
  101    HG2  PRO  13           2HG      PRO  13  -4.862  -5.682  -3.410
  102    HG3  PRO  13           1HG      PRO  13  -5.414  -5.924  -1.741
  103    HD2  PRO  13           2HD      PRO  13  -2.626  -5.534  -2.773
  104    HD3  PRO  13           1HD      PRO  13  -3.410  -4.825  -1.343
  105    H    ILE  14           H        ILE  14  -1.822  -7.756  -3.273
  106    HA   ILE  14           HA       ILE  14  -0.537 -10.323  -2.894
  107    HB   ILE  14           HB       ILE  14  -0.188 -10.535  -5.370
  108   HG12  ILE  14          2HG1      ILE  14  -2.303  -8.368  -5.577
  109   HG13  ILE  14          1HG1      ILE  14  -0.600  -8.205  -5.989
  110   HG21  ILE  14          1HG2      ILE  14  -3.065 -10.648  -4.493
  111   HG22  ILE  14          2HG2      ILE  14  -1.859 -11.929  -4.350
  112   HG23  ILE  14          3HG2      ILE  14  -2.415 -11.415  -5.940
  113   HD11  ILE  14          3HD1      ILE  14  -2.576 -10.007  -7.370
  114   HD12  ILE  14          1HD1      ILE  14  -0.877  -9.817  -7.797
  115   HD13  ILE  14          2HD1      ILE  14  -1.988  -8.458  -7.974
  116    H    LEU  15           H        LEU  15   1.695 -10.220  -3.480
  117    HA   LEU  15           HA       LEU  15   2.863  -7.731  -2.826
  118    HB2  LEU  15           2HB      LEU  15   3.780 -10.084  -2.413
  119    HB3  LEU  15           1HB      LEU  15   4.234 -10.113  -4.097
  120    HG   LEU  15           HG       LEU  15   6.132  -9.665  -2.575
  121   HD11  LEU  15          1HD1      LEU  15   5.527  -7.333  -4.369
  122   HD12  LEU  15          2HD1      LEU  15   6.297  -8.844  -4.847
  123   HD13  LEU  15          3HD1      LEU  15   7.110  -7.759  -3.717
  124   HD21  LEU  15          3HD2      LEU  15   4.699  -7.097  -1.943
  125   HD22  LEU  15          1HD2      LEU  15   6.322  -7.537  -1.421
  126   HD23  LEU  15          2HD2      LEU  15   4.931  -8.456  -0.843
  127    H    GLY  16           H        GLY  16   3.487  -6.100  -4.122
  128    HA2  GLY  16           2HA      GLY  16   4.427  -5.234  -6.126
  129    HA3  GLY  16           1HA      GLY  16   3.760  -6.612  -6.995
  130    H    PHE  17           H        PHE  17   1.496  -5.642  -4.878
  131    HA   PHE  17           HA       PHE  17   0.131  -3.971  -6.865
  132    HB2  PHE  17           2HB      PHE  17  -0.862  -6.211  -6.307
  133    HB3  PHE  17           1HB      PHE  17  -1.040  -5.670  -4.646
  134    HD1  PHE  17           2HD      PHE  17  -2.643  -3.776  -4.166
  135    HD2  PHE  17           1HD      PHE  17  -2.393  -5.690  -7.958
  136    HE1  PHE  17           2HE      PHE  17  -4.862  -2.903  -4.752
  137    HE2  PHE  17           1HE      PHE  17  -4.599  -4.822  -8.544
  138    HZ   PHE  17           HZ       PHE  17  -5.837  -3.426  -6.952
  139    H    VAL  18           H        VAL  18  -0.205  -1.922  -6.210
  140    HA   VAL  18           HA       VAL  18   0.359  -1.292  -3.423
  141    HB   VAL  18           HB       VAL  18   0.405   0.539  -5.841
  142   HG11  VAL  18          1HG1      VAL  18   1.443   2.194  -4.355
  143   HG12  VAL  18          2HG1      VAL  18   1.234   1.095  -2.992
  144   HG13  VAL  18          3HG1      VAL  18  -0.179   1.759  -3.810
  145   HG21  VAL  18          3HG2      VAL  18   2.687  -0.607  -4.231
  146   HG22  VAL  18          1HG2      VAL  18   2.841   0.560  -5.544
  147   HG23  VAL  18          2HG2      VAL  18   2.245  -1.068  -5.874
  148    H    TYR  19           H        TYR  19  -1.273  -0.593  -2.178
  149    HA   TYR  19           HA       TYR  19  -3.460   0.806  -3.492
  150    HB2  TYR  19           2HB      TYR  19  -4.470  -1.324  -2.940
  151    HB3  TYR  19           1HB      TYR  19  -3.850  -1.240  -1.289
  152    HD1  TYR  19           2HD      TYR  19  -6.229   0.409  -3.651
  153    HD2  TYR  19           1HD      TYR  19  -5.060  -0.094   0.411
  154    HE1  TYR  19           2HE      TYR  19  -8.217   1.648  -2.917
  155    HE2  TYR  19           1HE      TYR  19  -7.037   1.143   1.145
  156    HH   TYR  19           HH       TYR  19  -9.607   1.904  -0.923
  157    H    CYS  20           H        CYS  20  -3.120   2.746  -2.984
  158    HA   CYS  20           HA       CYS  20  -3.701   3.737  -0.411
  159    HB2  CYS  20           2HB      CYS  20  -0.896   4.121  -1.560
  160    HB3  CYS  20           1HB      CYS  20  -1.614   5.252  -0.426
  161    H    CYS  21           H        CYS  21  -3.433   6.277  -0.767
  162    HA   CYS  21           HA       CYS  21  -4.912   6.971  -3.034
  163    HB2  CYS  21           2HB      CYS  21  -3.177   8.602  -1.209
  164    HB3  CYS  21           1HB      CYS  21  -4.158   9.337  -2.490
  165    HA   PRO  22           HA       PRO  22  -2.237   6.997  -6.453
  166    HB2  PRO  22           2HB      PRO  22  -2.937   9.295  -7.778
  167    HB3  PRO  22           1HB      PRO  22  -3.899   7.813  -7.803
  168    HG2  PRO  22           2HG      PRO  22  -4.259  10.273  -6.144
  169    HG3  PRO  22           1HG      PRO  22  -5.484   9.286  -6.962
  170    HD2  PRO  22           2HD      PRO  22  -5.016   9.087  -4.319
  171    HD3  PRO  22           1HD      PRO  22  -5.475   7.675  -5.285
  172    H    GLY  23           H        GLY  23  -0.222   7.574  -6.928
  173    HA2  GLY  23           2HA      GLY  23   1.552   9.120  -7.219
  174    HA3  GLY  23           1HA      GLY  23   0.765  10.191  -6.065
  175    H    LEU  24           H        LEU  24   0.407   7.439  -4.538
  176    HA   LEU  24           HA       LEU  24   2.889   7.848  -3.034
  177    HB2  LEU  24           2HB      LEU  24   0.623   6.100  -2.083
  178    HB3  LEU  24           1HB      LEU  24   1.886   6.872  -1.222
  179    HG   LEU  24           HG       LEU  24  -0.252   8.500  -2.537
  180   HD11  LEU  24          1HD1      LEU  24  -0.057   7.423   0.244
  181   HD12  LEU  24          2HD1      LEU  24  -1.358   7.201  -0.940
  182   HD13  LEU  24          3HD1      LEU  24  -1.088   8.782  -0.209
  183   HD21  LEU  24          3HD2      LEU  24   0.595  10.232  -0.967
  184   HD22  LEU  24          1HD2      LEU  24   1.779   9.712  -2.167
  185   HD23  LEU  24          2HD2      LEU  24   1.902   9.126  -0.520
  186    H    ILE  25           H        ILE  25   4.026   6.024  -2.302
  187    HA   ILE  25           HA       ILE  25   3.557   3.598  -3.873
  188    HB   ILE  25           HB       ILE  25   6.000   3.192  -3.952
  189   HG12  ILE  25          2HG1      ILE  25   6.291   6.102  -3.153
  190   HG13  ILE  25          1HG1      ILE  25   6.657   4.732  -2.113
  191   HG21  ILE  25          1HG2      ILE  25   4.878   3.999  -5.920
  192   HG22  ILE  25          2HG2      ILE  25   6.480   4.735  -5.821
  193   HG23  ILE  25          3HG2      ILE  25   5.050   5.667  -5.377
  194   HD11  ILE  25          3HD1      ILE  25   8.682   5.647  -3.055
  195   HD12  ILE  25          1HD1      ILE  25   8.047   5.437  -4.689
  196   HD13  ILE  25          2HD1      ILE  25   8.399   4.028  -3.690
  197    H    CYS  26           H        CYS  26   3.436   1.824  -2.727
  198    HA   CYS  26           HA       CYS  26   4.062   1.948   0.100
  199    HB2  CYS  26           2HB      CYS  26   1.986   0.901  -0.848
  200    HB3  CYS  26           1HB      CYS  26   2.993  -0.395  -1.505
  201    H    GLY  27           H        GLY  27   6.142   1.952   0.342
  202    HA2  GLY  27           2HA      GLY  27   7.797   0.341  -1.453
  203    HA3  GLY  27           1HA      GLY  27   8.352   1.661  -0.438
  204    HA   PRO  28           HA       PRO  28   9.998  -1.223   2.349
  205    HB2  PRO  28           2HB      PRO  28   9.634  -0.003   4.770
  206    HB3  PRO  28           1HB      PRO  28  10.863   0.489   3.602
  207    HG2  PRO  28           2HG      PRO  28   8.183   1.688   4.156
  208    HG3  PRO  28           1HG      PRO  28   9.722   2.494   3.810
  209    HD2  PRO  28           2HD      PRO  28   7.767   2.202   1.949
  210    HD3  PRO  28           1HD      PRO  28   9.488   2.224   1.532
  211    H    PHE  29           H        PHE  29   6.843  -0.030   3.276
  212    HA   PHE  29           HA       PHE  29   5.687  -2.522   3.759
  213    HB2  PHE  29           2HB      PHE  29   7.105  -2.502   5.786
  214    HB3  PHE  29           1HB      PHE  29   6.498  -0.909   6.206
  215    HD1  PHE  29           1HD      PHE  29   5.639  -4.455   5.928
  216    HD2  PHE  29           2HD      PHE  29   4.449  -0.649   7.301
  217    HE1  PHE  29           1HE      PHE  29   3.855  -5.516   7.265
  218    HE2  PHE  29           2HE      PHE  29   2.649  -1.675   8.653
  219    HZ   PHE  29           HZ       PHE  29   2.357  -4.122   8.631
  220    H    VAL  30           H        VAL  30   5.932   0.902   4.443
  221    HA   VAL  30           HA       VAL  30   3.026   1.175   4.288
  222    HB   VAL  30           HB       VAL  30   3.297   3.320   5.386
  223   HG11  VAL  30          1HG1      VAL  30   3.144   1.371   6.829
  224   HG12  VAL  30          2HG1      VAL  30   4.158   2.628   7.545
  225   HG13  VAL  30          3HG1      VAL  30   4.905   1.219   6.796
  226   HG21  VAL  30          3HG2      VAL  30   6.267   2.782   5.295
  227   HG22  VAL  30          1HG2      VAL  30   5.505   4.098   6.195
  228   HG23  VAL  30          2HG2      VAL  30   5.397   4.050   4.438
  229    H    CYS  31           H        CYS  31   2.481   3.416   3.361
  230    HA   CYS  31           HA       CYS  31   3.800   3.689   0.797
  231    HB2  CYS  31           2HB      CYS  31   1.212   4.623   1.954
  232    HB3  CYS  31           1HB      CYS  31   1.819   5.287   0.422
  233    H    VAL  32           H        VAL  32   3.792   6.059   0.114
  234    HA   VAL  32           HA       VAL  32   4.483   8.079   1.830
  235    HB   VAL  32           HB       VAL  32   6.383   6.741   2.532
  236   HG11  VAL  32          1HG1      VAL  32   7.191   6.659  -0.392
  237   HG12  VAL  32          2HG1      VAL  32   6.652   5.285   0.574
  238   HG13  VAL  32          3HG1      VAL  32   8.185   6.077   0.944
  239   HG21  VAL  32          3HG2      VAL  32   8.228   8.256   2.030
  240   HG22  VAL  32          1HG2      VAL  32   6.741   9.112   2.410
  241   HG23  VAL  32          2HG2      VAL  32   7.278   8.992   0.727
  Start of MODEL   11
    1    H1   ARG   1           H        ARG   1 -14.521   8.972  -3.811
    2    HA   ARG   1           HA       ARG   1 -13.692   6.331  -4.270
    3    HB2  ARG   1           2HB      ARG   1 -11.882   8.509  -5.262
    4    HB3  ARG   1           1HB      ARG   1 -11.371   6.881  -4.891
    5    HG2  ARG   1           2HG      ARG   1 -13.417   7.609  -6.995
    6    HG3  ARG   1           1HG      ARG   1 -11.721   7.240  -7.319
    7    HD2  ARG   1           2HD      ARG   1 -13.772   5.376  -6.122
    8    HD3  ARG   1           1HD      ARG   1 -13.077   5.287  -7.739
    9    HE   ARG   1           HE       ARG   1 -10.929   5.247  -6.067
   10   HH11  ARG   1          1HH1      ARG   1 -13.763   3.196  -6.463
   11   HH12  ARG   1          2HH1      ARG   1 -12.984   1.809  -5.854
   12   HH21  ARG   1          1HH2      ARG   1  -9.905   3.396  -5.256
   13   HH22  ARG   1          2HH2      ARG   1 -10.740   1.904  -5.181
   14    H    ASP   2           H        ASP   2 -12.696   5.607  -2.561
   15    HA   ASP   2           HA       ASP   2 -11.658   7.646  -0.815
   16    HB2  ASP   2           2HB      ASP   2 -12.315   6.467   1.116
   17    HB3  ASP   2           1HB      ASP   2 -13.713   6.495   0.070
   18    H    CYS   3           H        CYS   3  -9.747   7.438  -0.148
   19    HA   CYS   3           HA       CYS   3  -8.274   4.924  -0.466
   20    HB2  CYS   3           2HB      CYS   3  -6.343   6.118  -1.408
   21    HB3  CYS   3           1HB      CYS   3  -7.738   6.225  -2.471
   22    H    GLN   4           H        GLN   4  -5.981   5.280   0.585
   23    HA   GLN   4           HA       GLN   4  -6.489   6.640   3.151
   24    HB2  GLN   4           2HB      GLN   4  -5.494   4.788   4.319
   25    HB3  GLN   4           1HB      GLN   4  -6.693   4.161   3.200
   26    HG2  GLN   4           2HG      GLN   4  -5.047   3.512   1.644
   27    HG3  GLN   4           1HG      GLN   4  -3.764   4.166   2.663
   28   HE21  GLN   4          1HE2      GLN   4  -4.206   1.495   1.684
   29   HE22  GLN   4          2HE2      GLN   4  -4.272   0.465   3.055
   30    H    GLU   5           H        GLU   5  -4.568   7.161   4.276
   31    HA   GLU   5           HA       GLU   5  -2.928   8.703   2.597
   32    HB2  GLU   5           2HB      GLU   5  -2.858   8.062   5.482
   33    HB3  GLU   5           1HB      GLU   5  -1.647   9.138   4.762
   34    HG2  GLU   5           2HG      GLU   5  -3.596  10.551   4.029
   35    HG3  GLU   5           1HG      GLU   5  -4.624   9.499   5.007
   36    H    LYS   6           H        LYS   6  -0.536   8.734   3.033
   37    HA   LYS   6           HA       LYS   6   0.464   6.414   1.828
   38    HB2  LYS   6           2HB      LYS   6   2.641   7.611   1.800
   39    HB3  LYS   6           1HB      LYS   6   1.328   8.635   1.235
   40    HG2  LYS   6           2HG      LYS   6   1.245   9.183   3.768
   41    HG3  LYS   6           1HG      LYS   6   2.945   8.809   3.682
   42    HD2  LYS   6           2HD      LYS   6   1.611  10.818   1.856
   43    HD3  LYS   6           1HD      LYS   6   2.356  11.261   3.382
   44    HE2  LYS   6           2HE      LYS   6   4.482  10.285   2.517
   45    HE3  LYS   6           1HE      LYS   6   3.680  10.087   0.958
   46    HZ1  LYS   6           3HZ      LYS   6   3.257  12.511   0.953
   47    HZ2  LYS   6           1HZ      LYS   6   4.905  12.147   1.021
   48    HZ3  LYS   6           2HZ      LYS   6   4.104  12.631   2.406
   49    H    TRP   7           H        TRP   7   0.933   7.790   5.067
   50    HA   TRP   7           HA       TRP   7   2.755   5.681   5.796
   51    HB2  TRP   7           2HB      TRP   7   1.584   7.903   7.468
   52    HB3  TRP   7           1HB      TRP   7   2.887   6.831   7.970
   53    HD1  TRP   7           HD       TRP   7   2.332  10.121   6.423
   54    HE1  TRP   7           1HE      TRP   7   4.491  11.042   5.387
   55    HE3  TRP   7           3HE      TRP   7   5.150   5.875   6.464
   56    HZ2  TRP   7           2HZ      TRP   7   7.023  10.123   4.676
   57    HZ3  TRP   7           3HZ      TRP   7   7.445   5.989   5.564
   58    HH2  TRP   7           HH       TRP   7   8.344   8.085   4.688
   59    H    GLU   8           H        GLU   8  -0.072   5.059   5.189
   60    HA   GLU   8           HA       GLU   8  -1.182   4.091   7.691
   61    HB2  GLU   8           2HB      GLU   8  -2.125   3.923   4.833
   62    HB3  GLU   8           1HB      GLU   8  -2.990   3.226   6.195
   63    HG2  GLU   8           2HG      GLU   8  -2.328   6.129   5.879
   64    HG3  GLU   8           1HG      GLU   8  -3.881   5.394   5.477
   65    H    TYR   9           H        TYR   9  -2.220   1.692   7.035
   66    HA   TYR   9           HA       TYR   9   0.006  -0.012   7.192
   67    HB2  TYR   9           2HB      TYR   9  -2.910  -0.657   6.757
   68    HB3  TYR   9           1HB      TYR   9  -1.666  -1.865   7.058
   69    HD1  TYR   9           1HD      TYR   9  -0.347  -1.692   9.238
   70    HD2  TYR   9           2HD      TYR   9  -3.980   0.431   8.567
   71    HE1  TYR   9           1HE      TYR   9  -0.618  -1.407  11.649
   72    HE2  TYR   9           2HE      TYR   9  -4.254   0.726  10.987
   73    HH   TYR   9           HH       TYR   9  -1.755   0.105  13.187
   74    H    CYS  10           H        CYS  10  -1.360   1.403   4.529
   75    HA   CYS  10           HA       CYS  10  -0.966   1.328   2.330
   76    HB2  CYS  10           2HB      CYS  10   1.319   1.224   2.691
   77    HB3  CYS  10           1HB      CYS  10   1.298  -0.459   3.214
   78    H    ILE  11           H        ILE  11  -0.276  -2.118   2.892
   79    HA   ILE  11           HA       ILE  11  -2.460  -2.677   1.057
   80    HB   ILE  11           HB       ILE  11  -0.371  -4.548   2.224
   81   HG12  ILE  11          2HG1      ILE  11   0.689  -2.940   0.705
   82   HG13  ILE  11          1HG1      ILE  11   0.678  -4.545  -0.008
   83   HG21  ILE  11          1HG2      ILE  11  -2.427  -4.976   0.069
   84   HG22  ILE  11          2HG2      ILE  11  -2.377  -5.752   1.654
   85   HG23  ILE  11          3HG2      ILE  11  -1.134  -6.104   0.450
   86   HD11  ILE  11          3HD1      ILE  11  -1.227  -3.891  -1.410
   87   HD12  ILE  11          1HD1      ILE  11   0.173  -2.846  -1.661
   88   HD13  ILE  11          2HD1      ILE  11  -1.186  -2.277  -0.696
   89    H    VAL  12           H        VAL  12  -4.248  -3.617   1.793
   90    HA   VAL  12           HA       VAL  12  -4.477  -3.632   4.658
   91    HB   VAL  12           HB       VAL  12  -6.966  -3.760   4.220
   92   HG11  VAL  12          1HG1      VAL  12  -5.416  -1.456   3.028
   93   HG12  VAL  12          2HG1      VAL  12  -5.818  -1.664   4.732
   94   HG13  VAL  12          3HG1      VAL  12  -7.097  -1.391   3.552
   95   HG21  VAL  12          3HG2      VAL  12  -7.725  -3.157   1.937
   96   HG22  VAL  12          1HG2      VAL  12  -6.888  -4.711   1.955
   97   HG23  VAL  12          2HG2      VAL  12  -6.064  -3.269   1.369
   98    HA   PRO  13           HA       PRO  13  -4.575  -8.060   4.698
   99    HB2  PRO  13           2HB      PRO  13  -4.723  -8.368   7.366
  100    HB3  PRO  13           1HB      PRO  13  -3.228  -7.843   6.586
  101    HG2  PRO  13           2HG      PRO  13  -5.268  -6.227   8.052
  102    HG3  PRO  13           1HG      PRO  13  -3.504  -6.083   8.062
  103    HD2  PRO  13           2HD      PRO  13  -5.195  -4.485   6.580
  104    HD3  PRO  13           1HD      PRO  13  -3.485  -4.769   6.197
  105    H    ILE  14           H        ILE  14  -6.938  -5.861   5.479
  106    HA   ILE  14           HA       ILE  14  -8.950  -7.935   5.993
  107    HB   ILE  14           HB       ILE  14  -9.316  -4.947   6.348
  108   HG12  ILE  14          2HG1      ILE  14  -8.666  -6.940   8.527
  109   HG13  ILE  14          1HG1      ILE  14  -7.501  -5.805   7.848
  110   HG21  ILE  14          1HG2      ILE  14 -11.213  -5.660   7.767
  111   HG22  ILE  14          2HG2      ILE  14 -10.831  -7.341   7.414
  112   HG23  ILE  14          3HG2      ILE  14 -11.361  -6.269   6.116
  113   HD11  ILE  14          3HD1      ILE  14  -8.865  -3.946   8.627
  114   HD12  ILE  14          1HD1      ILE  14  -8.403  -5.011   9.953
  115   HD13  ILE  14          2HD1      ILE  14 -10.036  -5.084   9.290
  116    H    LEU  15           H        LEU  15 -10.209  -8.331   4.286
  117    HA   LEU  15           HA       LEU  15  -9.889  -6.800   1.890
  118    HB2  LEU  15           2HB      LEU  15 -11.790  -9.063   2.495
  119    HB3  LEU  15           1HB      LEU  15 -11.492  -8.387   0.907
  120    HG   LEU  15           HG       LEU  15  -9.506  -9.883   2.608
  121   HD11  LEU  15          1HD1      LEU  15 -10.884 -10.639   0.042
  122   HD12  LEU  15          2HD1      LEU  15 -11.181 -11.330   1.636
  123   HD13  LEU  15          3HD1      LEU  15  -9.623 -11.571   0.846
  124   HD21  LEU  15          3HD2      LEU  15  -8.351  -8.168   1.338
  125   HD22  LEU  15          1HD2      LEU  15  -9.183  -8.664  -0.138
  126   HD23  LEU  15          2HD2      LEU  15  -8.030  -9.749   0.633
  127    H    GLY  16           H        GLY  16 -11.436  -5.586   0.843
  128    HA2  GLY  16           2HA      GLY  16 -13.623  -4.626   0.710
  129    HA3  GLY  16           1HA      GLY  16 -13.780  -4.884   2.446
  130    H    PHE  17           H        PHE  17 -10.757  -3.853   1.802
  131    HA   PHE  17           HA       PHE  17 -11.466  -1.054   2.276
  132    HB2  PHE  17           2HB      PHE  17  -9.167  -2.682   3.331
  133    HB3  PHE  17           1HB      PHE  17  -9.099  -0.927   3.277
  134    HD1  PHE  17           2HD      PHE  17 -10.582   0.401   4.675
  135    HD2  PHE  17           1HD      PHE  17 -10.486  -3.835   4.927
  136    HE1  PHE  17           2HE      PHE  17 -11.721   0.516   6.845
  137    HE2  PHE  17           1HE      PHE  17 -11.625  -3.724   7.117
  138    HZ   PHE  17           HZ       PHE  17 -12.238  -1.554   8.070
  139    H    VAL  18           H        VAL  18  -9.397   0.347   1.663
  140    HA   VAL  18           HA       VAL  18  -8.873  -0.414  -1.109
  141    HB   VAL  18           HB       VAL  18  -8.651   2.047  -1.566
  142   HG11  VAL  18          1HG1      VAL  18 -11.289   1.079  -0.497
  143   HG12  VAL  18          2HG1      VAL  18 -10.674   0.834  -2.132
  144   HG13  VAL  18          3HG1      VAL  18 -11.071   2.462  -1.570
  145   HG21  VAL  18          3HG2      VAL  18  -9.701   3.584   0.072
  146   HG22  VAL  18          1HG2      VAL  18  -8.218   2.845   0.688
  147   HG23  VAL  18          2HG2      VAL  18  -9.790   2.253   1.219
  148    H    TYR  19           H        TYR  19  -7.066   1.172  -1.919
  149    HA   TYR  19           HA       TYR  19  -4.653   0.362  -0.514
  150    HB2  TYR  19           2HB      TYR  19  -3.550   0.863  -2.698
  151    HB3  TYR  19           1HB      TYR  19  -4.815  -0.348  -2.842
  152    HD1  TYR  19           2HD      TYR  19  -7.002   0.292  -3.910
  153    HD2  TYR  19           1HD      TYR  19  -3.688   2.935  -3.874
  154    HE1  TYR  19           2HE      TYR  19  -8.049   1.614  -5.684
  155    HE2  TYR  19           1HE      TYR  19  -4.719   4.266  -5.646
  156    HH   TYR  19           HH       TYR  19  -7.918   4.040  -6.517
  157    H    CYS  20           H        CYS  20  -2.814   2.000  -0.586
  158    HA   CYS  20           HA       CYS  20  -3.707   4.459   0.504
  159    HB2  CYS  20           2HB      CYS  20  -1.335   5.143   0.506
  160    HB3  CYS  20           1HB      CYS  20  -1.490   3.501   1.114
  161    H    CYS  21           H        CYS  21  -3.749   6.453  -0.405
  162    HA   CYS  21           HA       CYS  21  -4.911   6.794  -2.809
  163    HB2  CYS  21           2HB      CYS  21  -3.169   8.767  -1.364
  164    HB3  CYS  21           1HB      CYS  21  -4.317   9.174  -2.667
  165    HA   PRO  22           HA       PRO  22  -2.138   6.229  -6.103
  166    HB2  PRO  22           2HB      PRO  22  -3.175   8.014  -7.914
  167    HB3  PRO  22           1HB      PRO  22  -3.879   6.434  -7.564
  168    HG2  PRO  22           2HG      PRO  22  -4.682   9.117  -6.553
  169    HG3  PRO  22           1HG      PRO  22  -5.697   7.744  -7.028
  170    HD2  PRO  22           2HD      PRO  22  -5.123   8.375  -4.428
  171    HD3  PRO  22           1HD      PRO  22  -5.450   6.715  -4.958
  172    H    GLY  23           H        GLY  23  -0.245   6.988  -6.776
  173    HA2  GLY  23           2HA      GLY  23   1.195   8.847  -7.443
  174    HA3  GLY  23           1HA      GLY  23   0.408   9.797  -6.177
  175    H    LEU  24           H        LEU  24   0.387   7.371  -4.486
  176    HA   LEU  24           HA       LEU  24   2.978   7.882  -3.272
  177    HB2  LEU  24           2HB      LEU  24   0.821   6.116  -2.133
  178    HB3  LEU  24           1HB      LEU  24   2.114   6.933  -1.349
