*HEADER    TOXIN                                               2NAW              
*TITLE     NMR SOLUTION STRUCTURE OF EXENDIN-4, ALPHA/KAPPA-CONOTOXIN PL14A      
*TITLE    2 CHIMERA                                                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: EXENDIN-4, ALPHA/KAPPA-CONOTOXIN PL14A CHIMERA;            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    AGONIST, TOXIN                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.I.SCHROEDER, J.E.SWEDBERG, D.J.CRAIK                                
*REVDAT   1   18-MAY-16 2NAW    1                                                


!Distance restraints
assign (resid   24 and name HB#  ) (resid   25 and name HN   )    3.41    3.41    0.00
assign (resid   39 and name HN   ) (resid   39 and name HG2  )    4.67    4.67    0.00
assign (resid   25 and name HN   ) (resid   25 and name HB1  )    3.10    3.10    0.00
assign (resid   25 and name HN   ) (resid   25 and name HB2  )    3.44    3.44    0.00
assign (resid   37 and name HN   ) (resid   37 and name HB#  )    3.44    3.44    0.00
assign (resid    3 and name HN   ) (resid    3 and name HG#  )    5.50    5.50    0.00
assign (resid   38 and name HN   ) (resid   38 and name HB2  )    3.70    3.70    0.00
assign (resid   38 and name HN   ) (resid   38 and name HB1  )    3.70    3.70    0.00
assign (resid   21 and name HN   ) (resid   21 and name HB#  )    2.87    2.87    0.00
assign (resid    6 and name HN   ) (resid    6 and name HB2  )    3.84    3.84    0.00
assign (resid    6 and name HN   ) (resid    6 and name HB1  )    3.84    3.84    0.00
assign (resid   31 and name HN   ) (resid   31 and name HB#  )    3.06    3.06    0.00
assign (resid    8 and name HN   ) (resid    8 and name HB2  )    3.91    3.91    0.00
assign (resid    8 and name HN   ) (resid    8 and name HB1  )    3.91    3.91    0.00
assign (resid   22 and name HN   ) (resid   22 and name HB#  )    2.76    2.76    0.00
assign (resid   24 and name HN   ) (resid   24 and name HG2  )    2.98    2.98    0.00
assign (resid   11 and name HN   ) (resid   11 and name HB2  )    3.69    3.69    0.00
assign (resid   11 and name HN   ) (resid   11 and name HB1  )    3.69    3.69    0.00
assign (resid   16 and name HN   ) (resid   16 and name HG2  )    4.64    4.64    0.00
assign (resid   15 and name HN   ) (resid   15 and name HB#  )    3.18    3.18    0.00
assign (resid   16 and name HN   ) (resid   16