  179    HG   LEU  24           HG       LEU  24  -0.073   8.497  -2.668
  180   HD11  LEU  24          1HD1      LEU  24  -0.919   8.835  -0.359
  181   HD12  LEU  24          2HD1      LEU  24   0.134   7.472   0.120
  182   HD13  LEU  24          3HD1      LEU  24  -1.154   7.240  -1.063
  183   HD21  LEU  24          3HD2      LEU  24   0.772  10.279  -1.170
  184   HD22  LEU  24          1HD2      LEU  24   1.954   9.724  -2.357
  185   HD23  LEU  24          2HD2      LEU  24   2.077   9.196  -0.676
  186    H    ILE  25           H        ILE  25   4.221   6.159  -2.548
  187    HA   ILE  25           HA       ILE  25   3.819   3.671  -4.035
  188    HB   ILE  25           HB       ILE  25   6.299   3.432  -4.236
  189   HG12  ILE  25          2HG1      ILE  25   6.355   6.366  -3.457
  190   HG13  ILE  25          1HG1      ILE  25   6.942   5.039  -2.461
  191   HG21  ILE  25          1HG2      ILE  25   6.548   4.961  -6.154
  192   HG22  ILE  25          2HG2      ILE  25   5.083   5.802  -5.647
  193   HG23  ILE  25          3HG2      ILE  25   5.000   4.115  -6.154
  194   HD11  ILE  25          3HD1      ILE  25   8.640   4.539  -4.133
  195   HD12  ILE  25          1HD1      ILE  25   8.766   6.205  -3.569
  196   HD13  ILE  25          2HD1      ILE  25   8.043   5.858  -5.139
  197    H    CYS  26           H        CYS  26   4.118   1.848  -2.924
  198    HA   CYS  26           HA       CYS  26   4.487   2.130  -0.064
  199    HB2  CYS  26           2HB      CYS  26   2.680   0.802  -1.257
  200    HB3  CYS  26           1HB      CYS  26   3.928  -0.399  -1.611
  201    H    GLY  27           H        GLY  27   6.518   2.346   0.439
  202    HA2  GLY  27           2HA      GLY  27   8.577   1.072  -1.144
  203    HA3  GLY  27           1HA      GLY  27   8.849   2.213   0.158
  204    HA   PRO  28           HA       PRO  28   9.953  -1.219   2.641
  205    HB2  PRO  28           2HB      PRO  28   8.995  -0.100   5.120
  206    HB3  PRO  28           1HB      PRO  28  10.646  -0.130   4.513
  207    HG2  PRO  28           2HG      PRO  28   9.135   2.174   4.779
  208    HG3  PRO  28           1HG      PRO  28  10.523   1.999   3.695
  209    HD2  PRO  28           2HD      PRO  28   7.600   1.897   3.068
  210    HD3  PRO  28           1HD      PRO  28   8.930   2.553   2.110
  211    H    PHE  29           H        PHE  29   7.088  -0.044   4.328
  212    HA   PHE  29           HA       PHE  29   5.626  -2.439   3.533
  213    HB2  PHE  29           2HB      PHE  29   6.567  -2.914   5.780
  214    HB3  PHE  29           1HB      PHE  29   5.847  -1.422   6.372
  215    HD1  PHE  29           1HD      PHE  29   5.025  -4.754   4.985
  216    HD2  PHE  29           2HD      PHE  29   3.661  -1.372   7.172
  217    HE1  PHE  29           1HE      PHE  29   2.972  -5.970   5.580
  218    HE2  PHE  29           2HE      PHE  29   1.603  -2.580   7.771
  219    HZ   PHE  29           HZ       PHE  29   1.257  -4.877   6.974
  220    H    VAL  30           H        VAL  30   5.785   0.871   4.521
  221    HA   VAL  30           HA       VAL  30   2.923   1.196   4.129
  222    HB   VAL  30           HB       VAL  30   3.172   3.331   5.298
  223   HG11  VAL  30          1HG1      VAL  30   4.443   1.054   6.808
  224   HG12  VAL  30          2HG1      VAL  30   2.716   1.388   6.654
  225   HG13  VAL  30          3HG1      VAL  30   3.757   2.510   7.533
  226   HG21  VAL  30          3HG2      VAL  30   5.382   4.015   4.658
  227   HG22  VAL  30          1HG2      VAL  30   6.095   2.607   5.451
  228   HG23  VAL  30          2HG2      VAL  30   5.348   3.863   6.421
  229    H    CYS  31           H        CYS  31   2.491   3.478   3.188
  230    HA   CYS  31           HA       CYS  31   4.033   3.742   0.725
  231    HB2  CYS  31           2HB      CYS  31   1.362   4.776   1.609
  232    HB3  CYS  31           1HB      CYS  31   2.081   5.163   0.033
  233    H    VAL  32           H        VAL  32   4.118   6.011  -0.003
  234    HA   VAL  32           HA       VAL  32   4.627   8.124   1.752
  235    HB   VAL  32           HB       VAL  32   6.551   6.812   2.516
  236   HG11  VAL  32          1HG1      VAL  32   6.818   5.305   0.626
  237   HG12  VAL  32          2HG1      VAL  32   8.347   6.115   0.969
  238   HG13  VAL  32          3HG1      VAL  32   7.354   6.639  -0.391
  239   HG21  VAL  32          3HG2      VAL  32   8.390   8.338   1.943
  240   HG22  VAL  32          1HG2      VAL  32   6.898   9.198   2.324
  241   HG23  VAL  32          2HG2      VAL  32   7.406   9.017   0.643
  Start of MODEL   12
    1    H1   ARG   1           H        ARG   1 -11.207  11.062  -1.751
    2    HA   ARG   1           HA       ARG   1 -11.883   9.392  -3.960
    3    HB2  ARG   1           2HB      ARG   1  -9.693  10.544  -4.669
    4    HB3  ARG   1           1HB      ARG   1  -9.005   9.791  -3.229
    5    HG2  ARG   1           2HG      ARG   1  -8.440   8.543  -5.258
    6    HG3  ARG   1           1HG      ARG   1  -9.415   7.586  -4.143
    7    HD2  ARG   1           2HD      ARG   1 -10.139   7.317  -6.484
    8    HD3  ARG   1           1HD      ARG   1 -11.395   8.005  -5.462
    9    HE   ARG   1           HE       ARG   1  -9.705   9.762  -7.070
   10   HH11  ARG   1          1HH1      ARG   1 -12.960   8.473  -6.332
   11   HH12  ARG   1          2HH1      ARG   1 -13.752   9.564  -7.385
   12   HH21  ARG   1          1HH2      ARG   1 -10.874  11.251  -8.520
   13   HH22  ARG   1          2HH2      ARG   1 -12.563  11.140  -8.638
   14    H    ASP   2           H        ASP   2 -11.984   7.400  -3.310
   15    HA   ASP   2           HA       ASP   2 -11.780   7.010  -0.492
   16    HB2  ASP   2           2HB      ASP   2 -12.687   5.140  -2.685
   17    HB3  ASP   2           1HB      ASP   2 -12.627   4.717  -0.982
   18    H    CYS   3           H        CYS   3  -9.587   7.285  -0.321
   19    HA   CYS   3           HA       CYS   3  -8.132   4.846  -0.762
   20    HB2  CYS   3           2HB      CYS   3  -6.167   6.113  -1.582
   21    HB3  CYS   3           1HB      CYS   3  -7.520   6.148  -2.704
   22    H    GLN   4           H        GLN   4  -5.943   5.118   0.407
   23    HA   GLN   4           HA       GLN   4  -6.507   6.544   2.908
   24    HB2  GLN   4           2HB      GLN   4  -5.540   4.755   4.116
   25    HB3  GLN   4           1HB      GLN   4  -6.615   4.061   2.909
   26    HG2  GLN   4           2HG      GLN   4  -4.828   3.447   1.521
   27    HG3  GLN   4           1HG      GLN   4  -3.644   4.199   2.608
   28   HE21  GLN   4          1HE2      GLN   4  -3.838   1.516   1.730
   29   HE22  GLN   4          2HE2      GLN   4  -4.034   0.517   3.137
   30    H    GLU   5           H        GLU   5  -4.684   7.138   4.086
   31    HA   GLU   5           HA       GLU   5  -3.000   8.670   2.421
   32    HB2  GLU   5           2HB      GLU   5  -3.084   8.251   5.361
   33    HB3  GLU   5           1HB      GLU   5  -2.020   9.448   4.585
   34    HG2  GLU   5           2HG      GLU   5  -4.090  10.482   3.643
   35    HG3  GLU   5           1HG      GLU   5  -5.024   9.349   4.617
   36    H    LYS   6           H        LYS   6  -0.613   8.824   3.209
   37    HA   LYS   6           HA       LYS   6   0.525   6.502   2.034
   38    HB2  LYS   6           2HB      LYS   6   2.691   7.750   2.208
   39    HB3  LYS   6           1HB      LYS   6   1.424   8.594   1.331
   40    HG2  LYS   6           2HG      LYS   6   0.879   9.698   3.428
   41    HG3  LYS   6           1HG      LYS   6   2.392   9.129   4.123
   42    HD2  LYS   6           2HD      LYS   6   2.108  10.867   1.655
   43    HD3  LYS   6           1HD      LYS   6   2.479  11.487   3.259
   44    HE2  LYS   6           2HE      LYS   6   4.551  10.030   3.200
   45    HE3  LYS   6           1HE      LYS   6   4.136   9.709   1.510
   46    HZ1  LYS   6           3HZ      LYS   6   5.740  11.518   1.719
   47    HZ2  LYS   6           1HZ      LYS   6   4.630  12.407   2.614
   48    HZ3  LYS   6           2HZ      LYS   6   4.324  12.017   1.002
   49    H    TRP   7           H        TRP   7   0.880   7.917   5.248
   50    HA   TRP   7           HA       TRP   7   2.737   5.825   5.959
   51    HB2  TRP   7           2HB      TRP   7   1.619   8.090   7.611
   52    HB3  TRP   7           1HB      TRP   7   2.838   6.955   8.182
   53    HD1  TRP   7           HD       TRP   7   2.526  10.220   6.488
   54    HE1  TRP   7           1HE      TRP   7   4.780  10.974   5.514
   55    HE3  TRP   7           3HE      TRP   7   5.098   5.827   6.871
   56    HZ2  TRP   7           2HZ      TRP   7   7.307   9.871   4.980
   57    HZ3  TRP   7           3HZ      TRP   7   7.437   5.771   6.086
   58    HH2  TRP   7           HH       TRP   7   8.504   7.752   5.169
   59    H    GLU   8           H        GLU   8   0.021   5.071   5.331
   60    HA   GLU   8           HA       GLU   8  -1.106   4.108   7.824
   61    HB2  GLU   8           2HB      GLU   8  -1.949   3.733   4.948
   62    HB3  GLU   8           1HB      GLU   8  -2.799   3.041   6.318
   63    HG2  GLU   8           2HG      GLU   8  -2.448   5.975   5.721
   64    HG3  GLU   8           1HG      GLU   8  -3.905   4.988   5.544
   65    H    TYR   9           H        TYR   9  -1.839   1.656   7.519
   66    HA   TYR   9           HA       TYR   9   0.537   0.142   7.732
   67    HB2  TYR   9           2HB      TYR   9  -1.580  -0.387   8.923
   68    HB3  TYR   9           1HB      TYR   9  -2.308  -0.855   7.398
   69    HD1  TYR   9           1HD      TYR   9   0.150  -1.756   9.949
   70    HD2  TYR   9           2HD      TYR   9  -1.792  -2.964   6.384
   71    HE1  TYR   9           1HE      TYR   9   0.978  -4.030  10.289
   72    HE2  TYR   9           2HE      TYR   9  -0.983  -5.249   6.695
   73    HH   TYR   9           HH       TYR   9   0.359  -6.325   9.607
   74    H    CYS  10           H        CYS  10  -1.692   0.662   5.131
   75    HA   CYS  10           HA       CYS  10  -1.488   0.523   2.904
   76    HB2  CYS  10           2HB      CYS  10   0.873   1.023   2.975
   77    HB3  CYS  10           1HB      CYS  10   1.280  -0.629   3.421
   78    H    ILE  11           H        ILE  11  -2.117  -0.873   1.283
   79    HA   ILE  11           HA       ILE  11  -2.403  -3.685   2.084
   80    HB   ILE  11           HB       ILE  11  -4.443  -2.006   0.587
   81   HG12  ILE  11          2HG1      ILE  11  -4.638  -3.227   3.353
   82   HG13  ILE  11          1HG1      ILE  11  -4.427  -1.514   3.007
   83   HG21  ILE  11          1HG2      ILE  11  -5.893  -3.996   0.680
   84   HG22  ILE  11          2HG2      ILE  11  -4.574  -4.906   1.415
   85   HG23  ILE  11          3HG2      ILE  11  -4.411  -4.297  -0.230
   86   HD11  ILE  11          3HD1      ILE  11  -6.808  -3.188   2.237
   87   HD12  ILE  11          1HD1      ILE  11  -6.613  -1.466   1.925
   88   HD13  ILE  11          2HD1      ILE  11  -6.741  -2.057   3.584
   89    H    VAL  12           H        VAL  12  -1.721  -5.083   0.539
   90    HA   VAL  12           HA       VAL  12  -1.289  -4.042  -2.161
   91    HB   VAL  12           HB       VAL  12   0.501  -6.054  -0.762
   92   HG11  VAL  12          1HG1      VAL  12   1.999  -5.737  -2.676
   93   HG12  VAL  12          2HG1      VAL  12   0.820  -4.651  -3.410
   94   HG13  VAL  12          3HG1      VAL  12   0.419  -6.351  -3.166
   95   HG21  VAL  12          3HG2      VAL  12   0.837  -3.881   0.276
   96   HG22  VAL  12          1HG2      VAL  12   1.035  -3.127  -1.305
   97   HG23  VAL  12          2HG2      VAL  12   2.231  -4.283  -0.725
   98    HA   PRO  13           HA       PRO  13  -4.089  -7.641  -2.527
   99    HB2  PRO  13           2HB      PRO  13  -4.895  -7.018  -5.072
  100    HB3  PRO  13           1HB      PRO  13  -5.636  -6.331  -3.623
  101    HG2  PRO  13           2HG      PRO  13  -3.579  -5.151  -5.444
  102    HG3  PRO  13           1HG      PRO  13  -4.980  -4.374  -4.688
  103    HD2  PRO  13           2HD      PRO  13  -2.483  -4.080  -3.755
  104    HD3  PRO  13           1HD      PRO  13  -3.891  -4.095  -2.674
  105    H    ILE  14           H        ILE  14  -2.153  -6.481  -5.267
  106    HA   ILE  14           HA       ILE  14  -0.929  -9.093  -5.624
  107    HB   ILE  14           HB       ILE  14  -2.273  -7.472  -7.840
  108   HG12  ILE  14          2HG1      ILE  14  -2.873 -10.279  -6.863
  109   HG13  ILE  14          1HG1      ILE  14  -3.857  -8.857  -6.548
  110   HG21  ILE  14          1HG2      ILE  14  -0.623  -9.986  -8.080
  111   HG22  ILE  14          2HG2      ILE  14  -0.169  -8.375  -8.635
  112   HG23  ILE  14          3HG2      ILE  14  -1.523  -9.220  -9.389
  113   HD11  ILE  14          3HD1      ILE  14  -4.343  -8.664  -8.926
  114   HD12  ILE  14          1HD1      ILE  14  -4.804 -10.249  -8.313
  115   HD13  ILE  14          2HD1      ILE  14  -3.326 -10.064  -9.258
  116    H    LEU  15           H        LEU  15   1.199  -8.831  -6.304
  117    HA   LEU  15           HA       LEU  15   2.486  -6.472  -5.700
  118    HB2  LEU  15           2HB      LEU  15   4.518  -7.370  -6.645
  119    HB3  LEU  15           1HB      LEU  15   3.672  -8.626  -5.781
  120    HG   LEU  15           HG       LEU  15   3.734  -8.353  -8.800
  121   HD11  LEU  15          1HD1      LEU  15   5.272 -10.199  -6.988
  122   HD12  LEU  15          2HD1      LEU  15   5.936  -8.850  -7.910
  123   HD13  LEU  15          3HD1      LEU  15   5.266 -10.248  -8.750
  124   HD21  LEU  15          3HD2      LEU  15   2.769 -10.599  -7.028
  125   HD22  LEU  15          1HD2      LEU  15   2.873 -10.659  -8.789
  126   HD23  LEU  15          2HD2      LEU  15   1.755  -9.544  -8.011
  127    H    GLY  16           H        GLY  16   2.637  -4.637  -6.583
  128    HA2  GLY  16           2HA      GLY  16   3.268  -3.225  -8.412
  129    HA3  GLY  16           1HA      GLY  16   2.440  -4.338  -9.497
  130    H    PHE  17           H        PHE  17   0.442  -4.311  -7.008
  131    HA   PHE  17           HA       PHE  17  -0.945  -1.850  -7.765
  132    HB2  PHE  17           2HB      PHE  17  -2.155  -4.579  -7.222
  133    HB3  PHE  17           1HB      PHE  17  -3.078  -3.097  -7.426
  134    HD1  PHE  17           2HD      PHE  17  -3.281  -2.059  -9.616
  135    HD2  PHE  17           1HD      PHE  17  -1.173  -5.712  -9.090
  136    HE1  PHE  17           2HE      PHE  17  -3.353  -2.444 -12.039
  137    HE2  PHE  17           1HE      PHE  17  -1.244  -6.105 -11.514
  138    HZ   PHE  17           HZ       PHE  17  -2.335  -4.462 -12.994
  139    H    VAL  18           H        VAL  18  -1.391  -0.629  -6.035
  140    HA   VAL  18           HA       VAL  18  -1.386  -1.928  -3.421
  141    HB   VAL  18           HB       VAL  18  -0.107  -0.060  -2.430
  142   HG11  VAL  18          1HG1      VAL  18   1.110  -2.058  -3.058
  143   HG12  VAL  18          2HG1      VAL  18   2.112  -0.625  -3.310
  144   HG13  VAL  18          3HG1      VAL  18   1.348  -1.421  -4.683
  145   HG21  VAL  18          3HG2      VAL  18   0.324   0.863  -5.278
  146   HG22  VAL  18          1HG2      VAL  18   1.123   1.530  -3.854
  147   HG23  VAL  18          2HG2      VAL  18  -0.621   1.703  -4.050
  148    H    TYR  19           H        TYR  19  -2.715  -0.983  -1.892
  149    HA   TYR  19           HA       TYR  19  -4.419   1.075  -3.035
  150    HB2  TYR  19           2HB      TYR  19  -5.094  -0.930  -0.880
  151    HB3  TYR  19           1HB      TYR  19  -6.117   0.436  -1.300
  152    HD1  TYR  19           2HD      TYR  19  -6.226   0.554  -4.106
  153    HD2  TYR  19           1HD      TYR  19  -5.991  -2.915  -1.663
  154    HE1  TYR  19           2HE      TYR  19  -7.259  -0.765  -5.890
  155    HE2  TYR  19           1HE      TYR  19  -7.021  -4.240  -3.449
  156    HH   TYR  19           HH       TYR  19  -8.454  -3.867  -5.437
  157    H    CYS  20           H        CYS  20  -3.734   2.847  -2.576
  158    HA   CYS  20           HA       CYS  20  -3.898   4.004  -0.031
  159    HB2  CYS  20           2HB      CYS  20  -1.212   3.913  -1.511
  160    HB3  CYS  20           1HB      CYS  20  -1.606   5.116  -0.300
  161    H    CYS  21           H        CYS  21  -3.530   6.398  -0.574
  162    HA   CYS  21           HA       CYS  21  -4.919   7.053  -2.900
  163    HB2  CYS  21           2HB      CYS  21  -3.124   8.736  -1.168
  164    HB3  CYS  21           1HB      CYS  21  -4.075   9.398  -2.510
  165    HA   PRO  22           HA       PRO  22  -2.229   6.576  -6.231
  166    HB2  PRO  22           2HB      PRO  22  -3.005   8.641  -7.863
  167    HB3  PRO  22           1HB      PRO  22  -3.918   7.143  -7.666
  168    HG2  PRO  22           2HG      PRO  22  -4.370   9.810  -6.411
  169    HG3  PRO  22           1HG      PRO  22  -5.550   8.627  -7.001
  170    HD2  PRO  22           2HD      PRO  22  -4.938   8.947  -4.364
  171    HD3  PRO  22           1HD      PRO  22  -5.467   7.401  -5.051
  172    H    GLY  23           H        GLY  23  -0.231   7.116  -6.771
  173    HA2  GLY  23           2HA      GLY  23   1.451   8.758  -7.325
  174    HA3  GLY  23           1HA      GLY  23   0.658   9.852  -6.188
  175    H    LEU  24           H        LEU  24   0.386   7.312  -4.466
  176    HA   LEU  24           HA       LEU  24   2.894   7.797  -3.067
  177    HB2  LEU  24           2HB      LEU  24   0.631   6.063  -2.082
  178    HB3  LEU  24           1HB      LEU  24   1.919   6.807  -1.209
  179    HG   LEU  24           HG       LEU  24  -0.224   8.431  -2.531
  180   HD11  LEU  24          1HD1      LEU  24   0.058   7.482   0.284
  181   HD12  LEU  24          2HD1      LEU  24  -1.261   7.150  -0.860
  182   HD13  LEU  24          3HD1      LEU  24  -1.032   8.778  -0.224
  183   HD21  LEU  24          3HD2      LEU  24   1.971   9.114  -0.580
  184   HD22  LEU  24          1HD2      LEU  24   0.648  10.189  -1.052
  185   HD23  LEU  24          2HD2      LEU  24   1.806   9.649  -2.262
  186    H    ILE  25           H        ILE  25   4.111   6.064  -2.342
  187    HA   ILE  25           HA       ILE  25   3.784   3.632  -3.940
  188    HB   ILE  25           HB       ILE  25   6.257   3.354  -3.854
  189   HG12  ILE  25          2HG1      ILE  25   6.288   6.250  -2.949
  190   HG13  ILE  25          1HG1      ILE  25   6.659   4.874  -1.922
  191   HG21  ILE  25          1HG2      ILE  25   5.247   5.822  -5.265
  192   HG22  ILE  25          2HG2      ILE  25   5.210   4.169  -5.878
  193   HG23  ILE  25          3HG2      ILE  25   6.755   4.989  -5.644
  194   HD11  ILE  25          3HD1      ILE  25   8.672   5.999  -2.694
  195   HD12  ILE  25          1HD1      ILE  25   8.192   5.709  -4.366
  196   HD13  ILE  25          2HD1      ILE  25   8.583   4.349  -3.315
  197    H    CYS  26           H        CYS  26   3.840   1.775  -2.855
  198    HA   CYS  26           HA       CYS  26   4.197   1.940   0.037
  199    HB2  CYS  26           2HB      CYS  26   2.199   0.820  -1.053
  200    HB3  CYS  26           1HB      CYS  26   3.297  -0.458  -1.589
  201    H    GLY  27           H        GLY  27   6.259   2.132   0.309
  202    HA2  GLY  27           2HA      GLY  27   8.128   0.534  -1.273
  203    HA3  GLY  27           1HA      GLY  27   8.520   1.933  -0.285
  204    HA   PRO  28           HA       PRO  28  10.328  -0.577   2.794
  205    HB2  PRO  28           2HB      PRO  28   9.260   0.604   5.086
  206    HB3  PRO  28           1HB      PRO  28  10.694   1.167   4.224
  207    HG2  PRO  28           2HG      PRO  28   7.874   2.144   4.063
  208    HG3  PRO  28           1HG      PRO  28   9.384   3.072   4.034
  209    HD2  PRO  28           2HD      PRO  28   8.010   2.620   1.799
  210    HD3  PRO  28           1HD      PRO  28   9.786   2.572   1.798
  211    H    PHE  29           H        PHE  29   6.923   0.103   3.305
  212    HA   PHE  29           HA       PHE  29   6.038  -2.513   3.468
  213    HB2  PHE  29           2HB      PHE  29   7.275  -2.503   5.648
  214    HB3  PHE  29           1HB      PHE  29   6.336  -1.103   6.143
  215    HD1  PHE  29           2HD      PHE  29   4.043  -1.326   6.749
  216    HD2  PHE  29           1HD      PHE  29   6.327  -4.689   5.604
  217    HE1  PHE  29           2HE      PHE  29   2.311  -2.812   7.725
  218    HE2  PHE  29           1HE      PHE  29   4.626  -6.199   6.564
  219    HZ   PHE  29           HZ       PHE  29   2.612  -5.252   7.629
  220    H    VAL  30           H        VAL  30   5.876   0.821   4.444
  221    HA   VAL  30           HA       VAL  30   2.981   0.872   4.142
  222    HB   VAL  30           HB       VAL  30   3.118   3.020   5.355
  223   HG11  VAL  30          1HG1      VAL  30   2.810   0.989   6.641
  224   HG12  VAL  30          2HG1      VAL  30   3.776   2.160   7.537
  225   HG13  VAL  30          3HG1      VAL  30   4.562   0.778   6.764
  226   HG21  VAL  30          3HG2      VAL  30   5.234   3.730   6.398
  227   HG22  VAL  30          1HG2      VAL  30   5.339   3.747   4.636
  228   HG23  VAL  30          2HG2      VAL  30   6.077   2.435   5.554
  229    H    CYS  31           H        CYS  31   2.309   3.151   3.286
  230    HA   CYS  31           HA       CYS  31   3.704   3.568   0.794
  231    HB2  CYS  31           2HB      CYS  31   1.075   4.589   1.882
  232    HB3  CYS  31           1HB      CYS  31   1.757   5.141   0.344
  233    H    VAL  32           H        VAL  32   3.739   6.009   0.164
  234    HA   VAL  32           HA       VAL  32   4.566   7.921   1.898
  235    HB   VAL  32           HB       VAL  32   6.320   6.435   2.702
  236   HG11  VAL  32          1HG1      VAL  32   6.593   4.975   0.752
  237   HG12  VAL  32          2HG1      VAL  32   8.153   5.641   1.235
  238   HG13  VAL  32          3HG1      VAL  32   7.306   6.306  -0.161
  239   HG21  VAL  32          3HG2      VAL  32   8.299   7.832   2.296
  240   HG22  VAL  32          1HG2      VAL  32   6.852   8.783   2.626
  241   HG23  VAL  32          2HG2      VAL  32   7.446   8.630   0.971
  Start of MODEL   13
    1    H1   ARG   1           H        ARG   1 -14.592   1.665  -0.723
    2    HA   ARG   1           HA       ARG   1 -14.762   3.598   1.173
    3    HB2  ARG   1           2HB      ARG   1 -12.307   1.882   1.471
    4    HB3  ARG   1           1HB      ARG   1 -12.452   3.507   2.092
    5    HG2  ARG   1           2HG      ARG   1 -14.281   2.810   3.559
    6    HG3  ARG   1           1HG      ARG   1 -14.217   1.183   2.884
    7    HD2  ARG   1           2HD      ARG   1 -13.080   1.314   5.056
    8    HD3  ARG   1           1HD      ARG   1 -11.972   0.881   3.760
    9    HE   ARG   1           HE       ARG   1 -11.917   3.649   4.078
   10   HH11  ARG   1          1HH1      ARG   1 -10.961   0.773   5.962
   11   HH12  ARG   1          2HH1      ARG   1  -9.670   1.579   6.732
   12   HH21  ARG   1          1HH2      ARG   1 -10.122   4.690   5.136
   13   HH22  ARG   1          2HH2      ARG   1  -9.194   3.819   6.268
   14    H    ASP   2           H        ASP   2 -12.797   5.065   0.929
   15    HA   ASP   2           HA       ASP   2 -12.096   5.307  -1.893
   16    HB2  ASP   2           2HB      ASP   2 -13.007   7.237  -0.518
   17    HB3  ASP   2           1HB      ASP   2 -11.558   7.142   0.472
   18    H    CYS   3           H        CYS   3  -9.727   6.719  -0.597
   19    HA   CYS   3           HA       CYS   3  -8.058   4.306  -0.460
   20    HB2  CYS   3           2HB      CYS   3  -6.202   5.669  -1.390
   21    HB3  CYS   3           1HB      CYS   3  -7.548   5.508  -2.505
   22    H    GLN   4           H        GLN   4  -5.880   4.917   0.587
   23    HA   GLN   4           HA       GLN   4  -6.470   6.363   3.100
   24    HB2  GLN   4           2HB      GLN   4  -5.280   4.676   4.314
   25    HB3  GLN   4           1HB      GLN   4  -6.435   3.878   3.253
   26    HG2  GLN   4           2HG      GLN   4  -4.743   3.318   1.688
   27    HG3  GLN   4           1HG      GLN   4  -3.523   4.171   2.637
   28   HE21  GLN   4          1HE2      GLN   4  -3.631   1.465   1.782
   29   HE22  GLN   4          2HE2      GLN   4  -3.607   0.476   3.194
   30    H    GLU   5           H        GLU   5  -4.561   7.045   4.182
   31    HA   GLU   5           HA       GLU   5  -3.050   8.614   2.378
   32    HB2  GLU   5           2HB      GLU   5  -2.945   8.225   5.315
   33    HB3  GLU   5           1HB      GLU   5  -1.955   9.442   4.470
   34    HG2  GLU   5           2HG      GLU   5  -4.144  10.365   3.634
   35    HG3  GLU   5           1HG      GLU   5  -4.930   9.251   4.748
   36    H    LYS   6           H        LYS   6  -0.600   8.858   3.063
   37    HA   LYS   6           HA       LYS   6   0.530   6.532   1.876
   38    HB2  LYS   6           2HB      LYS   6   2.713   7.786   1.925
   39    HB3  LYS   6           1HB      LYS   6   1.391   8.618   1.118
   40    HG2  LYS   6           2HG      LYS   6   0.960   9.746   3.191
   41    HG3  LYS   6           1HG      LYS   6   2.502   9.192   3.847
   42    HD2  LYS   6           2HD      LYS   6   2.102  10.893   1.361
   43    HD3  LYS   6           1HD      LYS   6   2.584  11.530   2.929
   44    HE2  LYS   6           2HE      LYS   6   4.653  10.117   2.774
   45    HE3  LYS   6           1HE      LYS   6   4.113   9.650   1.157
   46    HZ1  LYS   6           3HZ      LYS   6   4.232  11.928   0.457
   47    HZ2  LYS   6           1HZ      LYS   6   5.716  11.439   1.060
   48    HZ3  LYS   6           2HZ      LYS   6   4.726  12.429   1.988
   49    H    TRP   7           H        TRP   7   1.000   7.986   5.067
   50    HA   TRP   7           HA       TRP   7   2.820   5.865   5.761
   51    HB2  TRP   7           2HB      TRP   7   1.741   8.151   7.410
   52    HB3  TRP   7           1HB      TRP   7   2.978   7.018   7.955
   53    HD1  TRP   7           HD       TRP   7   2.592  10.260   6.236
   54    HE1  TRP   7           1HE      TRP   7   4.840  11.011   5.188
   55    HE3  TRP   7           3HE      TRP   7   5.215   5.905   6.643
   56    HZ2  TRP   7           2HZ      TRP   7   7.343   9.931   4.629
   57    HZ3  TRP   7           3HZ      TRP   7   7.537   5.846   5.822
   58    HH2  TRP   7           HH       TRP   7   8.571   7.830   4.833
   59    H    GLU   8           H        GLU   8   0.003   5.255   5.186
   60    HA   GLU   8           HA       GLU   8  -0.982   4.283   7.727
   61    HB2  GLU   8           2HB      GLU   8  -2.085   4.112   4.935
   62    HB3  GLU   8           1HB      GLU   8  -2.827   3.333   6.323
   63    HG2  GLU   8           2HG      GLU   8  -2.438   6.275   5.884
   64    HG3  GLU   8           1HG      GLU   8  -3.947   5.343   5.857
   65    H    TYR   9           H        TYR   9  -1.849   1.918   7.478
   66    HA   TYR   9           HA       TYR   9   0.271   0.183   7.645
   67    HB2  TYR   9           2HB      TYR   9  -2.569  -0.507   6.895
   68    HB3  TYR   9           1HB      TYR   9  -1.370  -1.632   7.519
   69    HD1  TYR   9           1HD      TYR   9  -0.651  -1.496   9.859
   70    HD2  TYR   9           2HD      TYR   9  -3.711   1.033   8.339
   71    HE1  TYR   9           1HE      TYR   9  -1.325  -0.952  12.133
   72    HE2  TYR   9           2HE      TYR   9  -4.386   1.592  10.605
   73    HH   TYR   9           HH       TYR   9  -2.508   0.836  13.322
   74    H    CYS  10           H        CYS  10  -1.489   1.139   4.827
   75    HA   CYS  10           HA       CYS  10  -1.279   0.823   2.633
   76    HB2  CYS  10           2HB      CYS  10   1.082   1.251   2.816
   77    HB3  CYS  10           1HB      CYS  10   1.401  -0.401   3.356
   78    H    ILE  11           H        ILE  11   0.214  -2.163   3.815
   79    HA   ILE  11           HA       ILE  11  -1.773  -3.607   2.249
   80    HB   ILE  11           HB       ILE  11   0.736  -4.584   3.658
   81   HG12  ILE  11          2HG1      ILE  11   1.298  -3.203   1.722
   82   HG13  ILE  11          1HG1      ILE  11   1.686  -4.887   1.401
   83   HG21  ILE  11          1HG2      ILE  11  -1.124  -6.097   1.831
   84   HG22  ILE  11          2HG2      ILE  11  -0.929  -6.344   3.566
   85   HG23  ILE  11          3HG2      ILE  11   0.405  -6.701   2.469
   86   HD11  ILE  11          3HD1      ILE  11  -0.377  -5.079   0.070
   87   HD12  ILE  11          1HD1      ILE  11   0.715  -3.839  -0.550
   88   HD13  ILE  11          2HD1      ILE  11  -0.706  -3.372   0.375
   89    H    VAL  12           H        VAL  12  -3.366  -4.628   3.260
   90    HA   VAL  12           HA       VAL  12  -3.117  -5.143   6.080
   91    HB   VAL  12           HB       VAL  12  -4.335  -2.998   5.847
   92   HG11  VAL  12          1HG1      VAL  12  -5.369  -3.223   3.700
   93   HG12  VAL  12          2HG1      VAL  12  -6.598  -2.879   4.920
   94   HG13  VAL  12          3HG1      VAL  12  -6.407  -4.518   4.298
   95   HG21  VAL  12          3HG2      VAL  12  -5.921  -5.318   6.898
   96   HG22  VAL  12          1HG2      VAL  12  -6.376  -3.629   7.173
   97   HG23  VAL  12          2HG2      VAL  12  -4.840  -4.242   7.768
   98    HA   PRO  13           HA       PRO  13  -4.366  -8.991   4.292
   99    HB2  PRO  13           2HB      PRO  13  -4.051 -10.528   6.454
  100    HB3  PRO  13           1HB      PRO  13  -2.670  -9.811   5.612
  101    HG2  PRO  13           2HG      PRO  13  -4.042  -8.896   8.110
  102    HG3  PRO  13           1HG      PRO  13  -2.305  -9.010   7.769
  103    HD2  PRO  13           2HD      PRO  13  -3.730  -6.687   7.620
  104    HD3  PRO  13           1HD      PRO  13  -2.273  -7.014   6.658
  105    H    ILE  14           H        ILE  14  -6.457  -7.154   5.738
  106    HA   ILE  14           HA       ILE  14  -8.272  -9.290   6.581
  107    HB   ILE  14           HB       ILE  14  -9.723  -7.611   7.558
  108   HG12  ILE  14          2HG1      ILE  14  -7.795  -5.529   6.460
  109   HG13  ILE  14          1HG1      ILE  14  -9.416  -5.842   5.874
  110   HG21  ILE  14          1HG2      ILE  14  -8.244  -6.687   9.293
  111   HG22  ILE  14          2HG2      ILE  14  -6.846  -7.126   8.313
  112   HG23  ILE  14          3HG2      ILE  14  -7.905  -8.383   8.951
  113   HD11  ILE  14          3HD1      ILE  14  -9.334  -3.857   7.273
  114   HD12  ILE  14          1HD1      ILE  14  -8.723  -4.822   8.615
  115   HD13  ILE  14          2HD1      ILE  14 -10.348  -5.108   7.993
  116    H    LEU  15           H        LEU  15 -10.515  -9.142   5.829
  117    HA   LEU  15           HA       LEU  15 -10.637  -8.705   3.004
  118    HB2  LEU  15           2HB      LEU  15 -11.872 -10.537   4.144
  119    HB3  LEU  15           1HB      LEU  15 -12.826  -9.342   4.995
  120    HG   LEU  15           HG       LEU  15 -13.803  -8.602   2.853
  121   HD11  LEU  15          1HD1      LEU  15 -11.971  -9.167   1.357
  122   HD12  LEU  15          2HD1      LEU  15 -13.463  -9.947   0.834
  123   HD13  LEU  15          3HD1      LEU  15 -12.225 -10.884   1.671
  124   HD21  LEU  15          3HD2      LEU  15 -14.025 -11.567   3.358
  125   HD22  LEU  15          1HD2      LEU  15 -15.185 -10.580   2.471
  126   HD23  LEU  15          2HD2      LEU  15 -14.929 -10.308   4.195
  127    H    GLY  16           H        GLY  16 -11.178  -6.876   2.050
  128    HA2  GLY  16           2HA      GLY  16 -12.541  -4.864   1.963
  129    HA3  GLY  16           1HA      GLY  16 -12.360  -4.744   3.716
  130    H    PHE  17           H        PHE  17  -9.906  -5.616   1.436
  131    HA   PHE  17           HA       PHE  17  -7.836  -4.129   2.506
  132    HB2  PHE  17           2HB      PHE  17  -7.549  -6.051   0.992
  133    HB3  PHE  17           1HB      PHE  17  -8.195  -5.106  -0.337
  134    HD1  PHE  17           2HD      PHE  17  -6.843  -3.351  -1.383
  135    HD2  PHE  17           1HD      PHE  17  -5.302  -5.736   1.785
  136    HE1  PHE  17           2HE      PHE  17  -4.574  -2.606  -1.932
  137    HE2  PHE  17           1HE      PHE  17  -3.021  -4.998   1.225
  138    HZ   PHE  17           HZ       PHE  17  -2.661  -3.424  -0.634
  139    H    VAL  18           H        VAL  18  -7.159  -2.095   2.308
  140    HA   VAL  18           HA       VAL  18  -8.549  -0.364   0.433
  141    HB   VAL  18           HB       VAL  18  -7.921   1.538   1.983
  142   HG11  VAL  18          1HG1      VAL  18  -9.731  -0.616   3.055
  143   HG12  VAL  18          2HG1      VAL  18 -10.172   0.659   1.918
  144   HG13  VAL  18          3HG1      VAL  18  -9.732   1.067   3.577
  145   HG21  VAL  18          3HG2      VAL  18  -7.330  -0.726   3.902
  146   HG22  VAL  18          1HG2      VAL  18  -7.424   0.984   4.329
  147   HG23  VAL  18          2HG2      VAL  18  -6.149   0.412   3.252
  148    H    TYR  19           H        TYR  19  -7.429   1.051  -0.731
  149    HA   TYR  19           HA       TYR  19  -4.644   0.309  -1.221
  150    HB2  TYR  19           2HB      TYR  19  -6.460   2.014  -2.934
  151    HB3  TYR  19           1HB      TYR  19  -5.036   1.115  -3.436
  152    HD1  TYR  19           2HD      TYR  19  -8.603   0.882  -2.565
  153    HD2  TYR  19           1HD      TYR  19  -5.207  -1.276  -3.955
  154    HE1  TYR  19           2HE      TYR  19 -10.056  -0.958  -3.201
  155    HE2  TYR  19           1HE      TYR  19  -6.680  -3.145  -4.608
  156    HH   TYR  19           HH       TYR  19 -10.078  -2.820  -4.722
  157    H    CYS  20           H        CYS  20  -3.049   1.994  -1.147
  158    HA   CYS  20           HA       CYS  20  -3.964   4.365   0.170
  159    HB2  CYS  20           2HB      CYS  20  -1.630   5.086   0.347
  160    HB3  CYS  20           1HB      CYS  20  -1.771   3.417   0.864
  161    H    CYS  21           H        CYS  21  -3.856   6.355  -0.542
  162    HA   CYS  21           HA       CYS  21  -5.009   6.881  -2.961
  163    HB2  CYS  21           2HB      CYS  21  -3.426   8.702  -1.176
  164    HB3  CYS  21           1HB      CYS  21  -4.466   9.271  -2.491
  165    HA   PRO  22           HA       PRO  22  -2.220   6.861  -6.309
  166    HB2  PRO  22           2HB      PRO  22  -2.933   9.131  -7.688
  167    HB3  PRO  22           1HB      PRO  22  -3.848   7.618  -7.711
  168    HG2  PRO  22           2HG      PRO  22  -4.312  10.078  -6.074
  169    HG3  PRO  22           1HG      PRO  22  -5.489   9.073  -6.940
  170    HD2  PRO  22           2HD      PRO  22  -5.138   8.846  -4.291
  171    HD3  PRO  22           1HD      PRO  22  -5.461   7.417  -5.295
  172    H    GLY  23           H        GLY  23  -0.291   7.614  -7.048
  173    HA2  GLY  23           2HA      GLY  23   1.447   9.160  -7.339
  174    HA3  GLY  23           1HA      GLY  23   0.701  10.199  -6.132
  175    H    LEU  24           H        LEU  24   0.455   7.482  -4.598
  176    HA   LEU  24           HA       LEU  24   2.969   7.890  -3.184
  177    HB2  LEU  24           2HB      LEU  24   0.734   6.092  -2.248
  178    HB3  LEU  24           1HB      LEU  24   2.003   6.850  -1.368
  179    HG   LEU  24           HG       LEU  24  -0.167   8.476  -2.641
  180   HD11  LEU  24          1HD1      LEU  24  -1.208   7.098  -1.040
  181   HD12  LEU  24          2HD1      LEU  24  -1.045   8.710  -0.339
  182   HD13  LEU  24          3HD1      LEU  24   0.062   7.407   0.137
  183   HD21  LEU  24          3HD2      LEU  24   1.831   9.728  -2.290
  184   HD22  LEU  24          1HD2      LEU  24   2.005   9.118  -0.647
  185   HD23  LEU  24          2HD2      LEU  24   0.667  10.194  -1.049
  186    H    ILE  25           H        ILE  25   4.126   6.069  -2.465
  187    HA   ILE  25           HA       ILE  25   3.805   3.657  -4.085
  188    HB   ILE  25           HB       ILE  25   6.331   3.472  -4.104
  189   HG12  ILE  25          2HG1      ILE  25   6.176   6.401  -3.322
  190   HG13  ILE  25          1HG1      ILE  25   6.812   5.103  -2.324
  191   HG21  ILE  25          1HG2      ILE  25   5.116   4.068  -6.101
  192   HG22  ILE  25          2HG2      ILE  25   6.627   4.975  -6.026
  193   HG23  ILE  25          3HG2      ILE  25   5.102   5.765  -5.623
  194   HD11  ILE  25          3HD1      ILE  25   8.613   4.758  -3.929
  195   HD12  ILE  25          1HD1      ILE  25   8.593   6.414  -3.324
  196   HD13  ILE  25          2HD1      ILE  25   7.968   6.055  -4.935
  197    H    CYS  26           H        CYS  26   3.993   1.791  -2.967
  198    HA   CYS  26           HA       CYS  26   4.399   2.004  -0.083
  199    HB2  CYS  26           2HB      CYS  26   2.402   0.807  -1.183
  200    HB3  CYS  26           1HB      CYS  26   3.551  -0.457  -1.621
  201    H    GLY  27           H        GLY  27   6.433   2.089   0.310
  202    HA2  GLY  27           2HA      GLY  27   8.293   0.508  -1.279
  203    HA3  GLY  27           1HA      GLY  27   8.721   1.808  -0.179
  204    HA   PRO  28           HA       PRO  28   9.917  -1.160   2.750
  205    HB2  PRO  28           2HB      PRO  28   9.208   0.009   5.148
  206    HB3  PRO  28           1HB      PRO  28  10.638   0.447   4.214
  207    HG2  PRO  28           2HG      PRO  28   8.014   1.848   4.412
  208    HG3  PRO  28           1HG      PRO  28   9.636   2.523   4.203
  209    HD2  PRO  28           2HD      PRO  28   7.786   2.277   2.183
  210    HD3  PRO  28           1HD      PRO  28   9.535   2.338   1.927
  211    H    PHE  29           H        PHE  29   7.232  -0.075   4.760
  212    HA   PHE  29           HA       PHE  29   5.825  -2.555   4.072
  213    HB2  PHE  29           2HB      PHE  29   5.949  -1.224   6.802
  214    HB3  PHE  29           1HB      PHE  29   4.956  -2.609   6.397
  215    HD1  PHE  29           1HD      PHE  29   6.031  -4.791   5.889
  216    HD2  PHE  29           2HD      PHE  29   8.247  -1.458   7.337
  217    HE1  PHE  29           1HE      PHE  29   7.852  -6.296   6.553
  218    HE2  PHE  29           2HE      PHE  29  10.077  -2.962   8.007
  219    HZ   PHE  29           HZ       PHE  29   9.880  -5.386   7.614
  220    H    VAL  30           H        VAL  30   5.814   0.791   4.187
  221    HA   VAL  30           HA       VAL  30   2.904   0.916   4.013
  222    HB   VAL  30           HB       VAL  30   2.912   3.037   5.191
  223   HG11  VAL  30          1HG1      VAL  30   4.396   0.935   6.757
  224   HG12  VAL  30          2HG1      VAL  30   2.649   1.057   6.549
  225   HG13  VAL  30          3HG1      VAL  30   3.516   2.305   7.441
  226   HG21  VAL  30          3HG2      VAL  30   5.903   2.667   5.422
  227   HG22  VAL  30          1HG2      VAL  30   4.970   3.861   6.332
  228   HG23  VAL  30          2HG2      VAL  30   5.044   3.947   4.574
  229    H    CYS  31           H        CYS  31   2.368   3.240   3.137
  230    HA   CYS  31           HA       CYS  31   3.813   3.587   0.632
  231    HB2  CYS  31           2HB      CYS  31   1.202   4.697   1.665
  232    HB3  CYS  31           1HB      CYS  31   1.893   5.120   0.092
  233    H    VAL  32           H        VAL  32   3.863   5.999  -0.003
  234    HA   VAL  32           HA       VAL  32   4.682   7.920   1.713
  235    HB   VAL  32           HB       VAL  32   6.459   6.440   2.507
  236   HG11  VAL  32          1HG1      VAL  32   8.238   5.610   1.010
  237   HG12  VAL  32          2HG1      VAL  32   7.369   6.264  -0.377
  238   HG13  VAL  32          3HG1      VAL  32   6.663   4.949   0.564
  239   HG21  VAL  32          3HG2      VAL  32   8.428   7.820   2.003
  240   HG22  VAL  32          1HG2      VAL  32   6.994   8.785   2.360
  241   HG23  VAL  32          2HG2      VAL  32   7.527   8.584   0.690
  Start of MODEL   14
    1    H1   ARG   1           H        ARG   1 -14.962   8.348  -3.195
    2    HA   ARG   1           HA       ARG   1 -14.150   5.875  -3.237
    3    HB2  ARG   1           2HB      ARG   1 -12.964   6.239  -5.367
    4    HB3  ARG   1           1HB      ARG   1 -11.969   7.467  -4.597
    5    HG2  ARG   1           2HG      ARG   1 -10.961   5.785  -3.164
    6    HG3  ARG   1           1HG      ARG   1 -12.008   4.546  -3.856
    7    HD2  ARG   1           2HD      ARG   1  -9.791   4.445  -4.854
    8    HD3  ARG   1           1HD      ARG   1 -10.989   4.920  -6.052
    9    HE   ARG   1           HE       ARG   1  -9.748   7.189  -4.857
   10   HH11  ARG   1          1HH1      ARG   1  -9.274   4.696  -7.303
   11   HH12  ARG   1          2HH1      ARG   1  -8.145   5.576  -8.209
   12   HH21  ARG   1          1HH2      ARG   1  -8.228   8.434  -6.099
   13   HH22  ARG   1          2HH2      ARG   1  -7.555   7.781  -7.518
   14    H    ASP   2           H        ASP   2 -12.957   5.387  -1.444
   15    HA   ASP   2           HA       ASP   2 -11.785   7.639   0.027
   16    HB2  ASP   2           2HB      ASP   2 -13.705   6.842   1.277
   17    HB3  ASP   2           1HB      ASP   2 -13.176   5.175   1.126
   18    H    CYS   3           H        CYS   3  -9.686   7.458  -0.556
   19    HA   CYS   3           HA       CYS   3  -8.439   4.825  -0.298
   20    HB2  CYS   3           2HB      CYS   3  -6.485   5.885  -1.404
   21    HB3  CYS   3           1HB      CYS   3  -7.936   5.984  -2.394
   22    H    GLN   4           H        GLN   4  -6.079   5.058   0.670
   23    HA   GLN   4           HA       GLN   4  -6.494   6.554   3.172
   24    HB2  GLN   4           2HB      GLN   4  -5.550   4.762   4.418
   25    HB3  GLN   4           1HB      GLN   4  -6.617   4.023   3.238
   26    HG2  GLN   4           2HG      GLN   4  -4.815   3.411   1.843
   27    HG3  GLN   4           1HG      GLN   4  -3.652   4.206   2.911
   28   HE21  GLN   4          1HE2      GLN   4  -3.720   1.520   2.065
   29   HE22  GLN   4          2HE2      GLN   4  -3.919   0.501   3.431
   30    H    GLU   5           H        GLU   5  -4.602   7.242   4.197
   31    HA   GLU   5           HA       GLU   5  -2.999   8.647   2.365
   32    HB2  GLU   5           2HB      GLU   5  -2.932   8.363   5.312
   33    HB3  GLU   5           1HB      GLU   5  -1.764   9.381   4.453
   34    HG2  GLU   5           2HG      GLU   5  -3.797  10.563   3.488
   35    HG3  GLU   5           1HG      GLU   5  -4.747   9.679   4.682
   36    H    LYS   6           H        LYS   6  -0.535   8.827   2.959
   37    HA   LYS   6           HA       LYS   6   0.522   6.500   1.804
   38    HB2  LYS   6           2HB      LYS   6   2.718   7.714   1.887
   39    HB3  LYS   6           1HB      LYS   6   1.412   8.637   1.153
   40    HG2  LYS   6           2HG      LYS   6   1.041   9.533   3.431
   41    HG3  LYS   6           1HG      LYS   6   2.659   8.994   3.840
   42    HD2  LYS   6           2HD      LYS   6   1.956  10.913   1.597
   43    HD3  LYS   6           1HD      LYS   6   2.545  11.397   3.181
   44    HE2  LYS   6           2HE      LYS   6   4.628  10.103   2.715
   45    HE3  LYS   6           1HE      LYS   6   3.997   9.809   1.089
   46    HZ1  LYS   6           3HZ      LYS   6   4.542  12.465   2.260
   47    HZ2  LYS   6           1HZ      LYS   6   3.976  12.191   0.691
   48    HZ3  LYS   6           2HZ      LYS   6   5.514  11.676   1.138
   49    H    TRP   7           H        TRP   7   0.963   7.883   5.032
   50    HA   TRP   7           HA       TRP   7   2.778   5.776   5.781
   51    HB2  TRP   7           2HB      TRP   7   1.590   8.029   7.402
   52    HB3  TRP   7           1HB      TRP   7   2.852   6.943   7.976
   53    HD1  TRP   7           HD       TRP   7   2.374  10.176   6.251
   54    HE1  TRP   7           1HE      TRP   7   4.610  11.015   5.264
   55    HE3  TRP   7           3HE      TRP   7   5.141   5.928   6.736
   56    HZ2  TRP   7           2HZ      TRP   7   7.144  10.024   4.766
   57    HZ3  TRP   7           3HZ      TRP   7   7.493   5.963   5.958
   58    HH2  TRP   7           HH       TRP   7   8.456   7.972   4.999
   59    H    GLU   8           H        GLU   8  -0.053   5.115   5.153
   60    HA   GLU   8           HA       GLU   8  -1.167   4.216   7.682
   61    HB2  GLU   8           2HB      GLU   8  -2.149   3.911   4.849
   62    HB3  GLU   8           1HB      GLU   8  -3.033   3.409   6.280
   63    HG2  GLU   8           2HG      GLU   8  -2.206   6.220   5.652
   64    HG3  GLU   8           1HG      GLU   8  -3.803   5.541   5.368
   65    H    TYR   9           H        TYR   9  -2.341   1.833   6.768
   66    HA   TYR   9           HA       TYR   9  -0.363  -0.079   7.338
   67    HB2  TYR   9           2HB      TYR   9  -2.996  -0.595   5.960
   68    HB3  TYR   9           1HB      TYR   9  -2.066  -1.717   6.945
   69    HD1  TYR   9           1HD      TYR   9  -1.810  -1.188   9.415
   70    HD2  TYR   9           2HD      TYR   9  -4.614   0.784   6.905
   71    HE1  TYR   9           1HE      TYR   9  -3.046  -0.483  11.372
   72    HE2  TYR   9           2HE      TYR   9  -5.870   1.505   8.844
   73    HH   TYR   9           HH       TYR   9  -4.644   1.303  12.016
   74    H    CYS  10           H        CYS  10  -1.604   1.261   4.429
   75    HA   CYS  10           HA       CYS  10  -1.184   1.112   2.258
   76    HB2  CYS  10           2HB      CYS  10   1.157   1.247   2.611
   77    HB3  CYS  10           1HB      CYS  10   1.278  -0.451   3.091
   78    H    ILE  11           H        ILE  11  -0.118  -2.175   3.120
   79    HA   ILE  11           HA       ILE  11  -2.224  -3.172   1.345
   80    HB   ILE  11           HB       ILE  11   0.228  -4.576   2.458
   81   HG12  ILE  11          2HG1      ILE  11  -0.234  -3.530  -0.349
   82   HG13  ILE  11          1HG1      ILE  11   0.838  -2.813   0.844
   83   HG21  ILE  11          1HG2      ILE  11  -1.748  -5.488   0.364
   84   HG22  ILE  11          2HG2      ILE  11  -1.592  -6.124   2.000
   85   HG23  ILE  11          3HG2      ILE  11  -0.283  -6.352   0.839
   86   HD11  ILE  11          3HD1      ILE  11   2.083  -4.118  -0.775
   87   HD12  ILE  11          1HD1      ILE  11   1.132  -5.549  -0.373
   88   HD13  ILE  11          2HD1      ILE  11   2.203  -4.834   0.831
   89    H    VAL  12           H        VAL  12  -3.834  -4.345   2.288
   90    HA   VAL  12           HA       VAL  12  -3.467  -5.056   5.103
   91    HB   VAL  12           HB       VAL  12  -6.109  -4.203   3.859
   92   HG11  VAL  12          1HG1      VAL  12  -6.345  -5.703   5.752
   93   HG12  VAL  12          2HG1      VAL  12  -6.895  -4.082   6.176
   94   HG13  VAL  12          3HG1      VAL  12  -5.323  -4.653   6.734
   95   HG21  VAL  12          3HG2      VAL  12  -4.281  -2.579   5.635
   96   HG22  VAL  12          1HG2      VAL  12  -5.902  -2.104   5.132
   97   HG23  VAL  12          2HG2      VAL  12  -4.618  -2.267   3.933
   98    HA   PRO  13           HA       PRO  13  -4.123  -9.060   3.274
   99    HB2  PRO  13           2HB      PRO  13  -4.322 -10.508   5.578
  100    HB3  PRO  13           1HB      PRO  13  -2.785  -9.934   4.923
  101    HG2  PRO  13           2HG      PRO  13  -4.467  -8.772   7.107
  102    HG3  PRO  13           1HG      PRO  13  -2.705  -8.959   7.029
  103    HD2  PRO  13           2HD      PRO  13  -3.939  -6.607   6.554
  104    HD3  PRO  13           1HD      PRO  13  -2.439  -7.072   5.727
  105    H    ILE  14           H        ILE  14  -6.333  -7.554   5.415
  106    HA   ILE  14           HA       ILE  14  -8.390  -9.455   4.616
  107    HB   ILE  14           HB       ILE  14  -9.732  -8.625   6.559
  108   HG12  ILE  14          2HG1      ILE  14  -7.125  -7.320   7.390
  109   HG13  ILE  14          1HG1      ILE  14  -8.573  -6.464   6.879
  110   HG21  ILE  14          1HG2      ILE  14  -8.488  -9.899   8.255
  111   HG22  ILE  14          2HG2      ILE  14  -7.078  -9.897   7.195
  112   HG23  ILE  14          3HG2      ILE  14  -8.553 -10.725   6.698
  113   HD11  ILE  14          3HD1      ILE  14  -8.325  -6.437   9.290
  114   HD12  ILE  14          1HD1      ILE  14  -8.313  -8.201   9.322
  115   HD13  ILE  14          2HD1      ILE  14  -9.766  -7.338   8.819
  116    H    LEU  15           H        LEU  15 -10.322  -8.674   3.843
  117    HA   LEU  15           HA       LEU  15 -10.008  -6.158   2.491
  118    HB2  LEU  15           2HB      LEU  15 -12.239  -8.180   2.334
  119    HB3  LEU  15           1HB      LEU  15 -12.055  -6.776   1.302
  120    HG   LEU  15           HG       LEU  15 -10.140  -9.103   1.428
  121   HD11  LEU  15          1HD1      LEU  15 -12.104  -8.287  -0.685
  122   HD12  LEU  15          2HD1      LEU  15 -12.241  -9.691   0.375
  123   HD13  LEU  15          3HD1      LEU  15 -10.940  -9.605  -0.813
  124   HD21  LEU  15          3HD2      LEU  15  -8.959  -7.050   0.907
  125   HD22  LEU  15          1HD2      LEU  15 -10.160  -6.647  -0.324
  126   HD23  LEU  15          2HD2      LEU  15  -9.108  -8.042  -0.540
  127    H    GLY  16           H        GLY  16 -12.168  -4.822   2.264
  128    HA2  GLY  16           2HA      GLY  16 -13.854  -3.690   3.455
  129    HA3  GLY  16           1HA      GLY  16 -13.266  -4.422   4.952
  130    H    PHE  17           H        PHE  17 -10.741  -3.581   3.134
  131    HA   PHE  17           HA       PHE  17 -10.433  -0.899   4.230
  132    HB2  PHE  17           2HB      PHE  17  -8.381  -3.129   4.147
  133    HB3  PHE  17           1HB      PHE  17  -7.967  -1.443   4.427
  134    HD1  PHE  17           1HD      PHE  17  -9.694  -4.388   5.828
  135    HD2  PHE  17           2HD      PHE  17  -8.332  -0.419   6.534
  136    HE1  PHE  17           1HE      PHE  17 -10.100  -4.680   8.230
  137    HE2  PHE  17           2HE      PHE  17  -8.736  -0.704   8.937
  138    HZ   PHE  17           HZ       PHE  17  -9.620  -2.834   9.792
  139    H    VAL  18           H        VAL  18  -8.401   0.075   2.959
  140    HA   VAL  18           HA       VAL  18  -8.714  -0.652   0.145
  141    HB   VAL  18           HB       VAL  18 -10.143   1.309   0.847
  142   HG11  VAL  18          1HG1      VAL  18  -7.520   2.705   1.251
  143   HG12  VAL  18          2HG1      VAL  18  -8.705   2.292   2.485
  144   HG13  VAL  18          3HG1      VAL  18  -9.109   3.478   1.244
  145   HG21  VAL  18          3HG2      VAL  18  -8.028   1.921  -1.226
  146   HG22  VAL  18          1HG2      VAL  18  -9.576   2.749  -1.073
  147   HG23  VAL  18          2HG2      VAL  18  -9.530   1.039  -1.505
  148    H    TYR  19           H        TYR  19  -6.894   0.440  -1.133
  149    HA   TYR  19           HA       TYR  19  -4.428   0.248   0.364
  150    HB2  TYR  19           2HB      TYR  19  -5.053   0.117  -2.587
  151    HB3  TYR  19           1HB      TYR  19  -3.404   0.346  -2.009
  152    HD1  TYR  19           1HD      TYR  19  -6.324  -1.913  -1.302
  153    HD2  TYR  19           2HD      TYR  19  -2.111  -1.563  -1.806
  154    HE1  TYR  19           1HE      TYR  19  -6.089  -4.321  -0.961
  155    HE2  TYR  19           2HE      TYR  19  -1.875  -3.979  -1.472
  156    HH   TYR  19           HH       TYR  19  -4.503  -6.109  -1.485
  157    H    CYS  20           H        CYS  20  -2.665   1.866  -0.374
  158    HA   CYS  20           HA       CYS  20  -3.698   4.341   0.515
  159    HB2  CYS  20           2HB      CYS  20  -1.429   5.233   0.289
  160    HB3  CYS  20           1HB      CYS  20  -1.415   3.675   1.098
  161    H    CYS  21           H        CYS  21  -3.730   6.290  -0.441
  162    HA   CYS  21           HA       CYS  21  -4.986   6.591  -2.848
  163    HB2  CYS  21           2HB      CYS  21  -3.260   8.514  -1.327
  164    HB3  CYS  21           1HB      CYS  21  -4.334   8.995  -2.660
  165    HA   PRO  22           HA       PRO  22  -2.002   6.333  -6.089
  166    HB2  PRO  22           2HB      PRO  22  -2.957   8.206  -7.828
  167    HB3  PRO  22           1HB      PRO  22  -3.712   6.623  -7.599
  168    HG2  PRO  22           2HG      PRO  22  -4.460   9.268  -6.432
  169    HG3  PRO  22           1HG      PRO  22  -5.508   7.999  -7.094
  170    HD2  PRO  22           2HD      PRO  22  -5.114   8.326  -4.425
  171    HD3  PRO  22           1HD      PRO  22  -5.398   6.731  -5.147
  172    H    GLY  23           H        GLY  23  -0.170   7.296  -6.807
  173    HA2  GLY  23           2HA      GLY  23   1.300   9.113  -7.223
  174    HA3  GLY  23           1HA      GLY  23   0.365  10.091  -6.091
  175    H    LEU  24           H        LEU  24   0.716   7.098  -4.828
  176    HA   LEU  24           HA       LEU  24   3.044   7.946  -3.244
  177    HB2  LEU  24           2HB      LEU  24   0.878   6.089  -2.252
  178    HB3  LEU  24           1HB      LEU  24   2.130   6.900  -1.384
  179    HG   LEU  24           HG       LEU  24  -0.061   8.453  -2.712
  180   HD11  LEU  24          1HD1      LEU  24  -0.974   8.694  -0.432
  181   HD12  LEU  24          2HD1      LEU  24   0.158   7.413   0.075
  182   HD13  LEU  24          3HD1      LEU  24  -1.095   7.078  -1.122
  183   HD21  LEU  24          3HD2      LEU  24   0.710  10.205  -1.134
  184   HD22  LEU  24          1HD2      LEU  24   1.926   9.734  -2.323
  185   HD23  LEU  24          2HD2      LEU  24   2.049   9.146  -0.674
  186    H    ILE  25           H        ILE  25   4.336   6.231  -2.501
  187    HA   ILE  25           HA       ILE  25   4.128   3.829  -4.178
  188    HB   ILE  25           HB       ILE  25   6.588   3.624  -4.113
  189   HG12  ILE  25          2HG1      ILE  25   6.591   6.404  -2.898
  190   HG13  ILE  25          1HG1      ILE  25   6.952   4.928  -2.011
  191   HG21  ILE  25          1HG2      ILE  25   5.589   6.241  -5.218
  192   HG22  ILE  25          2HG2      ILE  25   5.556   4.678  -6.030
  193   HG23  ILE  25          3HG2      ILE  25   7.099   5.458  -5.674
  194   HD11  ILE  25          3HD1      ILE  25   8.895   4.549  -3.433
  195   HD12  ILE  25          1HD1      ILE  25   8.973   6.120  -2.636
  196   HD13  ILE  25          2HD1      ILE  25   8.520   6.015  -4.338
  197    H    CYS  26           H        CYS  26   4.322   1.899  -3.157
  198    HA   CYS  26           HA       CYS  26   4.488   2.084  -0.241
  199    HB2  CYS  26           2HB      CYS  26   2.473   1.016  -1.359
  200    HB3  CYS  26           1HB      CYS  26   3.552  -0.285  -1.866
  201    H    GLY  27           H        GLY  27   6.435   1.856   0.411
  202    HA2  GLY  27           2HA      GLY  27   8.255   0.151  -1.168
  203    HA3  GLY  27           1HA      GLY  27   8.718   1.558  -0.213
  204    HA   PRO  28           HA       PRO  28  10.147  -0.875   3.036
  205    HB2  PRO  28           2HB      PRO  28   9.195   0.514   5.235
  206    HB3  PRO  28           1HB      PRO  28  10.629   0.958   4.305
  207    HG2  PRO  28           2HG      PRO  28   7.844   2.032   4.138
  208    HG3  PRO  28           1HG      PRO  28   9.385   2.904   4.051
  209    HD2  PRO  28           2HD      PRO  28   7.960   2.369   1.857
  210    HD3  PRO  28           1HD      PRO  28   9.733   2.305   1.833
  211    H    PHE  29           H        PHE  29   6.771   0.023   3.318
  212    HA   PHE  29           HA       PHE  29   5.666  -2.458   3.793
  213    HB2  PHE  29           2HB      PHE  29   6.830  -2.388   5.984
  214    HB3  PHE  29           1HB      PHE  29   6.159  -0.798   6.299
  215    HD1  PHE  29           1HD      PHE  29   5.475  -4.374   6.168
  216    HD2  PHE  29           2HD      PHE  29   3.895  -0.544   6.981
  217    HE1  PHE  29           1HE      PHE  29   3.563  -5.421   7.315
  218    HE2  PHE  29           2HE      PHE  29   1.962  -1.559   8.142
  219    HZ   PHE  29           HZ       PHE  29   1.800  -4.012   8.306
  220    H    VAL  30           H        VAL  30   5.806   0.935   4.463
  221    HA   VAL  30           HA       VAL  30   2.930   1.238   4.107
  222    HB   VAL  30           HB       VAL  30   3.251   3.464   5.144
  223   HG11  VAL  30          1HG1      VAL  30   4.510   1.289   6.791
  224   HG12  VAL  30          2HG1      VAL  30   2.770   1.518   6.555
  225   HG13  VAL  30          3HG1      VAL  30   3.712   2.743   7.397
  226   HG21  VAL  30          3HG2      VAL  30   5.530   3.936   4.428
  227   HG22  VAL  30          1HG2      VAL  30   6.134   2.611   5.426
  228   HG23  VAL  30          2HG2      VAL  30   5.420   4.023   6.189
  229    H    CYS  31           H        CYS  31   2.521   3.531   3.141
  230    HA   CYS  31           HA       CYS  31   4.010   3.704   0.655
  231    HB2  CYS  31           2HB      CYS  31   1.366   4.853   1.530
  232    HB3  CYS  31           1HB      CYS  31   2.092   5.153  -0.060
  233    H    VAL  32           H        VAL  32   4.040   6.140  -0.048
  234    HA   VAL  32           HA       VAL  32   4.725   8.079   1.721
  235    HB   VAL  32           HB       VAL  32   6.514   6.601   2.534
  236   HG11  VAL  32          1HG1      VAL  32   7.531   6.545  -0.313
  237   HG12  VAL  32          2HG1      VAL  32   6.835   5.188   0.572
  238   HG13  VAL  32          3HG1      VAL  32   8.375   5.877   1.085
  239   HG21  VAL  32          3HG2      VAL  32   7.595   8.873   0.868
  240   HG22  VAL  32          1HG2      VAL  32   8.471   8.047   2.160
  241   HG23  VAL  32          2HG2      VAL  32   7.008   8.948   2.532
  Start of MODEL   15
    1    H1   ARG   1           H        ARG   1 -11.597  11.094  -4.221
    2    HA   ARG   1           HA       ARG   1 -11.130   8.469  -5.314
    3    HB2  ARG   1           2HB      ARG   1  -8.886  10.339  -4.549
    4    HB3  ARG   1           1HB      ARG   1  -8.701   8.631  -4.891
    5    HG2  ARG   1           2HG      ARG   1  -9.586  10.742  -6.855
    6    HG3  ARG   1           1HG      ARG   1  -7.974  10.040  -6.751
    7    HD2  ARG   1           2HD      ARG   1 -10.534   8.607  -7.454
    8    HD3  ARG   1           1HD      ARG   1  -9.214   8.993  -8.551
    9    HE   ARG   1           HE       ARG   1  -9.027   7.094  -6.307
   10   HH11  ARG   1          1HH1      ARG   1  -7.828   8.149  -9.465
   11   HH12  ARG   1          2HH1      ARG   1  -7.099   6.662  -9.826
   12   HH21  ARG   1          1HH2      ARG   1  -8.037   5.055  -6.812
   13   HH22  ARG   1          2HH2      ARG   1  -7.203   4.875  -8.286
   14    H    ASP   2           H        ASP   2 -11.870   7.304  -3.618
   15    HA   ASP   2           HA       ASP   2 -11.267   8.237  -0.942
   16    HB2  ASP   2           2HB      ASP   2 -13.559   7.410  -1.342
   17    HB3  ASP   2           1HB      ASP   2 -12.901   5.831  -1.780
   18    H    CYS   3           H        CYS   3  -9.438   7.736  -0.195
   19    HA   CYS   3           HA       CYS   3  -8.347   5.086  -0.519
   20    HB2  CYS   3           2HB      CYS   3  -6.197   6.110  -1.326
   21    HB3  CYS   3           1HB      CYS   3  -7.521   6.103  -2.491
   22    H    GLN   4           H        GLN   4  -6.024   5.261   0.540
   23    HA   GLN   4           HA       GLN   4  -6.496   6.640   3.095
   24    HB2  GLN   4           2HB      GLN   4  -5.623   4.782   4.279
   25    HB3  GLN   4           1HB      GLN   4  -6.656   4.104   3.029
   26    HG2  GLN   4           2HG      GLN   4  -4.785   3.560   1.662
   27    HG3  GLN   4           1HG      GLN   4  -3.671   4.278   2.828
   28   HE21  GLN   4          1HE2      GLN   4  -3.702   1.654   1.785
   29   HE22  GLN   4          2HE2      GLN   4  -3.941   0.551   3.092
   30    H    GLU   5           H        GLU   5  -4.595   7.109   4.230
   31    HA   GLU   5           HA       GLU   5  -2.921   8.694   2.715
   32    HB2  GLU   5           2HB      GLU   5  -3.041   7.832   5.533
   33    HB3  GLU   5           1HB      GLU   5  -1.713   8.819   4.921
   34    HG2  GLU   5           2HG      GLU   5  -4.486   9.475   4.339
   35    HG3  GLU   5           1HG      GLU   5  -3.815   9.994   5.897
   36    H    LYS   6           H        LYS   6  -0.660   8.728   2.999
   37    HA   LYS   6           HA       LYS   6   0.467   6.434   1.816
   38    HB2  LYS   6           2HB      LYS   6   2.642   7.694   1.932
   39    HB3  LYS   6           1HB      LYS   6   1.340   8.537   1.109
   40    HG2  LYS   6           2HG      LYS   6   0.863   9.605   3.234
   41    HG3  LYS   6           1HG      LYS   6   2.427   9.074   3.854
   42    HD2  LYS   6           2HD      LYS   6   1.972  10.808   1.396
   43    HD3  LYS   6           1HD      LYS   6   2.432  11.431   2.973
   44    HE2  LYS   6           2HE      LYS   6   4.549  10.104   2.807
   45    HE3  LYS   6           1HE      LYS   6   4.018   9.603   1.200
   46    HZ1  LYS   6           3HZ      LYS   6   4.158  11.765   0.388
   47    HZ2  LYS   6           1HZ      LYS   6   5.582  11.519   1.223
   48    HZ3  LYS   6           2HZ      LYS   6   4.360  12.455   1.900
   49    H    TRP   7           H        TRP   7   0.868   7.816   5.049
   50    HA   TRP   7           HA       TRP   7   2.710   5.711   5.684
   51    HB2  TRP   7           2HB      TRP   7   1.585   7.930   7.389
   52    HB3  TRP   7           1HB      TRP   7   2.820   6.790   7.932
   53    HD1  TRP   7           HD       TRP   7   2.454  10.077   6.297
   54    HE1  TRP   7           1HE      TRP   7   4.718  10.879   5.323
   55    HE3  TRP   7           3HE      TRP   7   5.090   5.740   6.606
   56    HZ2  TRP   7           2HZ      TRP   7   7.223   9.831   4.761
   57    HZ3  TRP   7           3HZ      TRP   7   7.433   5.727   5.799
   58    HH2  TRP   7           HH       TRP   7   8.448   7.745   4.899
   59    H    GLU   8           H        GLU   8  -0.102   4.988   5.058
   60    HA   GLU   8           HA       GLU   8  -1.035   3.854   7.533
   61    HB2  GLU   8           2HB      GLU   8  -2.148   3.733   4.745
   62    HB3  GLU   8           1HB      GLU   8  -2.851   2.894   6.119
   63    HG2  GLU   8           2HG      GLU   8  -2.569   5.853   5.736
   64    HG3  GLU   8           1HG      GLU   8  -4.056   4.896   5.760
   65    H    TYR   9           H        TYR   9  -1.761   1.531   7.316
   66    HA   TYR   9           HA       TYR   9   0.446  -0.058   7.586
   67    HB2  TYR   9           2HB      TYR   9  -2.259  -1.143   6.818
   68    HB3  TYR   9           1HB      TYR   9  -1.030  -1.898   7.824
   69    HD1  TYR   9           1HD      TYR   9  -0.487  -0.827  10.067
   70    HD2  TYR   9           2HD      TYR   9  -3.896   0.235   7.765
   71    HE1  TYR   9           1HE      TYR   9  -1.494   0.168  12.039
   72    HE2  TYR   9           2HE      TYR   9  -4.931   1.232   9.724
   73    HH   TYR   9           HH       TYR   9  -4.812   1.150  12.110
   74    H    CYS  10           H        CYS  10  -1.716   0.107   4.784
   75    HA   CYS  10           HA       CYS  10  -1.450  -0.274   2.573
   76    HB2  CYS  10           2HB      CYS  10   0.716   0.914   2.785
   77    HB3  CYS  10           1HB      CYS  10   1.511  -0.614   3.150
   78    H    ILE  11           H        ILE  11  -1.066  -2.581   4.798
   79    HA   ILE  11           HA       ILE  11  -0.487  -4.711   2.894
   80    HB   ILE  11           HB       ILE  11  -0.413  -6.218   4.855
   81   HG12  ILE  11          2HG1      ILE  11  -0.807  -3.691   6.488
   82   HG13  ILE  11          1HG1      ILE  11  -2.001  -4.970   6.301
   83   HG21  ILE  11          1HG2      ILE  11   1.662  -5.327   5.819
   84   HG22  ILE  11          2HG2      ILE  11   1.320  -3.764   5.076
   85   HG23  ILE  11          3HG2      ILE  11   1.621  -5.176   4.062
   86   HD11  ILE  11          3HD1      ILE  11  -0.506  -6.531   7.429
   87   HD12  ILE  11          1HD1      ILE  11  -0.838  -5.125   8.437
   88   HD13  ILE  11          2HD1      ILE  11   0.704  -5.260   7.592
   89    H    VAL  12           H        VAL  12  -1.874  -6.795   3.537
   90    HA   VAL  12           HA       VAL  12  -4.668  -5.900   3.443
   91    HB   VAL  12           HB       VAL  12  -3.517  -8.447   2.282
   92   HG11  VAL  12          1HG1      VAL  12  -5.845  -8.690   2.942
   93   HG12  VAL  12          2HG1      VAL  12  -5.704  -8.683   1.184
   94   HG13  VAL  12          3HG1      VAL  12  -6.273  -7.244   2.028
   95   HG21  VAL  12          3HG2      VAL  12  -3.909  -7.441   0.089
   96   HG22  VAL  12          1HG2      VAL  12  -2.734  -6.520   1.028
   97   HG23  VAL  12          2HG2      VAL  12  -4.394  -5.937   0.869
   98    HA   PRO  13           HA       PRO  13  -4.472  -8.351   7.298
   99    HB2  PRO  13           2HB      PRO  13  -6.602  -6.539   8.157
  100    HB3  PRO  13           1HB      PRO  13  -5.008  -6.775   8.876
  101    HG2  PRO  13           2HG      PRO  13  -5.667  -4.488   7.617
  102    HG3  PRO  13           1HG      PRO  13  -4.029  -5.163   7.560
  103    HD2  PRO  13           2HD      PRO  13  -6.202  -5.355   5.506
  104    HD3  PRO  13           1HD      PRO  13  -4.478  -4.961   5.300
  105    H    ILE  14           H        ILE  14  -7.239  -7.042   5.591
  106    HA   ILE  14           HA       ILE  14  -8.645  -9.561   5.606
  107    HB   ILE  14           HB       ILE  14 -10.785  -8.335   6.240
  108   HG12  ILE  14          2HG1      ILE  14  -8.819  -6.267   7.268
  109   HG13  ILE  14          1HG1      ILE  14 -10.004  -6.042   5.991
  110   HG21  ILE  14          1HG2      ILE  14  -8.732  -8.684   8.412
  111   HG22  ILE  14          2HG2      ILE  14  -9.812  -9.921   7.771
  112   HG23  ILE  14          3HG2      ILE  14 -10.472  -8.551   8.665
  113   HD11  ILE  14          3HD1      ILE  14 -10.715  -4.990   8.052
  114   HD12  ILE  14          1HD1      ILE  14 -10.598  -6.533   8.899
  115   HD13  ILE  14          2HD1      ILE  14 -11.800  -6.317   7.629
  116    H    LEU  15           H        LEU  15 -10.543  -9.325   4.073
  117    HA   LEU  15           HA       LEU  15  -9.634  -7.721   1.873
  118    HB2  LEU  15           2HB      LEU  15 -11.443  -8.782   0.543
  119    HB3  LEU  15           1HB      LEU  15 -10.349  -9.925   1.275
  120    HG   LEU  15           HG       LEU  15 -12.139 -10.328   3.035
  121   HD11  LEU  15          1HD1      LEU  15 -13.470  -8.321   2.704
  122   HD12  LEU  15          2HD1      LEU  15 -14.426  -9.782   2.470
  123   HD13  LEU  15          3HD1      LEU  15 -13.882  -8.854   1.073
  124   HD21  LEU  15          3HD2      LEU  15 -13.418 -11.807   1.582
  125   HD22  LEU  15          1HD2      LEU  15 -11.692 -11.882   1.237
  126   HD23  LEU  15          2HD2      LEU  15 -12.766 -10.980   0.167
  127    H    GLY  16           H        GLY  16 -11.418  -6.563   0.555
  128    HA2  GLY  16           2HA      GLY  16 -12.850  -4.766   0.464
  129    HA3  GLY  16           1HA      GLY  16 -13.443  -5.231   2.062
  130    H    PHE  17           H        PHE  17 -10.151  -4.603   1.198
  131    HA   PHE  17           HA       PHE  17  -9.968  -2.701   3.359
  132    HB2  PHE  17           2HB      PHE  17  -7.526  -2.848   3.008
  133    HB3  PHE  17           1HB      PHE  17  -8.249  -4.429   3.246
  134    HD1  PHE  17           2HD      PHE  17  -8.379  -6.023   1.385
  135    HD2  PHE  17           1HD      PHE  17  -6.501  -2.231   0.912
  136    HE1  PHE  17           2HE      PHE  17  -7.321  -6.807  -0.690
  137    HE2  PHE  17           1HE      PHE  17  -5.439  -3.018  -1.164
  138    HZ   PHE  17           HZ       PHE  17  -5.848  -5.305  -1.965
  139    H    VAL  18           H        VAL  18  -8.519  -0.817   2.946
  140    HA   VAL  18           HA       VAL  18  -9.279   0.509   0.445
  141    HB   VAL  18           HB       VAL  18  -8.328   1.740   3.066
  142   HG11  VAL  18          1HG1      VAL  18  -7.885   3.143   1.122
  143   HG12  VAL  18          2HG1      VAL  18  -9.130   3.855   2.148
  144   HG13  VAL  18          3HG1      VAL  18  -9.582   3.039   0.652
  145   HG21  VAL  18          3HG2      VAL  18 -10.503   0.650   3.359
  146   HG22  VAL  18          1HG2      VAL  18 -11.147   1.571   2.004
  147   HG23  VAL  18          2HG2      VAL  18 -10.639   2.403   3.478
  148    H    TYR  19           H        TYR  19  -7.544   1.531  -0.733
  149    HA   TYR  19           HA       TYR  19  -4.902   0.545   0.069
  150    HB2  TYR  19           2HB      TYR  19  -5.936  -0.309  -2.118
  151    HB3  TYR  19           1HB      TYR  19  -5.739   1.324  -2.734
  152    HD1  TYR  19           1HD      TYR  19  -3.816  -1.494  -1.241
  153    HD2  TYR  19           2HD      TYR  19  -3.701   1.926  -3.775
  154    HE1  TYR  19           1HE      TYR  19  -1.549  -2.086  -1.912
  155    HE2  TYR  19           2HE      TYR  19  -1.413   1.339  -4.459
  156    HH   TYR  19           HH       TYR  19  -0.080  -1.688  -3.861
  157    H    CYS  20           H        CYS  20  -3.072   2.063  -0.732
  158    HA   CYS  20           HA       CYS  20  -3.778   4.612   0.347
  159    HB2  CYS  20           2HB      CYS  20  -1.402   5.203   0.159
  160    HB3  CYS  20           1HB      CYS  20  -1.611   3.661   0.968
  161    H    CYS  21           H        CYS  21  -3.689   6.499  -0.552
  162    HA   CYS  21           HA       CYS  21  -4.941   6.958  -2.909
  163    HB2  CYS  21           2HB      CYS  21  -3.068   8.666  -1.349
  164    HB3  CYS  21           1HB      CYS  21  -4.067   9.283  -2.695
  165    HA   PRO  22           HA       PRO  22  -2.247   6.660  -6.397
  166    HB2  PRO  22           2HB      PRO  22  -3.195   8.742  -7.919
  167    HB3  PRO  22           1HB      PRO  22  -4.028   7.192  -7.767
  168    HG2  PRO  22           2HG      PRO  22  -4.564   9.772  -6.365
  169    HG3  PRO  22           1HG      PRO  22  -5.711   8.587  -7.016
  170    HD2  PRO  22           2HD      PRO  22  -5.103   8.752  -4.373
  171    HD3  PRO  22           1HD      PRO  22  -5.529   7.218  -5.152
  172    H    GLY  23           H        GLY  23  -0.280   7.369  -6.838
  173    HA2  GLY  23           2HA      GLY  23   1.360   9.061  -7.230
  174    HA3  GLY  23           1HA      GLY  23   0.471  10.122  -6.141
  175    H    LEU  24           H        LEU  24   0.630   7.008  -4.927
  176    HA   LEU  24           HA       LEU  24   2.954   7.721  -3.265
  177    HB2  LEU  24           2HB      LEU  24   0.697   5.985  -2.254
  178    HB3  LEU  24           1HB      LEU  24   1.982   6.738  -1.408
  179    HG   LEU  24           HG       LEU  24  -0.154   8.394  -2.707
  180   HD11  LEU  24          1HD1      LEU  24  -1.223   7.062  -1.089
  181   HD12  LEU  24          2HD1      LEU  24  -1.003   8.669  -0.380
  182   HD13  LEU  24          3HD1      LEU  24   0.075   7.330   0.066
  183   HD21  LEU  24          3HD2      LEU  24   1.889   9.603  -2.355
  184   HD22  LEU  24          1HD2      LEU  24   2.016   9.011  -0.698
  185   HD23  LEU  24          2HD2      LEU  24   0.717  10.114  -1.142
  186    H    ILE  25           H        ILE  25   4.158   5.978  -2.543
  187    HA   ILE  25           HA       ILE  25   3.778   3.501  -4.074
  188    HB   ILE  25           HB       ILE  25   6.247   3.216  -4.055
  189   HG12  ILE  25          2HG1      ILE  25   6.294   6.141  -3.263
  190   HG13  ILE  25          1HG1      ILE  25   6.766   4.797  -2.232
  191   HG21  ILE  25          1HG2      ILE  25   5.180   5.614  -5.542
  192   HG22  ILE  25          2HG2      ILE  25   5.125   3.934  -6.075
  193   HG23  ILE  25          3HG2      ILE  25   6.675   4.769  -5.941
  194   HD11  ILE  25          3HD1      ILE  25   8.114   5.615  -4.795
  195   HD12  ILE  25          1HD1      ILE  25   8.597   4.278  -3.750
  196   HD13  ILE  25          2HD1      ILE  25   8.693   5.936  -3.160
  197    H    CYS  26           H        CYS  26   4.069   1.611  -2.987
  198    HA   CYS  26           HA       CYS  26   4.248   1.870  -0.087
  199    HB2  CYS  26           2HB      CYS  26   2.381   0.662  -1.265
  200    HB3  CYS  26           1HB      CYS  26   3.548  -0.581  -1.727
  201    H    GLY  27           H        GLY  27   6.248   1.969   0.496
  202    HA2  GLY  27           2HA      GLY  27   8.238   0.439  -1.037
  203    HA3  GLY  27           1HA      GLY  27   8.546   1.898  -0.110
  204    HA   PRO  28           HA       PRO  28  10.317  -0.401   3.105
  205    HB2  PRO  28           2HB      PRO  28   9.381   0.877   5.344
  206    HB3  PRO  28           1HB      PRO  28  10.663   1.510   4.307
  207    HG2  PRO  28           2HG      PRO  28   7.739   2.170   4.304
  208    HG3  PRO  28           1HG      PRO  28   9.123   3.274   4.208
  209    HD2  PRO  28           2HD      PRO  28   7.767   2.612   2.023
  210    HD3  PRO  28           1HD      PRO  28   9.539   2.746   1.981
  211    H    PHE  29           H        PHE  29   6.878   0.148   3.403
  212    HA   PHE  29           HA       PHE  29   6.100  -2.450   3.986
  213    HB2  PHE  29           2HB      PHE  29   7.255  -1.985   6.178
  214    HB3  PHE  29           1HB      PHE  29   6.218  -0.587   6.389
  215    HD1  PHE  29           2HD      PHE  29   3.768  -0.962   6.680
  216    HD2  PHE  29           1HD      PHE  29   6.581  -4.110   6.835
  217    HE1  PHE  29           2HE      PHE  29   2.118  -2.349   7.892
  218    HE2  PHE  29           1HE      PHE  29   4.953  -5.520   8.043
  219    HZ   PHE  29           HZ       PHE  29   2.722  -4.637   8.576
  220    H    VAL  30           H        VAL  30   5.769   0.952   4.567
  221    HA   VAL  30           HA       VAL  30   2.894   0.893   4.116
  222    HB   VAL  30           HB       VAL  30   2.940   3.132   5.207
  223   HG11  VAL  30          1HG1      VAL  30   4.319   1.006   6.847
  224   HG12  VAL  30          2HG1      VAL  30   2.576   1.121   6.577
  225   HG13  VAL  30          3HG1      VAL  30   3.415   2.384   7.478
  226   HG21  VAL  30          3HG2      VAL  30   5.011   3.820   6.392
  227   HG22  VAL  30          1HG2      VAL  30   5.178   3.860   4.630
  228   HG23  VAL  30          2HG2      VAL  30   5.872   2.533   5.558
  229    H    CYS  31           H        CYS  31   2.271   3.166   3.140
  230    HA   CYS  31           HA       CYS  31   3.765   3.479   0.660
  231    HB2  CYS  31           2HB      CYS  31   1.107   4.571   1.591
  232    HB3  CYS  31           1HB      CYS  31   1.836   4.971   0.029
  233    H    VAL  32           H        VAL  32   3.727   5.907  -0.041
  234    HA   VAL  32           HA       VAL  32   4.525   7.855   1.675
  235    HB   VAL  32           HB       VAL  32   6.300   6.393   2.474
  236   HG11  VAL  32          1HG1      VAL  32   8.094   5.564   0.976
  237   HG12  VAL  32          2HG1      VAL  32   7.200   6.188  -0.411
  238   HG13  VAL  32          3HG1      VAL  32   6.520   4.886   0.563
  239   HG21  VAL  32          3HG2      VAL  32   8.265   7.770   1.972
  240   HG22  VAL  32          1HG2      VAL  32   6.833   8.728   2.337
  241   HG23  VAL  32          2HG2      VAL  32   7.370   8.553   0.663
  Start of MODEL   16
    1    H1   ARG   1           H        ARG   1  -9.846  12.049  -0.848
    2    HA   ARG   1           HA       ARG   1 -11.784  10.917  -2.591
    3    HB2  ARG   1           2HB      ARG   1  -8.861  10.375  -3.113
    4    HB3  ARG   1           1HB      ARG   1 -10.210   9.516  -3.825
    5    HG2  ARG   1           2HG      ARG   1  -9.550  12.423  -4.264
    6    HG3  ARG   1           1HG      ARG   1  -9.206  11.113  -5.386
    7    HD2  ARG   1           2HD      ARG   1 -11.167  12.117  -6.202
    8    HD3  ARG   1           1HD      ARG   1 -11.706  10.663  -5.378
    9    HE   ARG   1           HE       ARG   1 -11.754  12.804  -3.581
   10   HH11  ARG   1          1HH1      ARG   1 -13.524  11.595  -6.402
   11   HH12  ARG   1          2HH1      ARG   1 -14.987  12.377  -6.013
   12   HH21  ARG   1          1HH2      ARG   1 -13.782  13.890  -3.044
   13   HH22  ARG   1          2HH2      ARG   1 -15.117  13.746  -4.096
   14    H    ASP   2           H        ASP   2 -12.124   8.805  -2.188
   15    HA   ASP   2           HA       ASP   2 -11.411   8.159   0.504
   16    HB2  ASP   2           2HB      ASP   2 -13.436   7.051  -1.389
   17    HB3  ASP   2           1HB      ASP   2 -12.990   6.166   0.063
   18    H    CYS   3           H        CYS   3  -9.339   7.825   0.246
   19    HA   CYS   3           HA       CYS   3  -8.601   5.080  -0.331
   20    HB2  CYS   3           2HB      CYS   3  -6.535   5.935  -1.484
   21    HB3  CYS   3           1HB      CYS   3  -8.012   6.177  -2.409
   22    H    GLN   4           H        GLN   4  -6.144   4.974   0.483
   23    HA   GLN   4           HA       GLN   4  -6.401   6.280   3.075
   24    HB2  GLN   4           2HB      GLN   4  -5.367   4.432   4.123
   25    HB3  GLN   4           1HB      GLN   4  -6.505   3.793   2.947
   26    HG2  GLN   4           2HG      GLN   4  -4.854   3.242   1.445
   27    HG3  GLN   4           1HG      GLN   4  -3.589   4.005   2.412
   28   HE21  GLN   4          1HE2      GLN   4  -3.889   1.221   1.552
   29   HE22  GLN   4          2HE2      GLN   4  -3.885   0.299   3.018
   30    H    GLU   5           H        GLU   5  -4.614   6.948   4.094
   31    HA   GLU   5           HA       GLU   5  -2.991   8.536   2.426
   32    HB2  GLU   5           2HB      GLU   5  -2.940   8.044   5.373
   33    HB3  GLU   5           1HB      GLU   5  -1.914   9.232   4.558
   34    HG2  GLU   5           2HG      GLU   5  -3.935  10.385   3.790
   35    HG3  GLU   5           1HG      GLU   5  -4.917   9.200   4.649
   36    H    LYS   6           H        LYS   6  -0.629   8.715   2.966
   37    HA   LYS   6           HA       LYS   6   0.485   6.382   1.929
   38    HB2  LYS   6           2HB      LYS   6   2.656   7.649   1.923
   39    HB3  LYS   6           1HB      LYS   6   1.324   8.475   1.127
   40    HG2  LYS   6           2HG      LYS   6   0.937   9.548   3.321
   41    HG3  LYS   6           1HG      LYS   6   2.572   9.086   3.771
   42    HD2  LYS   6           2HD      LYS   6   1.793  10.796   1.382
   43    HD3  LYS   6           1HD      LYS   6   2.422  11.422   2.896
   44    HE2  LYS   6           2HE      LYS   6   4.523  10.158   2.483
   45    HE3  LYS   6           1HE      LYS   6   3.848   9.640   0.937
   46    HZ1  LYS   6           3HZ      LYS   6   3.693  11.982   0.276
   47    HZ2  LYS   6           1HZ      LYS   6   5.269  11.526   0.628
   48    HZ3  LYS   6           2HZ      LYS   6   4.419  12.440   1.736
   49    H    TRP   7           H        TRP   7   0.904   7.940   5.071
   50    HA   TRP   7           HA       TRP   7   2.797   5.941   5.835
   51    HB2  TRP   7           2HB      TRP   7   1.583   8.201   7.413
   52    HB3  TRP   7           1HB      TRP   7   2.871   7.150   8.010
   53    HD1  TRP   7           HD       TRP   7   2.362  10.317   6.165
   54    HE1  TRP   7           1HE      TRP   7   4.572  11.107   5.077
   55    HE3  TRP   7           3HE      TRP   7   5.148   6.075   6.717
   56    HZ2  TRP   7           2HZ      TRP   7   7.107  10.109   4.553
   57    HZ3  TRP   7           3HZ      TRP   7   7.465   6.086   5.879
   58    HH2  TRP   7           HH       TRP   7   8.404   8.082   4.812
   59    H    GLU   8           H        GLU   8   0.001   5.101   5.272
   60    HA   GLU   8           HA       GLU   8  -0.930   4.058   7.815
   61    HB2  GLU   8           2HB      GLU   8  -1.928   3.789   4.985
   62    HB3  GLU   8           1HB      GLU   8  -2.641   2.926   6.335
   63    HG2  GLU   8           2HG      GLU   8  -2.500   5.895   5.950
   64    HG3  GLU   8           1HG      GLU   8  -3.927   4.862   5.810
   65    H    TYR   9           H        TYR   9  -1.603   1.552   7.441
   66    HA   TYR   9           HA       TYR   9   0.950   0.284   7.238
   67    HB2  TYR   9           2HB      TYR   9  -1.771  -0.971   7.667
   68    HB3  TYR   9           1HB      TYR   9  -0.228  -1.800   7.828
   69    HD1  TYR   9           1HD      TYR   9   1.433  -0.837   9.563
   70    HD2  TYR   9           2HD      TYR   9  -2.711   0.097   9.498
   71    HE1  TYR   9           1HE      TYR   9   1.569  -0.120  11.891
   72    HE2  TYR   9           2HE      TYR   9  -2.594   0.818  11.825
   73    HH   TYR   9           HH       TYR   9   0.386   1.329  13.416
   74    H    CYS  10           H        CYS  10  -1.337   1.102   5.006
   75    HA   CYS  10           HA       CYS  10  -1.285   1.000   2.757
   76    HB2  CYS  10           2HB      CYS  10   1.079   1.078   2.873
   77    HB3  CYS  10           1HB      CYS  10   1.228  -0.631   3.258
   78    H    ILE  11           H        ILE  11  -2.114  -1.364   4.712
   79    HA   ILE  11           HA       ILE  11  -2.677  -3.404   2.692
   80    HB   ILE  11           HB       ILE  11  -2.992  -3.521   5.707
   81   HG12  ILE  11          2HG1      ILE  11  -0.880  -4.752   3.928
   82   HG13  ILE  11          1HG1      ILE  11  -0.648  -3.346   4.958
   83   HG21  ILE  11          1HG2      ILE  11  -3.195  -5.723   3.640
   84   HG22  ILE  11          2HG2      ILE  11  -4.537  -5.040   4.557
   85   HG23  ILE  11          3HG2      ILE  11  -3.270  -5.945   5.390
   86   HD11  ILE  11          3HD1      ILE  11  -1.048  -4.705   6.926
   87   HD12  ILE  11          1HD1      ILE  11   0.262  -5.372   5.950
   88   HD13  ILE  11          2HD1      ILE  11  -1.340  -6.112   5.901
   89    H    VAL  12           H        VAL  12  -4.677  -3.751   1.969
   90    HA   VAL  12           HA       VAL  12  -6.901  -2.486   3.362
   91    HB   VAL  12           HB       VAL  12  -8.093  -2.340   1.220
   92   HG11  VAL  12          1HG1      VAL  12  -6.769  -0.433   1.840
   93   HG12  VAL  12          2HG1      VAL  12  -6.745  -0.638   0.088
   94   HG13  VAL  12          3HG1      VAL  12  -5.351  -1.124   1.052
   95   HG21  VAL  12          3HG2      VAL  12  -7.176  -4.279   0.089
   96   HG22  VAL  12          1HG2      VAL  12  -5.596  -3.502  -0.001
   97   HG23  VAL  12          2HG2      VAL  12  -6.953  -2.842  -0.913
   98    HA   PRO  13           HA       PRO  13  -8.656  -6.506   3.945
   99    HB2  PRO  13           2HB      PRO  13 -11.216  -5.858   2.648
  100    HB3  PRO  13           1HB      PRO  13 -10.872  -6.202   4.345
  101    HG2  PRO  13           2HG      PRO  13 -11.496  -3.741   3.545
  102    HG3  PRO  13           1HG      PRO  13 -10.277  -4.010   4.807
  103    HD2  PRO  13           2HD      PRO  13  -9.895  -3.444   1.889
  104    HD3  PRO  13           1HD      PRO  13  -9.089  -2.698   3.291
  105    H    ILE  14           H        ILE  14  -7.326  -6.327   1.292
  106    HA   ILE  14           HA       ILE  14  -8.709  -8.570   0.005
  107    HB   ILE  14           HB       ILE  14  -7.342  -6.321  -1.527
  108   HG12  ILE  14          2HG1      ILE  14 -10.307  -6.930  -1.347
  109   HG13  ILE  14          1HG1      ILE  14  -9.511  -5.597  -0.521
  110   HG21  ILE  14          1HG2      ILE  14  -7.197  -8.502  -2.622
  111   HG22  ILE  14          2HG2      ILE  14  -8.283  -7.440  -3.517
  112   HG23  ILE  14          3HG2      ILE  14  -8.944  -8.705  -2.482
  113   HD11  ILE  14          3HD1      ILE  14  -8.919  -4.622  -2.684
  114   HD12  ILE  14          1HD1      ILE  14 -10.661  -4.850  -2.527
  115   HD13  ILE  14          2HD1      ILE  14  -9.711  -5.969  -3.502
  116    H    LEU  15           H        LEU  15  -7.320 -10.249  -0.151
  117    HA   LEU  15           HA       LEU  15  -4.575  -9.857   0.549
  118    HB2  LEU  15           2HB      LEU  15  -6.114 -12.315  -0.236
  119    HB3  LEU  15           1HB      LEU  15  -4.377 -12.353  -0.072
  120    HG   LEU  15           HG       LEU  15  -5.297 -13.238   1.914
  121   HD11  LEU  15          1HD1      LEU  15  -3.379 -11.819   2.255
  122   HD12  LEU  15          2HD1      LEU  15  -4.471 -11.767   3.637
  123   HD13  LEU  15          3HD1      LEU  15  -4.433 -10.423   2.503
  124   HD21  LEU  15          3HD2      LEU  15  -6.976 -10.753   2.118
  125   HD22  LEU  15          1HD2      LEU  15  -6.863 -12.015   3.347
  126   HD23  LEU  15          2HD2      LEU  15  -7.546 -12.385   1.762
  127    H    GLY  16           H        GLY  16  -2.914  -9.610  -0.643
  128    HA2  GLY  16           2HA      GLY  16  -1.512  -9.788  -2.476
  129    HA3  GLY  16           1HA      GLY  16  -2.841 -10.469  -3.391
  130    H    PHE  17           H        PHE  17  -4.222  -7.886  -2.115
  131    HA   PHE  17           HA       PHE  17  -3.184  -6.092  -4.169
  132    HB2  PHE  17           2HB      PHE  17  -5.339  -7.157  -4.864
  133    HB3  PHE  17           1HB      PHE  17  -6.100  -6.453  -3.448
  134    HD1  PHE  17           1HD      PHE  17  -4.547  -5.731  -6.692
  135    HD2  PHE  17           2HD      PHE  17  -6.773  -4.158  -3.434
  136    HE1  PHE  17           1HE      PHE  17  -5.058  -3.728  -8.018
  137    HE2  PHE  17           2HE      PHE  17  -7.285  -2.146  -4.761
  138    HZ   PHE  17           HZ       PHE  17  -6.428  -1.931  -7.050
  139    H    VAL  18           H        VAL  18  -2.236  -4.547  -3.014
  140    HA   VAL  18           HA       VAL  18  -3.777  -3.429  -0.814
  141    HB   VAL  18           HB       VAL  18  -1.659  -2.858   0.374
  142   HG11  VAL  18          1HG1      VAL  18  -1.140  -5.094   1.228
  143   HG12  VAL  18          2HG1      VAL  18  -1.990  -5.806  -0.142
  144   HG13  VAL  18          3HG1      VAL  18  -2.879  -4.851   1.041
  145   HG21  VAL  18          3HG2      VAL  18  -0.318  -4.626  -1.680
  146   HG22  VAL  18          1HG2      VAL  18   0.453  -3.966  -0.239
  147   HG23  VAL  18          2HG2      VAL  18  -0.102  -2.884  -1.518
  148    H    TYR  19           H        TYR  19  -4.114  -1.275  -0.919
  149    HA   TYR  19           HA       TYR  19  -2.467   0.184  -2.786
  150    HB2  TYR  19           2HB      TYR  19  -4.341   1.186  -3.939
  151    HB3  TYR  19           1HB      TYR  19  -4.474  -0.559  -4.055
  152    HD1  TYR  19           2HD      TYR  19  -6.266  -1.721  -2.818
  153    HD2  TYR  19           1HD      TYR  19  -5.973   2.513  -2.795
  154    HE1  TYR  19           2HE      TYR  19  -8.559  -1.578  -1.983
  155    HE2  TYR  19           1HE      TYR  19  -8.275   2.678  -1.955
  156    HH   TYR  19           HH       TYR  19 -10.319   1.279  -1.986
  157    H    CYS  20           H        CYS  20  -2.742   2.463  -2.603
  158    HA   CYS  20           HA       CYS  20  -4.119   3.565  -0.300
  159    HB2  CYS  20           2HB      CYS  20  -2.056   4.939   0.243
  160    HB3  CYS  20           1HB      CYS  20  -1.873   3.235   0.625
  161    H    CYS  21           H        CYS  21  -3.587   6.136  -0.638
  162    HA   CYS  21           HA       CYS  21  -4.975   6.824  -2.932
  163    HB2  CYS  21           2HB      CYS  21  -3.118   8.376  -1.187
  164    HB3  CYS  21           1HB      CYS  21  -4.083   9.151  -2.475
  165    HA   PRO  22           HA       PRO  22  -2.171   6.665  -6.301
  166    HB2  PRO  22           2HB      PRO  22  -2.953   8.797  -7.815
  167    HB3  PRO  22           1HB      PRO  22  -3.874   7.294  -7.716
  168    HG2  PRO  22           2HG      PRO  22  -4.298   9.878  -6.282
  169    HG3  PRO  22           1HG      PRO  22  -5.492   8.788  -7.013
  170    HD2  PRO  22           2HD      PRO  22  -5.002   8.844  -4.344
  171    HD3  PRO  22           1HD      PRO  22  -5.478   7.359  -5.177
  172    H    GLY  23           H        GLY  23  -0.265   7.433  -6.975
  173    HA2  GLY  23           2HA      GLY  23   1.369   9.106  -7.360
  174    HA3  GLY  23           1HA      GLY  23   0.612  10.096  -6.119
  175    H    LEU  24           H        LEU  24   0.412   7.511  -4.552
  176    HA   LEU  24           HA       LEU  24   2.955   7.885  -3.177
  177    HB2  LEU  24           2HB      LEU  24   0.758   6.048  -2.253
  178    HB3  LEU  24           1HB      LEU  24   2.003   6.839  -1.365
  179    HG   LEU  24           HG       LEU  24  -0.218   8.389  -2.642
  180   HD11  LEU  24          1HD1      LEU  24  -1.123   8.555  -0.361
  181   HD12  LEU  24          2HD1      LEU  24   0.048   7.319   0.145
  182   HD13  LEU  24          3HD1      LEU  24  -1.184   6.937  -1.047
  183   HD21  LEU  24          3HD2      LEU  24   1.924   9.102  -0.634
  184   HD22  LEU  24          1HD2      LEU  24   0.550  10.138  -1.049
  185   HD23  LEU  24          2HD2      LEU  24   1.741   9.707  -2.271
  186    H    ILE  25           H        ILE  25   4.108   6.042  -2.484
  187    HA   ILE  25           HA       ILE  25   3.714   3.623  -4.082
  188    HB   ILE  25           HB       ILE  25   6.225   3.363  -4.085
  189   HG12  ILE  25          2HG1      ILE  25   6.190   6.296  -3.309
  190   HG13  ILE  25          1HG1      ILE  25   6.711   4.978  -2.272
  191   HG21  ILE  25          1HG2      ILE  25   5.078   5.697  -5.594
  192   HG22  ILE  25          2HG2      ILE  25   5.092   4.008  -6.105
  193   HG23  ILE  25          3HG2      ILE  25   6.605   4.906  -5.973
  194   HD11  ILE  25          3HD1      ILE  25   8.014   5.810  -4.851
  195   HD12  ILE  25          1HD1      ILE  25   8.557   4.513  -3.786
  196   HD13  ILE  25          2HD1      ILE  25   8.589   6.186  -3.226
  197    H    CYS  26           H        CYS  26   3.887   1.767  -2.934
  198    HA   CYS  26           HA       CYS  26   4.200   2.022  -0.057
  199    HB2  CYS  26           2HB      CYS  26   2.391   0.727  -1.260
  200    HB3  CYS  26           1HB      CYS  26   3.610  -0.506  -1.624
  201    H    GLY  27           H        GLY  27   6.179   2.220   0.522
  202    HA2  GLY  27           2HA      GLY  27   8.288   1.091  -1.102
  203    HA3  GLY  27           1HA      GLY  27   8.504   2.253   0.188
  204    HA   PRO  28           HA       PRO  28   9.838  -1.135   2.620
  205    HB2  PRO  28           2HB      PRO  28   8.997  -0.042   5.140
  206    HB3  PRO  28           1HB      PRO  28  10.601  -0.007   4.424
  207    HG2  PRO  28           2HG      PRO  28   8.994   2.233   4.787
  208    HG3  PRO  28           1HG      PRO  28  10.361   2.127   3.673
  209    HD2  PRO  28           2HD      PRO  28   7.441   1.936   3.116
  210    HD3  PRO  28           1HD      PRO  28   8.743   2.605   2.119
  211    H    PHE  29           H        PHE  29   7.129  -0.065   4.607
  212    HA   PHE  29           HA       PHE  29   5.627  -2.476   3.861
  213    HB2  PHE  29           2HB      PHE  29   6.689  -2.754   6.112
  214    HB3  PHE  29           1HB      PHE  29   5.883  -1.283   6.636
  215    HD1  PHE  29           1HD      PHE  29   5.256  -4.728   5.443
  216    HD2  PHE  29           2HD      PHE  29   3.708  -1.364   7.529
  217    HE1  PHE  29           1HE      PHE  29   3.338  -6.076   6.178
  218    HE2  PHE  29           2HE      PHE  29   1.780  -2.705   8.269
  219    HZ   PHE  29           HZ       PHE  29   1.593  -5.059   7.598
  220    H    VAL  30           H        VAL  30   5.816   0.874   4.438
  221    HA   VAL  30           HA       VAL  30   2.915   1.196   4.337
  222    HB   VAL  30           HB       VAL  30   3.284   3.397   5.341
  223   HG11  VAL  30          1HG1      VAL  30   4.083   2.711   7.563
  224   HG12  VAL  30          2HG1      VAL  30   4.660   1.192   6.867
  225   HG13  VAL  30          3HG1      VAL  30   2.937   1.567   6.866
  226   HG21  VAL  30          3HG2      VAL  30   6.209   2.650   5.326
  227   HG22  VAL  30          1HG2      VAL  30   5.533   4.038   6.186
  228   HG23  VAL  30          2HG2      VAL  30   5.448   3.960   4.427
  229    H    CYS  31           H        CYS  31   2.342   3.316   3.243
  230    HA   CYS  31           HA       CYS  31   3.778   3.604   0.723
  231    HB2  CYS  31           2HB      CYS  31   1.173   4.663   1.774
  232    HB3  CYS  31           1HB      CYS  31   1.869   5.218   0.234
  233    H    VAL  32           H        VAL  32   3.876   5.928   0.034
  234    HA   VAL  32           HA       VAL  32   4.629   7.939   1.717
  235    HB   VAL  32           HB       VAL  32   6.400   6.505   2.585
  236   HG11  VAL  32          1HG1      VAL  32   7.346   6.200  -0.282
  237   HG12  VAL  32          2HG1      VAL  32   6.619   4.931   0.705
  238   HG13  VAL  32          3HG1      VAL  32   8.195   5.593   1.142
  239   HG21  VAL  32          3HG2      VAL  32   7.480   8.579   0.694
  240   HG22  VAL  32          1HG2      VAL  32   8.390   7.852   2.021
  241   HG23  VAL  32          2HG2      VAL  32   6.958   8.823   2.362
  Start of MODEL   17
    1    H1   ARG   1           H        ARG   1 -12.751   9.421  -3.453
    2    HA   ARG   1           HA       ARG   1 -13.261   6.849  -4.198
    3    HB2  ARG   1           2HB      ARG   1 -10.455   7.730  -4.877
    4    HB3  ARG   1           1HB      ARG   1 -10.971   6.054  -4.751
    5    HG2  ARG   1           2HG      ARG   1 -12.110   8.057  -6.688
    6    HG3  ARG   1           1HG      ARG   1 -10.860   6.872  -7.071
    7    HD2  ARG   1           2HD      ARG   1 -13.649   6.232  -6.101
    8    HD3  ARG   1           1HD      ARG   1 -13.097   6.130  -7.769
    9    HE   ARG   1           HE       ARG   1 -11.328   4.588  -6.489
   10   HH11  ARG   1          1HH1      ARG   1 -14.870   4.573  -6.464
   11   HH12  ARG   1          2HH1      ARG   1 -14.977   2.899  -6.196
   12   HH21  ARG   1          1HH2      ARG   1 -11.474   2.349  -6.101
   13   HH22  ARG   1          2HH2      ARG   1 -12.989   1.590  -5.978
   14    H    ASP   2           H        ASP   2 -12.587   5.421  -2.631
   15    HA   ASP   2           HA       ASP   2 -11.717   6.726  -0.195
   16    HB2  ASP   2           2HB      ASP   2 -13.698   5.387   0.042
   17    HB3  ASP   2           1HB      ASP   2 -12.908   3.996  -0.690
   18    H    CYS   3           H        CYS   3  -9.617   6.916  -0.141
   19    HA   CYS   3           HA       CYS   3  -8.064   4.476  -0.357
   20    HB2  CYS   3           2HB      CYS   3  -6.247   5.744  -1.435
   21    HB3  CYS   3           1HB      CYS   3  -7.694   5.710  -2.434
   22    H    GLN   4           H        GLN   4  -5.894   4.830   0.699
   23    HA   GLN   4           HA       GLN   4  -6.367   6.383   3.146
   24    HB2  GLN   4           2HB      GLN   4  -5.256   4.664   4.393
   25    HB3  GLN   4           1HB      GLN   4  -6.379   3.906   3.275
   26    HG2  GLN   4           2HG      GLN   4  -4.676   3.307   1.786
   27    HG3  GLN   4           1HG      GLN   4  -3.455   4.098   2.782
   28   HE21  GLN   4          1HE2      GLN   4  -3.750   1.351   1.969
   29   HE22  GLN   4          2HE2      GLN   4  -3.822   0.430   3.460
   30    H    GLU   5           H        GLU   5  -4.505   7.130   4.195
   31    HA   GLU   5           HA       GLU   5  -2.943   8.643   2.411
   32    HB2  GLU   5           2HB      GLU   5  -2.879   8.271   5.365
   33    HB3  GLU   5           1HB      GLU   5  -1.783   9.391   4.528
   34    HG2  GLU   5           2HG      GLU   5  -3.854  10.509   3.650
   35    HG3  GLU   5           1HG      GLU   5  -4.774   9.464   4.716
   36    H    LYS   6           H        LYS   6  -0.489   8.811   3.008
   37    HA   LYS   6           HA       LYS   6   0.416   6.372   1.933
   38    HB2  LYS   6           2HB      LYS   6   2.476   7.386   1.403
   39    HB3  LYS   6           1HB      LYS   6   1.228   8.587   1.182
   40    HG2  LYS   6           2HG      LYS   6   1.949   9.242   3.594
   41    HG3  LYS   6           1HG      LYS   6   3.457   8.506   3.104
   42    HD2  LYS   6           2HD      LYS   6   3.201   9.938   0.913
   43    HD3  LYS   6           1HD      LYS   6   1.978  10.767   1.915
   44    HE2  LYS   6           2HE      LYS   6   3.569  11.374   3.477
   45    HE3  LYS   6           1HE      LYS   6   4.846  10.516   2.597
   46    HZ1  LYS   6           3HZ      LYS   6   4.861  12.904   2.145
   47    HZ2  LYS   6           1HZ      LYS   6   3.286  12.832   1.572
   48    HZ3  LYS   6           2HZ      LYS   6   4.527  12.050   0.746
   49    H    TRP   7           H        TRP   7   0.999   7.939   5.014
   50    HA   TRP   7           HA       TRP   7   2.785   5.834   5.835
   51    HB2  TRP   7           2HB      TRP   7   1.616   8.123   7.421
   52    HB3  TRP   7           1HB      TRP   7   2.932   7.079   7.944
   53    HD1  TRP   7           HD       TRP   7   2.272  10.231   5.957
   54    HE1  TRP   7           1HE      TRP   7   4.418  11.100   4.979
   55    HE3  TRP   7           3HE      TRP   7   5.290   6.193   6.866
   56    HZ2  TRP   7           2HZ      TRP   7   7.062  10.254   4.617
   57    HZ3  TRP   7           3HZ      TRP   7   7.639   6.340   6.122
   58    HH2  TRP   7           HH       TRP   7   8.494   8.322   5.039
   59    H    GLU   8           H        GLU   8  -0.039   5.256   5.191
   60    HA   GLU   8           HA       GLU   8  -1.164   4.360   7.701
   61    HB2  GLU   8           2HB      GLU   8  -2.129   4.248   4.867
   62    HB3  GLU   8           1HB      GLU   8  -2.954   3.419   6.178
   63    HG2  GLU   8           2HG      GLU   8  -2.465   6.367   5.960
   64    HG3  GLU   8           1HG      GLU   8  -3.992   5.503   5.702
   65    H    TYR   9           H        TYR   9  -2.266   2.001   7.119
   66    HA   TYR   9           HA       TYR   9  -0.142   0.253   7.619
   67    HB2  TYR   9           2HB      TYR   9  -2.930  -0.461   6.739
   68    HB3  TYR   9           1HB      TYR   9  -1.774  -1.516   7.538
   69    HD1  TYR   9           2HD      TYR   9  -0.855  -0.461   9.848
   70    HD2  TYR   9           1HD      TYR   9  -4.592   0.418   8.041
   71    HE1  TYR   9           2HE      TYR   9  -1.729   0.218  12.016
   72    HE2  TYR   9           1HE      TYR   9  -5.489   1.113  10.208
   73    HH   TYR   9           HH       TYR   9  -3.542   1.699  12.879
   74    H    CYS  10           H        CYS  10  -1.538   1.267   4.643
   75    HA   CYS  10           HA       CYS  10  -1.330   0.684   2.464
   76    HB2  CYS  10           2HB      CYS  10   1.031   1.233   2.852
   77    HB3  CYS  10           1HB      CYS  10   1.340  -0.415   3.401
   78    H    ILE  11           H        ILE  11  -2.888  -0.717   2.033
   79    HA   ILE  11           HA       ILE  11  -2.581  -3.441   3.033
   80    HB   ILE  11           HB       ILE  11  -5.071  -2.029   1.997
   81   HG12  ILE  11          2HG1      ILE  11  -4.271  -2.773   4.821
   82   HG13  ILE  11          1HG1      ILE  11  -4.203  -1.150   4.156
   83   HG21  ILE  11          1HG2      ILE  11  -6.290  -3.966   2.921
   84   HG22  ILE  11          2HG2      ILE  11  -4.753  -4.730   3.322
   85   HG23  ILE  11          3HG2      ILE  11  -5.184  -4.456   1.636
   86   HD11  ILE  11          3HD1      ILE  11  -6.690  -2.803   4.536
   87   HD12  ILE  11          1HD1      ILE  11  -6.626  -1.166   3.888
   88   HD13  ILE  11          2HD1      ILE  11  -6.161  -1.470   5.564
   89    H    VAL  12           H        VAL  12  -2.461  -5.145   1.695
   90    HA   VAL  12           HA       VAL  12  -2.734  -4.620  -1.143
   91    HB   VAL  12           HB       VAL  12  -0.716  -6.146  -1.547
   92   HG11  VAL  12          1HG1      VAL  12  -0.628  -3.783  -1.895
   93   HG12  VAL  12          2HG1      VAL  12   0.893  -4.304  -1.161
   94   HG13  VAL  12          3HG1      VAL  12  -0.329  -3.484  -0.186
   95   HG21  VAL  12          3HG2      VAL  12  -0.543  -7.088   0.725
   96   HG22  VAL  12          1HG2      VAL  12  -0.170  -5.486   1.356
   97   HG23  VAL  12          2HG2      VAL  12   0.954  -6.279   0.253
   98    HA   PRO  13           HA       PRO  13  -5.200  -8.409  -0.317
   99    HB2  PRO  13           2HB      PRO  13  -6.904  -7.167  -2.379
  100    HB3  PRO  13           1HB      PRO  13  -7.360  -7.753  -0.778
  101    HG2  PRO  13           2HG      PRO  13  -7.306  -5.142  -1.312
  102    HG3  PRO  13           1HG      PRO  13  -6.775  -5.764   0.262
  103    HD2  PRO  13           2HD      PRO  13  -5.121  -4.939  -2.099
  104    HD3  PRO  13           1HD      PRO  13  -4.890  -4.536  -0.386
  105    H    ILE  14           H        ILE  14  -4.602  -6.672  -3.322
  106    HA   ILE  14           HA       ILE  14  -4.258  -9.210  -4.743
  107    HB   ILE  14           HB       ILE  14  -4.614  -6.416  -5.879
  108   HG12  ILE  14          2HG1      ILE  14  -6.683  -7.163  -4.784
  109   HG13  ILE  14          1HG1      ILE  14  -6.883  -7.105  -6.529
  110   HG21  ILE  14          1HG2      ILE  14  -3.353  -7.892  -7.352
  111   HG22  ILE  14          2HG2      ILE  14  -4.944  -7.538  -8.026
  112   HG23  ILE  14          3HG2      ILE  14  -4.639  -9.096  -7.260
  113   HD11  ILE  14          3HD1      ILE  14  -6.444  -9.580  -4.865
  114   HD12  ILE  14          1HD1      ILE  14  -6.615  -9.546  -6.621
  115   HD13  ILE  14          2HD1      ILE  14  -7.964  -9.062  -5.593
  116    H    LEU  15           H        LEU  15  -2.239  -9.777  -5.136
  117    HA   LEU  15           HA       LEU  15  -0.029  -8.182  -4.405
  118    HB2  LEU  15           2HB      LEU  15  -0.146 -10.717  -6.027
  119    HB3  LEU  15           1HB      LEU  15   1.329  -9.980  -5.441
  120    HG   LEU  15           HG       LEU  15  -0.874 -11.098  -3.705
  121   HD11  LEU  15          1HD1      LEU  15   0.353 -12.828  -4.900
  122   HD12  LEU  15          2HD1      LEU  15   0.744 -12.849  -3.181
  123   HD13  LEU  15          3HD1      LEU  15   1.878 -12.147  -4.334
  124   HD21  LEU  15          3HD2      LEU  15   1.835  -9.957  -2.996
  125   HD22  LEU  15          1HD2      LEU  15   0.747 -10.778  -1.875
  126   HD23  LEU  15          2HD2      LEU  15   0.265  -9.251  -2.604
  127    H    GLY  16           H        GLY  16   1.071  -6.782  -5.480
  128    HA2  GLY  16           2HA      GLY  16   2.278  -6.136  -7.451
  129    HA3  GLY  16           1HA      GLY  16   0.935  -6.751  -8.413
  130    H    PHE  17           H        PHE  17  -0.605  -5.392  -5.990
  131    HA   PHE  17           HA       PHE  17  -0.477  -2.668  -7.048
  132    HB2  PHE  17           2HB      PHE  17  -2.953  -4.213  -6.239
  133    HB3  PHE  17           1HB      PHE  17  -2.922  -2.490  -6.572
  134    HD1  PHE  17           1HD      PHE  17  -2.377  -1.721  -8.895
  135    HD2  PHE  17           2HD      PHE  17  -3.163  -5.788  -7.946
  136    HE1  PHE  17           1HE      PHE  17  -2.848  -2.176 -11.256
  137    HE2  PHE  17           2HE      PHE  17  -3.631  -6.255 -10.313
  138    HZ   PHE  17           HZ       PHE  17  -3.476  -4.449 -11.972
  139    H    VAL  18           H        VAL  18  -0.274  -1.157  -5.491
  140    HA   VAL  18           HA       VAL  18  -0.641  -2.107  -2.759
  141    HB   VAL  18           HB       VAL  18   0.856  -0.369  -1.975
  142   HG11  VAL  18          1HG1      VAL  18   1.937  -2.397  -2.545
  143   HG12  VAL  18          2HG1      VAL  18   2.980  -1.092  -3.145
  144   HG13  VAL  18          3HG1      VAL  18   1.947  -1.979  -4.250
  145   HG21  VAL  18          3HG2      VAL  18   0.347   1.400  -3.600
  146   HG22  VAL  18          1HG2      VAL  18   1.167   0.483  -4.862
  147   HG23  VAL  18          2HG2      VAL  18   2.084   1.123  -3.498
  148    H    TYR  19           H        TYR  19  -2.131  -1.194  -1.463
  149    HA   TYR  19           HA       TYR  19  -3.727   0.772  -2.857
  150    HB2  TYR  19           2HB      TYR  19  -4.553  -1.237  -0.772
  151    HB3  TYR  19           1HB      TYR  19  -5.612   0.027  -1.395
  152    HD1  TYR  19           2HD      TYR  19  -3.663  -2.966  -2.376
  153    HD2  TYR  19           1HD      TYR  19  -6.733  -0.245  -3.465
  154    HE1  TYR  19           2HE      TYR  19  -4.266  -4.418  -4.262
  155    HE2  TYR  19           1HE      TYR  19  -7.346  -1.676  -5.346
  156    HH   TYR  19           HH       TYR  19  -6.262  -3.413  -6.762
  157    H    CYS  20           H        CYS  20  -3.260   2.604  -2.378
  158    HA   CYS  20           HA       CYS  20  -3.947   3.765   0.048
  159    HB2  CYS  20           2HB      CYS  20  -1.738   4.949   0.368
  160    HB3  CYS  20           1HB      CYS  20  -1.617   3.232   0.707
  161    H    CYS  21           H        CYS  21  -3.618   6.198  -0.432
  162    HA   CYS  21           HA       CYS  21  -4.955   6.764  -2.788
  163    HB2  CYS  21           2HB      CYS  21  -3.297   8.553  -1.032
  164    HB3  CYS  21           1HB      CYS  21  -4.296   9.139  -2.384
  165    HA   PRO  22           HA       PRO  22  -2.156   6.609  -6.088
  166    HB2  PRO  22           2HB      PRO  22  -3.045   8.660  -7.675
  167    HB3  PRO  22           1HB      PRO  22  -3.827   7.082  -7.563
  168    HG2  PRO  22           2HG      PRO  22  -4.541   9.650  -6.231
  169    HG3  PRO  22           1HG      PRO  22  -5.590   8.394  -6.917
  170    HD2  PRO  22           2HD      PRO  22  -5.143   8.650  -4.253
  171    HD3  PRO  22           1HD      PRO  22  -5.474   7.088  -5.009
  172    H    GLY  23           H        GLY  23  -0.304   7.445  -6.861
  173    HA2  GLY  23           2HA      GLY  23   1.285   9.162  -7.271
  174    HA3  GLY  23           1HA      GLY  23   0.493  10.140  -6.036
  175    H    LEU  24           H        LEU  24   0.415   7.435  -4.540
  176    HA   LEU  24           HA       LEU  24   2.969   7.916  -3.188
  177    HB2  LEU  24           2HB      LEU  24   0.753   6.184  -2.134
  178    HB3  LEU  24           1HB      LEU  24   2.045   6.977  -1.313
  179    HG   LEU  24           HG       LEU  24  -0.127   8.574  -2.609
  180   HD11  LEU  24          1HD1      LEU  24  -1.203   7.219  -1.045
  181   HD12  LEU  24          2HD1      LEU  24  -0.983   8.796  -0.258
  182   HD13  LEU  24          3HD1      LEU  24   0.092   7.427   0.115
  183   HD21  LEU  24          3HD2      LEU  24   1.995   9.223  -0.548
  184   HD22  LEU  24          1HD2      LEU  24   0.689  10.307  -1.036
  185   HD23  LEU  24          2HD2      LEU  24   1.894   9.801  -2.210
  186    H    ILE  25           H        ILE  25   4.177   6.142  -2.583
  187    HA   ILE  25           HA       ILE  25   3.693   3.687  -4.122
  188    HB   ILE  25           HB       ILE  25   6.177   3.434  -4.371
  189   HG12  ILE  25          2HG1      ILE  25   6.238   6.316  -3.428
  190   HG13  ILE  25          1HG1      ILE  25   6.883   4.934  -2.557
  191   HG21  ILE  25          1HG2      ILE  25   4.865   4.203  -6.250
  192   HG22  ILE  25          2HG2      ILE  25   6.429   5.020  -6.235
  193   HG23  ILE  25          3HG2      ILE  25   4.985   5.869  -5.685
  194   HD11  ILE  25          3HD1      ILE  25   8.521   4.597  -4.349
  195   HD12  ILE  25          1HD1      ILE  25   8.655   6.196  -3.612
  196   HD13  ILE  25          2HD1      ILE  25   7.878   6.010  -5.184
  197    H    CYS  26           H        CYS  26   4.256   1.786  -3.047
  198    HA   CYS  26           HA       CYS  26   4.619   2.186  -0.155
  199    HB2  CYS  26           2HB      CYS  26   2.547   0.965  -1.137
  200    HB3  CYS  26           1HB      CYS  26   3.678  -0.336  -1.482
  201    H    GLY  27           H        GLY  27   6.628   2.126   0.320
  202    HA2  GLY  27           2HA      GLY  27   8.431   0.461  -1.230
  203    HA3  GLY  27           1HA      GLY  27   8.903   1.684  -0.059
  204    HA   PRO  28           HA       PRO  28   9.887  -1.455   2.798
  205    HB2  PRO  28           2HB      PRO  28   9.154  -0.223   5.170
  206    HB3  PRO  28           1HB      PRO  28  10.683   0.038   4.337
  207    HG2  PRO  28           2HG      PRO  28   8.216   1.709   4.335
  208    HG3  PRO  28           1HG      PRO  28   9.912   2.211   4.275
  209    HD2  PRO  28           2HD      PRO  28   8.284   2.217   2.112
  210    HD3  PRO  28           1HD      PRO  28  10.029   1.928   1.992
  211    H    PHE  29           H        PHE  29   7.101  -0.000   4.404
  212    HA   PHE  29           HA       PHE  29   5.578  -2.440   3.889
  213    HB2  PHE  29           2HB      PHE  29   6.666  -2.544   6.160
  214    HB3  PHE  29           1HB      PHE  29   5.774  -1.092   6.589
  215    HD1  PHE  29           1HD      PHE  29   5.521  -4.662   5.850
  216    HD2  PHE  29           2HD      PHE  29   3.428  -1.185   7.100
  217    HE1  PHE  29           1HE      PHE  29   3.629  -6.071   6.576
  218    HE2  PHE  29           2HE      PHE  29   1.534  -2.575   7.827
  219    HZ   PHE  29           HZ       PHE  29   1.632  -5.024   7.566
  220    H    VAL  30           H        VAL  30   5.791   0.987   4.423
  221    HA   VAL  30           HA       VAL  30   2.911   1.227   4.017
  222    HB   VAL  30           HB       VAL  30   2.984   3.348   5.171
  223   HG11  VAL  30          1HG1      VAL  30   3.606   2.643   7.430
  224   HG12  VAL  30          2HG1      VAL  30   4.400   1.219   6.750
  225   HG13  VAL  30          3HG1      VAL  30   2.658   1.430   6.573
  226   HG21  VAL  30          3HG2      VAL  30   5.156   4.183   4.532
  227   HG22  VAL  30          1HG2      VAL  30   5.954   2.896   5.438
  228   HG23  VAL  30          2HG2      VAL  30   5.056   4.143   6.294
  229    H    CYS  31           H        CYS  31   2.430   3.448   3.029
  230    HA   CYS  31           HA       CYS  31   3.988   3.727   0.594
  231    HB2  CYS  31           2HB      CYS  31   1.338   4.817   1.501
  232    HB3  CYS  31           1HB      CYS  31   2.090   5.269  -0.038
  233    H    VAL  32           H        VAL  32   4.459   5.855  -0.136
  234    HA   VAL  32           HA       VAL  32   4.720   7.958   1.694
  235    HB   VAL  32           HB       VAL  32   6.597   6.654   2.522
  236   HG11  VAL  32          1HG1      VAL  32   7.640   6.663  -0.317
  237   HG12  VAL  32          2HG1      VAL  32   7.042   5.262   0.571
  238   HG13  VAL  32          3HG1      VAL  32   8.524   6.067   1.089
  239   HG21  VAL  32          3HG2      VAL  32   6.898   9.053   2.489
  240   HG22  VAL  32          1HG2      VAL  32   7.557   8.979   0.851
  241   HG23  VAL  32          2HG2      VAL  32   8.434   8.246   2.202
  Start of MODEL   18
    1    H1   ARG   1           H        ARG   1 -11.179  10.059  -4.169
    2    HA   ARG   1           HA       ARG   1 -12.295   7.685  -5.157
    3    HB2  ARG   1           2HB      ARG   1  -9.296   7.931  -5.231
    4    HB3  ARG   1           1HB      ARG   1 -10.160   6.408  -5.197
    5    HG2  ARG   1           2HG      ARG   1 -11.233   7.058  -7.353
    6    HG3  ARG   1           1HG      ARG   1 -10.175   8.471  -7.385
    7    HD2  ARG   1           2HD      ARG   1  -9.269   6.585  -8.693
    8    HD3  ARG   1           1HD      ARG   1  -8.216   7.057  -7.358
    9    HE   ARG   1           HE       ARG   1 -10.015   4.993  -6.589
   10   HH11  ARG   1          1HH1      ARG   1  -7.076   5.442  -8.507
   11   HH12  ARG   1          2HH1      ARG   1  -6.394   3.948  -8.079
   12   HH21  ARG   1          1HH2      ARG   1  -9.098   2.887  -6.027
   13   HH22  ARG   1          2HH2      ARG   1  -7.585   2.462  -6.677
   14    H    ASP   2           H        ASP   2 -11.920   5.959  -3.765
   15    HA   ASP   2           HA       ASP   2 -11.641   6.902  -1.047
   16    HB2  ASP   2           2HB      ASP   2 -12.727   4.345  -2.233
   17    HB3  ASP   2           1HB      ASP   2 -12.485   4.589  -0.509
   18    H    CYS   3           H        CYS   3  -9.651   6.907  -0.350
   19    HA   CYS   3           HA       CYS   3  -8.019   4.541  -0.673
   20    HB2  CYS   3           2HB      CYS   3  -6.126   5.855  -1.547
   21    HB3  CYS   3           1HB      CYS   3  -7.474   5.772  -2.675
   22    H    GLN   4           H        GLN   4  -5.870   4.937   0.436
   23    HA   GLN   4           HA       GLN   4  -6.382   6.356   2.967
   24    HB2  GLN   4           2HB      GLN   4  -5.177   4.600   4.093
   25    HB3  GLN   4           1HB      GLN   4  -6.253   3.820   2.959
   26    HG2  GLN   4           2HG      GLN   4  -4.633   3.392   1.428
   27    HG3  GLN   4           1HG      GLN   4  -3.412   4.257   2.370
   28   HE21  GLN   4          1HE2      GLN   4  -2.254   2.499   2.514
   29   HE22  GLN   4          2HE2      GLN   4  -2.628   1.136   3.542
   30    H    GLU   5           H        GLU   5  -4.514   7.061   4.047
   31    HA   GLU   5           HA       GLU   5  -2.895   8.683   2.428
   32    HB2  GLU   5           2HB      GLU   5  -2.949   8.031   5.333
   33    HB3  GLU   5           1HB      GLU   5  -1.795   9.176   4.640
   34    HG2  GLU   5           2HG      GLU   5  -4.638   9.315   4.114
   35    HG3  GLU   5           1HG      GLU   5  -4.044  10.065   5.612
   36    H    LYS   6           H        LYS   6  -0.580   8.785   3.208
   37    HA   LYS   6           HA       LYS   6   0.603   6.475   1.968
   38    HB2  LYS   6           2HB      LYS   6   2.771   7.725   2.047
   39    HB3  LYS   6           1HB      LYS   6   1.469   8.583   1.233
   40    HG2  LYS   6           2HG      LYS   6   0.996   9.620   3.324
   41    HG3  LYS   6           1HG      LYS   6   2.541   9.091   3.985
   42    HD2  LYS   6           2HD      LYS   6   2.147  10.842   1.533
   43    HD3  LYS   6           1HD      LYS   6   2.529  11.462   3.135
   44    HE2  LYS   6           2HE      LYS   6   4.663  10.142   3.019
   45    HE3  LYS   6           1HE      LYS   6   4.233   9.754   1.348
   46    HZ1  LYS   6           3HZ      LYS   6   4.626  12.504   2.396
   47    HZ2  LYS   6           1HZ      LYS   6   4.256  12.100   0.807
   48    HZ3  LYS   6           2HZ      LYS   6   5.732  11.662   1.449
   49    H    TRP   7           H        TRP   7   0.954   7.925   5.184
   50    HA   TRP   7           HA       TRP   7   2.836   5.854   5.899
   51    HB2  TRP   7           2HB      TRP   7   1.727   8.137   7.537
   52    HB3  TRP   7           1HB      TRP   7   2.978   7.024   8.080
   53    HD1  TRP   7           HD       TRP   7   2.551  10.255   6.331
   54    HE1  TRP   7           1HE      TRP   7   4.789  11.028   5.300
   55    HE3  TRP   7           3HE      TRP   7   5.215   5.918   6.775
   56    HZ2  TRP   7           2HZ      TRP   7   7.322   9.953   4.752
   57    HZ3  TRP   7           3HZ      TRP   7   7.543   5.879   5.959
   58    HH2  TRP   7           HH       TRP   7   8.562   7.857   4.974
   59    H    GLU   8           H        GLU   8   0.109   5.156   5.302
   60    HA   GLU   8           HA       GLU   8  -1.005   4.161   7.773
   61    HB2  GLU   8           2HB      GLU   8  -1.785   3.804   4.892
   62    HB3  GLU   8           1HB      GLU   8  -2.635   3.041   6.222
   63    HG2  GLU   8           2HG      GLU   8  -2.373   5.980   5.664
   64    HG3  GLU   8           1HG      GLU   8  -3.815   4.952   5.592
   65    H    TYR   9           H        TYR   9  -1.631   1.759   7.669
   66    HA   TYR   9           HA       TYR   9   0.791   0.356   7.939
   67    HB2  TYR   9           2HB      TYR   9  -1.992  -0.817   7.770
   68    HB3  TYR   9           1HB      TYR   9  -0.558  -1.678   8.306
   69    HD1  TYR   9           1HD      TYR   9   0.733  -0.516  10.321
   70    HD2  TYR   9           2HD      TYR   9  -3.361   0.132   9.361
   71    HE1  TYR   9           1HE      TYR   9   0.318   0.226  12.615
   72    HE2  TYR   9           2HE      TYR   9  -3.789   0.887  11.639
   73    HH   TYR   9           HH       TYR   9  -1.341   1.685  13.803
   74    H    CYS  10           H        CYS  10  -1.320   0.628   5.255
   75    HA   CYS  10           HA       CYS  10  -1.249  -0.077   3.077
   76    HB2  CYS  10           2HB      CYS  10   1.026   1.048   3.220
   77    HB3  CYS  10           1HB      CYS  10   1.722  -0.539   3.551
   78    H    ILE  11           H        ILE  11  -2.098  -1.939   4.850
   79    HA   ILE  11           HA       ILE  11  -0.794  -4.415   4.054
   80    HB   ILE  11           HB       ILE  11  -2.294  -5.511   5.720
   81   HG12  ILE  11          2HG1      ILE  11  -3.031  -2.672   6.491
   82   HG13  ILE  11          1HG1      ILE  11  -4.108  -3.822   5.705
   83   HG21  ILE  11          1HG2      ILE  11  -0.533  -3.305   6.768
   84   HG22  ILE  11          2HG2      ILE  11  -0.032  -4.940   6.336
   85   HG23  ILE  11          3HG2      ILE  11  -1.103  -4.680   7.713
   86   HD11  ILE  11          3HD1      ILE  11  -2.899  -4.115   8.447
   87   HD12  ILE  11          1HD1      ILE  11  -3.979  -5.272   7.671
   88   HD13  ILE  11          2HD1      ILE  11  -4.564  -3.660   8.086
   89    H    VAL  12           H        VAL  12  -2.214  -6.224   3.377
   90    HA   VAL  12           HA       VAL  12  -4.621  -5.331   2.083
   91    HB   VAL  12           HB       VAL  12  -2.857  -4.799   0.474
   92   HG11  VAL  12          1HG1      VAL  12  -2.121  -7.711   0.560
   93   HG12  VAL  12          2HG1      VAL  12  -1.141  -6.351   1.108
   94   HG13  VAL  12          3HG1      VAL  12  -1.509  -6.537  -0.607
   95   HG21  VAL  12          3HG2      VAL  12  -3.703  -6.003  -1.464
   96   HG22  VAL  12          1HG2      VAL  12  -5.015  -5.490  -0.406
   97   HG23  VAL  12          2HG2      VAL  12  -4.483  -7.170  -0.399
   98    HA   PRO  13           HA       PRO  13  -5.949  -9.377   3.446
   99    HB2  PRO  13           2HB      PRO  13  -7.828  -9.151   1.149
  100    HB3  PRO  13           1HB      PRO  13  -8.173  -9.487   2.848
  101    HG2  PRO  13           2HG      PRO  13  -8.710  -7.099   1.817
  102    HG3  PRO  13           1HG      PRO  13  -8.044  -7.248   3.453
  103    HD2  PRO  13           2HD      PRO  13  -6.680  -6.451   0.916
  104    HD3  PRO  13           1HD      PRO  13  -6.474  -5.826   2.567
  105    H    ILE  14           H        ILE  14  -5.821  -8.874  -0.085
  106    HA   ILE  14           HA       ILE  14  -4.699 -11.578  -0.361
  107    HB   ILE  14           HB       ILE  14  -6.432 -10.044  -2.333
  108   HG12  ILE  14          2HG1      ILE  14  -7.052 -12.556  -0.752
  109   HG13  ILE  14          1HG1      ILE  14  -7.680 -10.956  -0.389
  110   HG21  ILE  14          1HG2      ILE  14  -6.379 -12.073  -3.693
  111   HG22  ILE  14          2HG2      ILE  14  -5.266 -12.816  -2.547
  112   HG23  ILE  14          3HG2      ILE  14  -4.761 -11.404  -3.473
  113   HD11  ILE  14          3HD1      ILE  14  -8.844 -10.951  -2.554
  114   HD12  ILE  14          1HD1      ILE  14  -9.339 -12.298  -1.528
  115   HD13  ILE  14          2HD1      ILE  14  -8.227 -12.575  -2.865
  116    H    LEU  15           H        LEU  15  -2.742 -11.668  -1.326
  117    HA   LEU  15           HA       LEU  15  -1.350  -9.236  -1.835
  118    HB2  LEU  15           2HB      LEU  15  -0.512 -12.105  -2.293
  119    HB3  LEU  15           1HB      LEU  15   0.527 -10.737  -2.608
  120    HG   LEU  15           HG       LEU  15   1.207 -11.674  -0.564
  121   HD11  LEU  15          1HD1      LEU  15   0.905  -9.890   1.045
  122   HD12  LEU  15          2HD1      LEU  15  -0.401  -9.226   0.070
  123   HD13  LEU  15          3HD1      LEU  15   1.240  -9.279  -0.575
  124   HD21  LEU  15          3HD2      LEU  15  -1.651 -11.521   0.395
  125   HD22  LEU  15          1HD2      LEU  15  -0.264 -11.994   1.376
  126   HD23  LEU  15          2HD2      LEU  15  -0.753 -12.990   0.006
  127    H    GLY  16           H        GLY  16  -0.329  -8.598  -3.796
  128    HA2  GLY  16           2HA      GLY  16  -0.186  -8.613  -6.167
  129    HA3  GLY  16           1HA      GLY  16  -1.664  -9.578  -6.211
  130    H    PHE  17           H        PHE  17  -2.291  -7.520  -3.920
  131    HA   PHE  17           HA       PHE  17  -3.289  -5.370  -5.642
  132    HB2  PHE  17           2HB      PHE  17  -4.699  -6.608  -3.244
  133    HB3  PHE  17           1HB      PHE  17  -5.315  -5.304  -4.246
  134    HD1  PHE  17           2HD      PHE  17  -4.620  -8.914  -4.085
  135    HD2  PHE  17           1HD      PHE  17  -6.372  -5.776  -6.354
  136    HE1  PHE  17           2HE      PHE  17  -5.732 -10.573  -5.508
  137    HE2  PHE  17           1HE      PHE  17  -7.492  -7.451  -7.783
  138    HZ   PHE  17           HZ       PHE  17  -7.171  -9.839  -7.360
  139    H    VAL  18           H        VAL  18  -3.144  -3.302  -4.631
  140    HA   VAL  18           HA       VAL  18  -2.637  -3.042  -1.871
  141    HB   VAL  18           HB       VAL  18  -0.307  -3.550  -2.577
  142   HG11  VAL  18          1HG1      VAL  18  -0.366  -2.837  -4.868
  143   HG12  VAL  18          2HG1      VAL  18   0.962  -2.042  -4.020
  144   HG13  VAL  18          3HG1      VAL  18  -0.522  -1.152  -4.374
  145   HG21  VAL  18          3HG2      VAL  18  -0.695  -0.665  -1.813
  146   HG22  VAL  18          1HG2      VAL  18   0.811  -1.566  -1.653
  147   HG23  VAL  18          2HG2      VAL  18  -0.604  -2.040  -0.714
  148    H    TYR  19           H        TYR  19  -3.445  -1.123  -1.195
  149    HA   TYR  19           HA       TYR  19  -4.036   0.814  -3.295
  150    HB2  TYR  19           2HB      TYR  19  -6.004  -0.276  -1.298
  151    HB3  TYR  19           1HB      TYR  19  -6.275   1.158  -2.270
  152    HD1  TYR  19           1HD      TYR  19  -6.673   0.962  -4.677
  153    HD2  TYR  19           2HD      TYR  19  -6.155  -2.488  -2.250
  154    HE1  TYR  19           1HE      TYR  19  -7.653  -0.420  -6.446
  155    HE2  TYR  19           2HE      TYR  19  -7.125  -3.885  -4.008
  156    HH   TYR  19           HH       TYR  19  -8.604  -3.653  -5.908
  157    H    CYS  20           H        CYS  20  -3.168   2.612  -2.775
  158    HA   CYS  20           HA       CYS  20  -3.821   3.855  -0.225
  159    HB2  CYS  20           2HB      CYS  20  -1.117   3.975  -1.647
  160    HB3  CYS  20           1HB      CYS  20  -1.611   5.114  -0.408
  161    H    CYS  21           H        CYS  21  -3.461   6.351  -0.681
  162    HA   CYS  21           HA       CYS  21  -4.952   6.971  -2.941
  163    HB2  CYS  21           2HB      CYS  21  -3.262   8.688  -1.144
  164    HB3  CYS  21           1HB      CYS  21  -4.229   9.344  -2.477
  165    HA   PRO  22           HA       PRO  22  -2.302   6.789  -6.318
  166    HB2  PRO  22           2HB      PRO  22  -3.231   8.847  -7.856
  167    HB3  PRO  22           1HB      PRO  22  -4.044   7.289  -7.696
  168    HG2  PRO  22           2HG      PRO  22  -4.646   9.882  -6.342
  169    HG3  PRO  22           1HG      PRO  22  -5.759   8.647  -6.952
  170    HD2  PRO  22           2HD      PRO  22  -5.117   8.911  -4.316
  171    HD3  PRO  22           1HD      PRO  22  -5.560   7.358  -5.054
  172    H    GLY  23           H        GLY  23  -0.306   7.353  -6.701
  173    HA2  GLY  23           2HA      GLY  23   1.294   9.074  -7.300
  174    HA3  GLY  23           1HA      GLY  23   0.518  10.117  -6.110
  175    H    LEU  24           H        LEU  24   0.335   7.438  -4.528
  176    HA   LEU  24           HA       LEU  24   2.883   7.892  -3.151
  177    HB2  LEU  24           2HB      LEU  24   0.645   6.162  -2.103
  178    HB3  LEU  24           1HB      LEU  24   1.937   6.928  -1.275
  179    HG   LEU  24           HG       LEU  24  -0.229   8.552  -2.564
  180   HD11  LEU  24          1HD1      LEU  24  -1.061   8.857  -0.257
  181   HD12  LEU  24          2HD1      LEU  24   0.018   7.526   0.233
  182   HD13  LEU  24          3HD1      LEU  24  -1.275   7.250  -0.938
  183   HD21  LEU  24          3HD2      LEU  24   1.969   9.204  -0.603
  184   HD22  LEU  24          1HD2      LEU  24   0.646  10.302  -1.027
  185   HD23  LEU  24          2HD2      LEU  24   1.792   9.784  -2.258
  186    H    ILE  25           H        ILE  25   4.049   6.095  -2.446
  187    HA   ILE  25           HA       ILE  25   3.658   3.634  -4.022
  188    HB   ILE  25           HB       ILE  25   6.151   3.372  -4.049
  189   HG12  ILE  25          2HG1      ILE  25   6.203   6.273  -3.170
  190   HG13  ILE  25          1HG1      ILE  25   6.648   4.905  -2.159
  191   HG21  ILE  25          1HG2      ILE  25   5.118   5.818  -5.459
  192   HG22  ILE  25          2HG2      ILE  25   5.019   4.153  -6.032
  193   HG23  ILE  25          3HG2      ILE  25   6.590   4.941  -5.874
  194   HD11  ILE  25          3HD1      ILE  25   8.495   4.397  -3.672
  195   HD12  ILE  25          1HD1      ILE  25   8.604   6.039  -3.038
  196   HD13  ILE  25          2HD1      ILE  25   8.037   5.764  -4.687
  197    H    CYS  26           H        CYS  26   3.851   1.761  -2.887
  198    HA   CYS  26           HA       CYS  26   4.222   2.061  -0.016
  199    HB2  CYS  26           2HB      CYS  26   2.321   0.746  -1.046
  200    HB3  CYS  26           1HB      CYS  26   3.508  -0.477  -1.509
  201    H    GLY  27           H        GLY  27   6.208   2.301   0.417
  202    HA2  GLY  27           2HA      GLY  27   8.269   1.054  -1.152
  203    HA3  GLY  27           1HA      GLY  27   8.511   2.175   0.175
  204    HA   PRO  28           HA       PRO  28   9.776  -1.294   2.481
  205    HB2  PRO  28           2HB      PRO  28   9.089  -0.254   5.055
  206    HB3  PRO  28           1HB      PRO  28  10.657  -0.198   4.263
  207    HG2  PRO  28           2HG      PRO  28   9.017   2.018   4.769
  208    HG3  PRO  28           1HG      PRO  28  10.397   1.972   3.669
  209    HD2  PRO  28           2HD      PRO  28   7.491   1.869   3.059
  210    HD3  PRO  28           1HD      PRO  28   8.824   2.491   2.087
  211    H    PHE  29           H        PHE  29   7.219  -0.231   4.675
  212    HA   PHE  29           HA       PHE  29   5.659  -2.586   3.878
  213    HB2  PHE  29           2HB      PHE  29   5.960  -1.490   6.684
  214    HB3  PHE  29           1HB      PHE  29   4.993  -2.878   6.214
  215    HD1  PHE  29           2HD      PHE  29   6.234  -4.882   5.205
  216    HD2  PHE  29           1HD      PHE  29   8.176  -1.756   7.330
  217    HE1  PHE  29           2HE      PHE  29   8.168  -6.352   5.595
  218    HE2  PHE  29           1HE      PHE  29  10.112  -3.209   7.716
  219    HZ   PHE  29           HZ       PHE  29  10.111  -5.516   6.850
  220    H    VAL  30           H        VAL  30   5.853   0.697   4.037
  221    HA   VAL  30           HA       VAL  30   2.956   1.042   4.198
  222    HB   VAL  30           HB       VAL  30   3.258   3.173   5.367
  223   HG11  VAL  30          1HG1      VAL  30   4.600   0.894   6.808
  224   HG12  VAL  30          2HG1      VAL  30   2.870   1.232   6.738
  225   HG13  VAL  30          3HG1      VAL  30   3.951   2.350   7.569
  226   HG21  VAL  30          3HG2      VAL  30   6.192   2.465   5.416
  227   HG22  VAL  30          1HG2      VAL  30   5.463   3.775   6.350
  228   HG23  VAL  30          2HG2      VAL  30   5.445   3.827   4.588
  229    H    CYS  31           H        CYS  31   2.354   3.213   3.247
  230    HA   CYS  31           HA       CYS  31   3.775   3.662   0.735
  231    HB2  CYS  31           2HB      CYS  31   1.114   4.586   1.821
  232    HB3  CYS  31           1HB      CYS  31   1.809   5.192   0.301
  233    H    VAL  32           H        VAL  32   3.917   5.931   0.068
  234    HA   VAL  32           HA       VAL  32   4.646   7.933   1.794
  235    HB   VAL  32           HB       VAL  32   6.431   6.474   2.600
  236   HG11  VAL  32          1HG1      VAL  32   8.236   5.658   1.116
  237   HG12  VAL  32          2HG1      VAL  32   7.365   6.297  -0.277
  238   HG13  VAL  32          3HG1      VAL  32   6.668   4.982   0.669
  239   HG21  VAL  32          3HG2      VAL  32   8.382   7.876   2.164
  240   HG22  VAL  32          1HG2      VAL  32   6.936   8.844   2.437
  241   HG23  VAL  32          2HG2      VAL  32   7.552   8.617   0.796
  Start of MODEL   19
    1    H1   ARG   1           H        ARG   1 -13.189   2.891  -3.331
    2    HA   ARG   1           HA       ARG   1 -14.144   2.467  -0.725
    3    HB2  ARG   1           2HB      ARG   1 -11.254   1.743  -1.204
    4    HB3  ARG   1           1HB      ARG   1 -12.040   1.855   0.355
    5    HG2  ARG   1           2HG      ARG   1 -13.488  -0.035  -0.248
    6    HG3  ARG   1           1HG      ARG   1 -12.658  -0.151  -1.802
    7    HD2  ARG   1           2HD      ARG   1 -11.729  -1.778  -0.282
    8    HD3  ARG   1           1HD      ARG   1 -10.533  -0.523  -0.602
    9    HE   ARG   1           HE       ARG   1 -12.135  -0.051   1.730
   10   HH11  ARG   1          1HH1      ARG   1  -9.128  -1.550   0.547
   11   HH12  ARG   1          2HH1      ARG   1  -8.425  -1.595   2.092
   12   HH21  ARG   1          1HH2      ARG   1 -11.140  -0.182   3.823
   13   HH22  ARG   1          2HH2      ARG   1  -9.569  -0.821   3.961
   14    H    ASP   2           H        ASP   2 -12.491   3.784   0.768
   15    HA   ASP   2           HA       ASP   2 -11.800   6.210  -0.654
   16    HB2  ASP   2           2HB      ASP   2 -13.293   6.613   1.208
   17    HB3  ASP   2           1HB      ASP   2 -12.275   5.658   2.281
   18    H    CYS   3           H        CYS   3  -9.801   6.555  -1.019
   19    HA   CYS   3           HA       CYS   3  -7.850   4.606  -0.418
   20    HB2  CYS   3           2HB      CYS   3  -6.254   5.979  -1.570
   21    HB3  CYS   3           1HB      CYS   3  -7.762   5.948  -2.471
   22    H    GLN   4           H        GLN   4  -5.805   4.939   0.641
   23    HA   GLN   4           HA       GLN   4  -6.231   6.399   3.181
   24    HB2  GLN   4           2HB      GLN   4  -5.093   4.642   4.310
   25    HB3  GLN   4           1HB      GLN   4  -6.121   3.851   3.129
   26    HG2  GLN   4           2HG      GLN   4  -4.234   3.601   1.622
   27    HG3  GLN   4           1HG      GLN   4  -3.161   4.272   2.856
   28   HE21  GLN   4          1HE2      GLN   4  -4.972   1.650   1.802
   29   HE22  GLN   4          2HE2      GLN   4  -4.495   0.520   3.046
   30    H    GLU   5           H        GLU   5  -4.402   7.253   4.176
   31    HA   GLU   5           HA       GLU   5  -2.765   8.697   2.415
   32    HB2  GLU   5           2HB      GLU   5  -2.756   8.309   5.379
   33    HB3  GLU   5           1HB      GLU   5  -1.593   9.381   4.578
   34    HG2  GLU   5           2HG      GLU   5  -3.534  10.660   3.692
   35    HG3  GLU   5           1HG      GLU   5  -4.597   9.618   4.632
   36    H    LYS   6           H        LYS   6  -0.308   8.743   3.116
   37    HA   LYS   6           HA       LYS   6   0.646   6.377   1.891
   38    HB2  LYS   6           2HB      LYS   6   2.881   7.512   2.005
   39    HB3  LYS   6           1HB      LYS   6   1.617   8.451   1.215
   40    HG2  LYS   6           2HG      LYS   6   1.214   9.451   3.426
   41    HG3  LYS   6           1HG      LYS   6   2.768   8.833   3.953
   42    HD2  LYS   6           2HD      LYS   6   2.316  10.712   1.617
   43    HD3  LYS   6           1HD      LYS   6   2.790  11.223   3.233
   44    HE2  LYS   6           2HE      LYS   6   4.844   9.776   2.951
   45    HE3  LYS   6           1HE      LYS   6   4.335   9.576   1.270
   46    HZ1  LYS   6           3HZ      LYS   6   5.952  11.357   1.566
   47    HZ2  LYS   6           1HZ      LYS   6   4.865  12.198   2.534
   48    HZ3  LYS   6           2HZ      LYS   6   4.524  11.918   0.903
   49    H    TRP   7           H        TRP   7   1.226   7.788   5.092
   50    HA   TRP   7           HA       TRP   7   2.874   5.528   5.827
   51    HB2  TRP   7           2HB      TRP   7   2.042   7.938   7.447
   52    HB3  TRP   7           1HB      TRP   7   3.209   6.727   7.957
   53    HD1  TRP   7           HD       TRP   7   3.006   9.991   6.303
   54    HE1  TRP   7           1HE      TRP   7   5.251  10.638   5.224
   55    HE3  TRP   7           3HE      TRP   7   5.356   5.470   6.510
   56    HZ2  TRP   7           2HZ      TRP   7   7.681   9.407   4.554
   57    HZ3  TRP   7           3HZ      TRP   7   7.651   5.301   5.600
   58    HH2  TRP   7           HH       TRP   7   8.768   7.235   4.653
   59    H    GLU   8           H        GLU   8   0.102   4.959   5.289
   60    HA   GLU   8           HA       GLU   8  -1.119   4.561   7.892
   61    HB2  GLU   8           2HB      GLU   8  -2.084   3.870   5.135
   62    HB3  GLU   8           1HB      GLU   8  -2.984   3.548   6.607
   63    HG2  GLU   8           2HG      GLU   8  -2.119   6.245   5.654
   64    HG3  GLU   8           1HG      GLU   8  -3.714   5.498   5.450
   65    H    TYR   9           H        TYR   9  -2.091   2.018   6.038
   66    HA   TYR   9           HA       TYR   9  -0.157   0.284   7.363
   67    HB2  TYR   9           2HB      TYR   9  -3.028  -0.239   6.665
   68    HB3  TYR   9           1HB      TYR   9  -1.904  -1.533   7.074
   69    HD1  TYR   9           1HD      TYR   9  -0.533  -1.068   9.294
   70    HD2  TYR   9           2HD      TYR   9  -4.330   0.618   8.388
   71    HE1  TYR   9           1HE      TYR   9  -0.925  -0.723  11.658
   72    HE2  TYR   9           2HE      TYR   9  -4.741   0.973  10.776
   73    HH   TYR   9           HH       TYR   9  -3.975   0.049  12.921
   74    H    CYS  10           H        CYS  10  -1.805   0.931   4.362
   75    HA   CYS  10           HA       CYS  10  -1.353   0.432   2.241
   76    HB2  CYS  10           2HB      CYS  10   0.959   1.053   2.652
   77    HB3  CYS  10           1HB      CYS  10   1.297  -0.540   3.321
   78    H    ILE  11           H        ILE  11  -2.687  -1.064   1.446
   79    HA   ILE  11           HA       ILE  11  -2.210  -3.809   2.214
   80    HB   ILE  11           HB       ILE  11  -4.393  -3.066   2.970
   81   HG12  ILE  11          2HG1      ILE  11  -4.656  -4.639   0.445
   82   HG13  ILE  11          1HG1      ILE  11  -4.219  -5.309   2.016
   83   HG21  ILE  11          1HG2      ILE  11  -4.675  -1.114   1.528
   84   HG22  ILE  11          2HG2      ILE  11  -6.095  -2.163   1.462
   85   HG23  ILE  11          3HG2      ILE  11  -4.918  -2.193   0.149
   86   HD11  ILE  11          3HD1      ILE  11  -6.436  -4.661   2.879
   87   HD12  ILE  11          1HD1      ILE  11  -6.570  -5.767   1.511
   88   HD13  ILE  11          2HD1      ILE  11  -6.863  -4.041   1.285
   89    H    VAL  12           H        VAL  12  -1.945  -5.300   0.559
   90    HA   VAL  12           HA       VAL  12  -1.901  -4.165  -2.118
   91    HB   VAL  12           HB       VAL  12   0.389  -4.543  -1.388
   92   HG11  VAL  12          1HG1      VAL  12   1.296  -6.731  -0.799
   93   HG12  VAL  12          2HG1      VAL  12  -0.333  -7.401  -0.831
   94   HG13  VAL  12          3HG1      VAL  12   0.087  -6.163   0.353
   95   HG21  VAL  12          3HG2      VAL  12  -0.427  -6.667  -3.361
   96   HG22  VAL  12          1HG2      VAL  12   1.219  -6.086  -3.116
   97   HG23  VAL  12          2HG2      VAL  12  -0.022  -4.992  -3.728
   98    HA   PRO  13           HA       PRO  13  -5.205  -7.306  -2.243
   99    HB2  PRO  13           2HB      PRO  13  -5.963  -5.791  -4.663
  100    HB3  PRO  13           1HB      PRO  13  -6.932  -6.164  -3.239
  101    HG2  PRO  13           2HG      PRO  13  -6.048  -3.678  -3.704
  102    HG3  PRO  13           1HG      PRO  13  -6.144  -4.332  -2.059
  103    HD2  PRO  13           2HD      PRO  13  -3.752  -4.027  -3.837
  104    HD3  PRO  13           1HD      PRO  13  -3.922  -3.700  -2.097
  105    H    ILE  14           H        ILE  14  -3.404  -6.040  -4.956
  106    HA   ILE  14           HA       ILE  14  -3.222  -8.707  -6.159
  107    HB   ILE  14           HB       ILE  14  -3.375  -6.003  -7.545
  108   HG12  ILE  14          2HG1      ILE  14  -5.598  -6.741  -6.843
  109   HG13  ILE  14          1HG1      ILE  14  -5.454  -6.805  -8.593
  110   HG21  ILE  14          1HG2      ILE  14  -3.294  -7.231  -9.664
  111   HG22  ILE  14          2HG2      ILE  14  -3.010  -8.716  -8.756
  112   HG23  ILE  14          3HG2      ILE  14  -1.821  -7.415  -8.707
  113   HD11  ILE  14          3HD1      ILE  14  -6.657  -8.730  -7.774
  114   HD12  ILE  14          1HD1      ILE  14  -5.322  -9.143  -6.697
  115   HD13  ILE  14          2HD1      ILE  14  -5.105  -9.237  -8.442
  116    H    LEU  15           H        LEU  15  -1.086  -9.287  -6.392
  117    HA   LEU  15           HA       LEU  15   0.824  -7.620  -5.178
  118    HB2  LEU  15           2HB      LEU  15   1.167 -10.141  -6.789
  119    HB3  LEU  15           1HB      LEU  15   2.527  -9.282  -6.103
  120    HG   LEU  15           HG       LEU  15   2.045 -11.122  -4.692
  121   HD11  LEU  15          1HD1      LEU  15   0.981  -8.653  -3.363
  122   HD12  LEU  15          2HD1      LEU  15   2.672  -9.120  -3.524
  123   HD13  LEU  15          3HD1      LEU  15   1.578 -10.101  -2.551
  124   HD21  LEU  15          3HD2      LEU  15  -0.241 -11.626  -5.351
  125   HD22  LEU  15          1HD2      LEU  15  -0.816 -10.163  -4.548
  126   HD23  LEU  15          2HD2      LEU  15  -0.137 -11.481  -3.596
  127    H    GLY  16           H        GLY  16   1.924  -6.065  -5.848
  128    HA2  GLY  16           2HA      GLY  16   3.252  -4.874  -7.409
  129    HA3  GLY  16           1HA      GLY  16   2.322  -5.615  -8.712
  130    H    PHE  17           H        PHE  17   0.019  -4.966  -6.590
  131    HA   PHE  17           HA       PHE  17  -0.294  -2.174  -7.356
  132    HB2  PHE  17           2HB      PHE  17  -1.802  -3.483  -8.725
  133    HB3  PHE  17           1HB      PHE  17  -2.367  -4.358  -7.305
  134    HD1  PHE  17           1HD      PHE  17  -2.276  -0.985  -8.841
  135    HD2  PHE  17           2HD      PHE  17  -4.209  -3.593  -6.099
  136    HE1  PHE  17           1HE      PHE  17  -4.080   0.654  -8.564
  137    HE2  PHE  17           2HE      PHE  17  -6.017  -1.959  -5.809
  138    HZ   PHE  17           HZ       PHE  17  -5.960   0.166  -7.043
  139    H    VAL  18           H        VAL  18  -0.214  -1.027  -5.577
  140    HA   VAL  18           HA       VAL  18  -1.166  -2.256  -3.101
  141    HB   VAL  18           HB       VAL  18   0.191  -0.563  -1.894
  142   HG11  VAL  18          1HG1      VAL  18   2.395  -1.525  -2.442
  143   HG12  VAL  18          2HG1      VAL  18   1.714  -2.201  -3.919
  144   HG13  VAL  18          3HG1      VAL  18   1.134  -2.752  -2.348
  145   HG21  VAL  18          3HG2      VAL  18   0.210   1.213  -3.600
  146   HG22  VAL  18          1HG2      VAL  18   1.196   0.198  -4.650
  147   HG23  VAL  18          2HG2      VAL  18   1.856   0.789  -3.128
  148    H    TYR  19           H        TYR  19  -2.669  -1.182  -1.828
  149    HA   TYR  19           HA       TYR  19  -3.997   0.921  -3.324
  150    HB2  TYR  19           2HB      TYR  19  -5.421  -1.028  -2.909
  151    HB3  TYR  19           1HB      TYR  19  -5.177  -0.831  -1.173
  152    HD1  TYR  19           1HD      TYR  19  -6.290   1.156  -4.101
  153    HD2  TYR  19           2HD      TYR  19  -6.820   0.313   0.024
  154    HE1  TYR  19           1HE      TYR  19  -8.164   2.718  -4.040
  155    HE2  TYR  19           2HE      TYR  19  -8.717   1.885   0.101
  156    HH   TYR  19           HH       TYR  19 -10.122   3.140  -2.734
  157    H    CYS  20           H        CYS  20  -3.381   2.757  -2.793
  158    HA   CYS  20           HA       CYS  20  -3.892   3.841  -0.188
  159    HB2  CYS  20           2HB      CYS  20  -1.171   4.069  -1.575
  160    HB3  CYS  20           1HB      CYS  20  -1.694   5.094  -0.251
  161    H    CYS  21           H        CYS  21  -3.543   6.326  -0.599
  162    HA   CYS  21           HA       CYS  21  -5.071   6.989  -2.866
  163    HB2  CYS  21           2HB      CYS  21  -3.326   8.691  -1.103
  164    HB3  CYS  21           1HB      CYS  21  -4.340   9.349  -2.397
  165    HA   PRO  22           HA       PRO  22  -2.414   6.877  -6.284
  166    HB2  PRO  22           2HB      PRO  22  -3.197   9.082  -7.721
  167    HB3  PRO  22           1HB      PRO  22  -4.103   7.566  -7.664
  168    HG2  PRO  22           2HG      PRO  22  -4.540  10.094  -6.134
  169    HG3  PRO  22           1HG      PRO  22  -5.736   9.013  -6.872
  170    HD2  PRO  22           2HD      PRO  22  -5.186   8.984  -4.210
  171    HD3  PRO  22           1HD      PRO  22  -5.647   7.511  -5.090
  172    H    GLY  23           H        GLY  23  -0.424   7.470  -6.804
  173    HA2  GLY  23           2HA      GLY  23   1.280   9.080  -7.250
  174    HA3  GLY  23           1HA      GLY  23   0.522  10.155  -6.079
  175    H    LEU  24           H        LEU  24   0.373   7.237  -4.692
  176    HA   LEU  24           HA       LEU  24   2.870   7.710  -3.216
  177    HB2  LEU  24           2HB      LEU  24   0.584   6.013  -2.204
  178    HB3  LEU  24           1HB      LEU  24   1.900   6.733  -1.360
  179    HG   LEU  24           HG       LEU  24  -0.243   8.423  -2.602
  180   HD11  LEU  24          1HD1      LEU  24   0.039   7.429   0.204
  181   HD12  LEU  24          2HD1      LEU  24  -1.273   7.093  -0.949
  182   HD13  LEU  24          3HD1      LEU  24  -1.059   8.718  -0.307
  183   HD21  LEU  24          3HD2      LEU  24   0.686  10.133  -1.059
  184   HD22  LEU  24          1HD2      LEU  24   1.821   9.603  -2.302
  185   HD23  LEU  24          2HD2      LEU  24   1.987   9.004  -0.663
  186    H    ILE  25           H        ILE  25   3.994   5.855  -2.516
  187    HA   ILE  25           HA       ILE  25   3.494   3.389  -4.017
  188    HB   ILE  25           HB       ILE  25   5.975   3.103  -4.285
  189   HG12  ILE  25          2HG1      ILE  25   6.058   6.060  -3.619
  190   HG13  ILE  25          1HG1      ILE  25   6.722   4.762  -2.636
  191   HG21  ILE  25          1HG2      ILE  25   6.167   4.548  -6.286
  192   HG22  ILE  25          2HG2      ILE  25   4.694   5.382  -5.783
  193   HG23  ILE  25          3HG2      ILE  25   4.639   3.672  -6.199
  194   HD11  ILE  25          3HD1      ILE  25   7.654   5.562  -5.385
  195   HD12  ILE  25          1HD1      ILE  25   8.324   4.252  -4.414
  196   HD13  ILE  25          2HD1      ILE  25   8.464   5.919  -3.858
  197    H    CYS  26           H        CYS  26   4.139   1.520  -2.930
  198    HA   CYS  26           HA       CYS  26   4.439   1.922  -0.036
  199    HB2  CYS  26           2HB      CYS  26   2.595   0.531  -1.158
  200    HB3  CYS  26           1HB      CYS  26   3.874  -0.657  -1.446
  201    H    GLY  27           H        GLY  27   6.459   2.205   0.393
  202    HA2  GLY  27           2HA      GLY  27   8.487   0.711  -1.062
  203    HA3  GLY  27           1HA      GLY  27   8.763   2.048   0.044
  204    HA   PRO  28           HA       PRO  28  10.214  -0.742   3.048
  205    HB2  PRO  28           2HB      PRO  28   9.324   0.401   5.384
  206    HB3  PRO  28           1HB      PRO  28  10.713   0.982   4.461
  207    HG2  PRO  28           2HG      PRO  28   7.900   2.002   4.502
  208    HG3  PRO  28           1HG      PRO  28   9.419   2.915   4.454
  209    HD2  PRO  28           2HD      PRO  28   7.901   2.538   2.256
  210    HD3  PRO  28           1HD      PRO  28   9.671   2.611   2.177
  211    H    PHE  29           H        PHE  29   6.909   0.215   3.778
  212    HA   PHE  29           HA       PHE  29   5.992  -2.467   4.047
  213    HB2  PHE  29           2HB      PHE  29   7.124  -2.252   6.209
  214    HB3  PHE  29           1HB      PHE  29   6.305  -0.730   6.511
  215    HD1  PHE  29           2HD      PHE  29   5.570  -4.300   5.831
  216    HD2  PHE  29           1HD      PHE  29   4.439  -0.727   7.785
  217    HE1  PHE  29           2HE      PHE  29   3.761  -5.525   6.988
  218    HE2  PHE  29           1HE      PHE  29   2.613  -1.921   8.957
  219    HZ   PHE  29           HZ       PHE  29   2.280  -4.327   8.556
  220    H    VAL  30           H        VAL  30   5.671   0.965   4.476
  221    HA   VAL  30           HA       VAL  30   2.847   0.751   3.815
  222    HB   VAL  30           HB       VAL  30   2.531   2.919   4.995
  223   HG11  VAL  30          1HG1      VAL  30   2.705   2.042   7.271
  224   HG12  VAL  30          2HG1      VAL  30   3.754   0.754   6.675
  225   HG13  VAL  30          3HG1      VAL  30   2.070   0.828   6.155
  226   HG21  VAL  30          3HG2      VAL  30   4.282   3.711   6.528
  227   HG22  VAL  30          1HG2      VAL  30   4.799   3.796   4.840
  228   HG23  VAL  30          2HG2      VAL  30   5.385   2.497   5.879
  229    H    CYS  31           H        CYS  31   2.165   3.044   2.938
  230    HA   CYS  31           HA       CYS  31   3.707   3.443   0.561
  231    HB2  CYS  31           2HB      CYS  31   1.095   4.569   1.556
  232    HB3  CYS  31           1HB      CYS  31   1.847   5.020   0.007
  233    H    VAL  32           H        VAL  32   3.819   5.829  -0.115
  234    HA   VAL  32           HA       VAL  32   4.757   7.738   1.596
  235    HB   VAL  32           HB       VAL  32   6.490   6.124   2.275
  236   HG11  VAL  32          1HG1      VAL  32   7.317   6.088  -0.634
  237   HG12  VAL  32          2HG1      VAL  32   6.611   4.744   0.264
  238   HG13  VAL  32          3HG1      VAL  32   8.213   5.344   0.692
  239   HG21  VAL  32          3HG2      VAL  32   7.055   8.475   2.243
  240   HG22  VAL  32          1HG2      VAL  32   7.611   8.348   0.571
  241   HG23  VAL  32          2HG2      VAL  32   8.458   7.485   1.868
  Start of MODEL   20
    1    H1   ARG   1           H        ARG   1 -12.488   8.838  -4.346
    2    HA   ARG   1           HA       ARG   1 -13.630   6.365  -4.434
    3    HB2  ARG   1           2HB      ARG   1 -10.665   6.311  -5.022
    4    HB3  ARG   1           1HB      ARG   1 -11.628   4.916  -4.573
    5    HG2  ARG   1           2HG      ARG   1 -12.930   5.144  -6.617
    6    HG3  ARG   1           1HG      ARG   1 -11.991   6.574  -7.055
    7    HD2  ARG   1           2HD      ARG   1 -11.152   4.626  -8.236
    8    HD3  ARG   1           1HD      ARG   1  -9.956   5.217  -7.086
    9    HE   ARG   1           HE       ARG   1 -11.502   3.215  -5.863
   10   HH11  ARG   1          1HH1      ARG   1  -8.920   3.602  -8.256
   11   HH12  ARG   1          2HH1      ARG   1  -8.398   1.993  -8.166
   12   HH21  ARG   1          1HH2      ARG   1 -10.743   0.979  -5.714
   13   HH22  ARG   1          2HH2      ARG   1  -9.464   0.465  -6.702
   14    H    ASP   2           H        ASP   2 -12.440   4.973  -2.640
   15    HA   ASP   2           HA       ASP   2 -11.731   6.813  -0.473
   16    HB2  ASP   2           2HB      ASP   2 -13.661   5.347  -0.018
   17    HB3  ASP   2           1HB      ASP   2 -12.677   3.935  -0.377
   18    H    CYS   3           H        CYS   3  -9.565   7.039  -0.414
   19    HA   CYS   3           HA       CYS   3  -8.043   4.570  -0.579
   20    HB2  CYS   3           2HB      CYS   3  -6.172   5.854  -1.536
   21    HB3  CYS   3           1HB      CYS   3  -7.588   5.879  -2.578
   22    H    GLN   4           H        GLN   4  -5.826   4.890   0.499
   23    HA   GLN   4           HA       GLN   4  -6.339   6.332   2.998
   24    HB2  GLN   4           2HB      GLN   4  -5.308   4.570   4.215
   25    HB3  GLN   4           1HB      GLN   4  -6.343   3.842   2.995
   26    HG2  GLN   4           2HG      GLN   4  -4.541   3.296   1.612
   27    HG3  GLN   4           1HG      GLN   4  -3.388   4.092   2.692
   28   HE21  GLN   4          1HE2      GLN   4  -3.493   1.380   1.824
   29   HE22  GLN   4          2HE2      GLN   4  -3.659   0.395   3.257
   30    H    GLU   5           H        GLU   5  -4.494   7.049   4.103
   31    HA   GLU   5           HA       GLU   5  -2.900   8.676   2.466
   32    HB2  GLU   5           2HB      GLU   5  -2.918   8.055   5.378
   33    HB3  GLU   5           1HB      GLU   5  -1.798   9.220   4.662
   34    HG2  GLU   5           2HG      GLU   5  -3.614  10.608   4.016
   35    HG3  GLU   5           1HG      GLU   5  -4.790   9.372   4.455
   36    H    LYS   6           H        LYS   6  -0.511   8.864   3.057
   37    HA   LYS   6           HA       LYS   6   0.729   6.597   1.927
   38    HB2  LYS   6           2HB      LYS   6   2.841   7.903   2.176
   39    HB3  LYS   6           1HB      LYS   6   1.558   8.766   1.337
   40    HG2  LYS   6           2HG      LYS   6   0.967   9.735   3.486
   41    HG3  LYS   6           1HG      LYS   6   2.483   9.157   4.165
   42    HD2  LYS   6           2HD      LYS   6   2.173  11.030   1.816
   43    HD3  LYS   6           1HD      LYS   6   2.557  11.553   3.454
   44    HE2  LYS   6           2HE      LYS   6   4.638  10.089   3.242
   45    HE3  LYS   6           1HE      LYS   6   4.215   9.946   1.539
   46    HZ1  LYS   6           3HZ      LYS   6   4.725  12.511   2.935
   47    HZ2  LYS   6           1HZ      LYS   6   4.326  12.331   1.307
   48    HZ3  LYS   6           2HZ      LYS   6   5.791  11.736   1.898
   49    H    TRP   7           H        TRP   7   0.955   7.984   5.184
   50    HA   TRP   7           HA       TRP   7   2.763   5.873   5.947
   51    HB2  TRP   7           2HB      TRP   7   1.650   8.183   7.508
   52    HB3  TRP   7           1HB      TRP   7   2.811   7.021   8.156
   53    HD1  TRP   7           HD       TRP   7   2.683  10.289   6.539
   54    HE1  TRP   7           1HE      TRP   7   4.985  10.952   5.584
   55    HE3  TRP   7           3HE      TRP   7   5.019   5.753   6.760
   56    HZ2  TRP   7           2HZ      TRP   7   7.431   9.736   5.012
   57    HZ3  TRP   7           3HZ      TRP   7   7.356   5.605   5.954
   58    HH2  TRP   7           HH       TRP   7   8.509   7.564   5.104
   59    H    GLU   8           H        GLU   8   0.041   5.222   5.239
   60    HA   GLU   8           HA       GLU   8  -1.140   4.312   7.701
   61    HB2  GLU   8           2HB      GLU   8  -1.963   4.072   4.831
   62    HB3  GLU   8           1HB      GLU   8  -2.828   3.283   6.138
   63    HG2  GLU   8           2HG      GLU   8  -2.392   6.217   5.764
   64    HG3  GLU   8           1HG      GLU   8  -3.914   5.340   5.569
   65    H    TYR   9           H        TYR   9  -1.969   1.933   7.456
   66    HA   TYR   9           HA       TYR   9   0.305   0.382   7.845
   67    HB2  TYR   9           2HB      TYR   9  -2.512  -0.561   7.348
   68    HB3  TYR   9           1HB      TYR   9  -1.219  -1.528   8.049
   69    HD1  TYR   9           1HD      TYR   9  -0.109  -0.392  10.216
   70    HD2  TYR   9           2HD      TYR   9  -4.017   0.417   8.757
   71    HE1  TYR   9           1HE      TYR   9  -0.780   0.386  12.445
   72    HE2  TYR   9           2HE      TYR   9  -4.696   1.202  10.965
   73    HH   TYR   9           HH       TYR   9  -4.016   0.890  13.311
   74    H    CYS  10           H        CYS  10  -1.667   0.813   4.991
   75    HA   CYS  10           HA       CYS  10  -1.513   0.156   2.829
   76    HB2  CYS  10           2HB      CYS  10   0.811   1.105   3.038
   77    HB3  CYS  10           1HB      CYS  10   1.395  -0.497   3.476
   78    H    ILE  11           H        ILE  11  -2.131  -1.768   4.989
   79    HA   ILE  11           HA       ILE  11  -1.237  -4.263   3.786
   80    HB   ILE  11           HB       ILE  11  -2.215  -5.388   5.766
   81   HG12  ILE  11          2HG1      ILE  11  -2.721  -2.579   6.778
   82   HG13  ILE  11          1HG1      ILE  11  -3.959  -3.731   6.301
   83   HG21  ILE  11          1HG2      ILE  11  -0.548  -4.612   7.402
   84   HG22  ILE  11          2HG2      ILE  11  -0.238  -3.201   6.388
   85   HG23  ILE  11          3HG2      ILE  11   0.128  -4.819   5.789
   86   HD11  ILE  11          3HD1      ILE  11  -3.761  -3.603   8.708
   87   HD12  ILE  11          1HD1      ILE  11  -2.051  -4.024   8.605
   88   HD13  ILE  11          2HD1      ILE  11  -3.279  -5.196   8.124
   89    H    VAL  12           H        VAL  12  -2.505  -5.542   2.703
   90    HA   VAL  12           HA       VAL  12  -5.364  -5.198   2.792
   91    HB   VAL  12           HB       VAL  12  -5.431  -5.472   0.239
   92   HG11  VAL  12          1HG1      VAL  12  -5.908  -3.324   1.320
   93   HG12  VAL  12          2HG1      VAL  12  -5.120  -3.115  -0.237
   94   HG13  VAL  12          3HG1      VAL  12  -4.192  -2.912   1.252
   95   HG21  VAL  12          3HG2      VAL  12  -3.449  -4.748  -1.024
   96   HG22  VAL  12          1HG2      VAL  12  -3.127  -6.208  -0.089
   97   HG23  VAL  12          2HG2      VAL  12  -2.535  -4.649   0.480
   98    HA   PRO  13           HA       PRO  13  -5.077  -9.587   2.807
   99    HB2  PRO  13           2HB      PRO  13  -7.609  -9.989   1.492
  100    HB3  PRO  13           1HB      PRO  13  -7.241 -10.084   3.212
  101    HG2  PRO  13           2HG      PRO  13  -8.807  -8.140   2.113
  102    HG3  PRO  13           1HG      PRO  13  -7.871  -7.919   3.602
  103    HD2  PRO  13           2HD      PRO  13  -7.228  -7.062   0.806
  104    HD3  PRO  13           1HD      PRO  13  -7.032  -6.172   2.332
  105    H    ILE  14           H        ILE  14  -4.771  -8.041  -0.023
  106    HA   ILE  14           HA       ILE  14  -4.283 -10.536  -1.434
  107    HB   ILE  14           HB       ILE  14  -4.694  -9.246  -3.603
  108   HG12  ILE  14          2HG1      ILE  14  -6.163  -7.357  -1.734
  109   HG13  ILE  14          1HG1      ILE  14  -4.710  -6.966  -2.644
  110   HG21  ILE  14          1HG2      ILE  14  -6.209 -10.964  -2.854
  111   HG22  ILE  14          2HG2      ILE  14  -7.120  -9.630  -3.566
  112   HG23  ILE  14          3HG2      ILE  14  -7.045  -9.810  -1.814
  113   HD11  ILE  14          3HD1      ILE  14  -5.931  -7.207  -4.727
  114   HD12  ILE  14          1HD1      ILE  14  -6.734  -6.048  -3.668
  115   HD13  ILE  14          2HD1      ILE  14  -7.380  -7.681  -3.841
  116    H    LEU  15           H        LEU  15  -2.269 -10.797  -1.922
  117    HA   LEU  15           HA       LEU  15  -0.503  -8.564  -1.377
  118    HB2  LEU  15           2HB      LEU  15   0.099 -11.511  -1.591
  119    HB3  LEU  15           1HB      LEU  15   1.296 -10.281  -1.267
  120    HG   LEU  15           HG       LEU  15   0.868 -11.264   0.804
  121   HD11  LEU  15          1HD1      LEU  15  -0.127  -9.549   2.191
  122   HD12  LEU  15          2HD1      LEU  15  -0.818  -8.787   0.766
  123   HD13  LEU  15          3HD1      LEU  15   0.932  -8.861   0.959
  124   HD21  LEU  15          3HD2      LEU  15  -1.145 -12.526   0.299
  125   HD22  LEU  15          1HD2      LEU  15  -2.100 -11.042   0.276
  126   HD23  LEU  15          2HD2      LEU  15  -1.377 -11.603   1.783
  127    H    GLY  16           H        GLY  16   1.052  -7.875  -2.741
  128    HA2  GLY  16           2HA      GLY  16   2.216  -7.879  -4.810
  129    HA3  GLY  16           1HA      GLY  16   0.928  -8.874  -5.495
  130    H    PHE  17           H        PHE  17  -0.671  -6.837  -3.683
  131    HA   PHE  17           HA       PHE  17  -0.935  -4.800  -5.767
  132    HB2  PHE  17           2HB      PHE  17  -3.071  -5.990  -3.990
  133    HB3  PHE  17           1HB      PHE  17  -3.309  -4.592  -5.026
  134    HD1  PHE  17           2HD      PHE  17  -3.272  -4.855  -7.474
  135    HD2  PHE  17           1HD      PHE  17  -3.079  -8.205  -4.857
  136    HE1  PHE  17           2HE      PHE  17  -3.893  -6.335  -9.328
  137    HE2  PHE  17           1HE      PHE  17  -3.704  -9.693  -6.714
  138    HZ   PHE  17           HZ       PHE  17  -4.114  -8.756  -8.953
  139    H    VAL  18           H        VAL  18  -0.684  -2.779  -5.098
  140    HA   VAL  18           HA       VAL  18  -0.562  -2.310  -2.223
  141    HB   VAL  18           HB       VAL  18   0.677  -0.234  -2.738
  142   HG11  VAL  18          1HG1      VAL  18   2.763  -1.256  -3.549
  143   HG12  VAL  18          2HG1      VAL  18   1.850  -2.691  -4.021
  144   HG13  VAL  18          3HG1      VAL  18   1.951  -2.228  -2.322
  145   HG21  VAL  18          3HG2      VAL  18   1.499   0.222  -5.016
  146   HG22  VAL  18          1HG2      VAL  18  -0.262   0.275  -4.945
  147   HG23  VAL  18          2HG2      VAL  18   0.551  -1.132  -5.627
  148    H    TYR  19           H        TYR  19  -1.868  -0.797  -1.281
  149    HA   TYR  19           HA       TYR  19  -3.671   0.654  -3.015
  150    HB2  TYR  19           2HB      TYR  19  -4.495  -1.254  -0.869
  151    HB3  TYR  19           1HB      TYR  19  -5.499   0.130  -1.260
  152    HD1  TYR  19           2HD      TYR  19  -6.425   0.352  -3.566
  153    HD2  TYR  19           1HD      TYR  19  -4.495  -3.206  -2.264
  154    HE1  TYR  19           2HE      TYR  19  -7.480  -0.866  -5.387
  155    HE2  TYR  19           1HE      TYR  19  -5.547  -4.448  -4.095
  156    HH   TYR  19           HH       TYR  19  -7.655  -4.182  -5.495
  157    H    CYS  20           H        CYS  20  -3.199   2.606  -2.633
  158    HA   CYS  20           HA       CYS  20  -3.756   3.785  -0.084
  159    HB2  CYS  20           2HB      CYS  20  -1.040   4.133  -1.445
  160    HB3  CYS  20           1HB      CYS  20  -1.652   5.173  -0.174
  161    H    CYS  21           H        CYS  21  -3.437   6.244  -0.592
  162    HA   CYS  21           HA       CYS  21  -4.948   6.887  -2.852
  163    HB2  CYS  21           2HB      CYS  21  -3.169   8.589  -1.126
  164    HB3  CYS  21           1HB      CYS  21  -4.169   9.255  -2.428
  165    HA   PRO  22           HA       PRO  22  -2.281   6.604  -6.223
  166    HB2  PRO  22           2HB      PRO  22  -3.252   8.558  -7.870
  167    HB3  PRO  22           1HB      PRO  22  -4.048   7.003  -7.611
  168    HG2  PRO  22           2HG      PRO  22  -4.643   9.661  -6.409
  169    HG3  PRO  22           1HG      PRO  22  -5.769   8.397  -6.937
  170    HD2  PRO  22           2HD      PRO  22  -5.069   8.822  -4.309
  171    HD3  PRO  22           1HD      PRO  22  -5.563   7.239  -4.941
  172    H    GLY  23           H        GLY  23  -0.298   7.208  -6.562
  173    HA2  GLY  23           2HA      GLY  23   1.261   8.989  -7.253
  174    HA3  GLY  23           1HA      GLY  23   0.422  10.037  -6.111
  175    H    LEU  24           H        LEU  24   0.509   7.200  -4.611
  176    HA   LEU  24           HA       LEU  24   2.960   7.953  -3.179
  177    HB2  LEU  24           2HB      LEU  24   0.765   6.165  -2.119
  178    HB3  LEU  24           1HB      LEU  24   2.054   6.944  -1.274
  179    HG   LEU  24           HG       LEU  24  -0.113   8.540  -2.599
  180   HD11  LEU  24          1HD1      LEU  24   0.118   7.618   0.241
  181   HD12  LEU  24          2HD1      LEU  24  -1.148   7.209  -0.935
  182   HD13  LEU  24          3HD1      LEU  24  -1.004   8.858  -0.335
  183   HD21  LEU  24          3HD2      LEU  24   1.909   9.785  -2.278
  184   HD22  LEU  24          1HD2      LEU  24   2.045   9.237  -0.600
  185   HD23  LEU  24          2HD2      LEU  24   0.728  10.307  -1.077
  186    H    ILE  25           H        ILE  25   4.189   6.160  -2.334
  187    HA   ILE  25           HA       ILE  25   3.884   3.730  -3.945
  188    HB   ILE  25           HB       ILE  25   6.358   3.453  -3.865
  189   HG12  ILE  25          2HG1      ILE  25   6.400   6.374  -3.057
  190   HG13  ILE  25          1HG1      ILE  25   6.804   5.027  -2.001
  191   HG21  ILE  25          1HG2      ILE  25   5.343   5.866  -5.362
  192   HG22  ILE  25          2HG2      ILE  25   5.294   4.189  -5.905
  193   HG23  ILE  25          3HG2      ILE  25   6.843   5.010  -5.721
  194   HD11  ILE  25          3HD1      ILE  25   8.276   5.836  -4.497
  195   HD12  ILE  25          1HD1      ILE  25   8.686   4.468  -3.461
  196   HD13  ILE  25          2HD1      ILE  25   8.795   6.109  -2.831
  197    H    CYS  26           H        CYS  26   3.920   1.878  -2.853
  198    HA   CYS  26           HA       CYS  26   4.332   2.085   0.029
  199    HB2  CYS  26           2HB      CYS  26   2.289   0.970  -0.993
  200    HB3  CYS  26           1HB      CYS  26   3.358  -0.330  -1.521
  201    H    GLY  27           H        GLY  27   6.395   2.344   0.139
  202    HA2  GLY  27           2HA      GLY  27   8.249   0.757  -1.373
  203    HA3  GLY  27           1HA      GLY  27   8.644   2.015  -0.214
  204    HA   PRO  28           HA       PRO  28   9.881  -0.992   2.675
  205    HB2  PRO  28           2HB      PRO  28   8.973   0.024   5.054
  206    HB3  PRO  28           1HB      PRO  28  10.393   0.635   4.206
  207    HG2  PRO  28           2HG      PRO  28   7.601   1.712   4.234
  208    HG3  PRO  28           1HG      PRO  28   9.133   2.598   4.299
  209    HD2  PRO  28           2HD      PRO  28   7.680   2.385   2.043
  210    HD3  PRO  28           1HD      PRO  28   9.453   2.445   2.022
  211    H    PHE  29           H        PHE  29   7.020  -0.160   4.573
  212    HA   PHE  29           HA       PHE  29   5.685  -2.557   3.585
  213    HB2  PHE  29           2HB      PHE  29   6.971  -2.908   5.782
  214    HB3  PHE  29           1HB      PHE  29   5.830  -1.789   6.510
  215    HD1  PHE  29           1HD      PHE  29   6.049  -4.982   4.674
  216    HD2  PHE  29           2HD      PHE  29   3.822  -2.572   7.347
  217    HE1  PHE  29           1HE      PHE  29   4.540  -6.883   5.105
  218    HE2  PHE  29           2HE      PHE  29   2.293  -4.455   7.788
  219    HZ   PHE  29           HZ       PHE  29   2.647  -6.611   6.673
  220    H    VAL  30           H        VAL  30   5.719   0.634   3.858
  221    HA   VAL  30           HA       VAL  30   2.841   0.964   4.048
  222    HB   VAL  30           HB       VAL  30   3.148   3.077   5.296
  223   HG11  VAL  30          1HG1      VAL  30   3.725   2.166   7.493
  224   HG12  VAL  30          2HG1      VAL  30   4.349   0.707   6.715
  225   HG13  VAL  30          3HG1      VAL  30   2.635   1.117   6.591
  226   HG21  VAL  30          3HG2      VAL  30   6.037   2.251   5.554
  227   HG22  VAL  30          1HG2      VAL  30   5.285   3.634   6.347
  228   HG23  VAL  30          2HG2      VAL  30   5.434   3.599   4.588
  229    H    CYS  31           H        CYS  31   2.383   3.291   3.239
  230    HA   CYS  31           HA       CYS  31   3.852   3.694   0.755
  231    HB2  CYS  31           2HB      CYS  31   1.223   4.713   1.798
  232    HB3  CYS  31           1HB      CYS  31   1.945   5.291   0.289
  233    H    VAL  32           H        VAL  32   3.871   6.148   0.160
  234    HA   VAL  32           HA       VAL  32   4.726   8.044   1.919
  235    HB   VAL  32           HB       VAL  32   6.479   6.485   2.655
  236   HG11  VAL  32          1HG1      VAL  32   6.710   5.102   0.652
  237   HG12  VAL  32          2HG1      VAL  32   8.282   5.742   1.132
  238   HG13  VAL  32          3HG1      VAL  32   7.414   6.460  -0.225
  239   HG21  VAL  32          3HG2      VAL  32   7.021   8.826   2.662
  240   HG22  VAL  32          1HG2      VAL  32   7.603   8.741   0.996
  241   HG23  VAL  32          2HG2      VAL  32   8.452   7.875   2.288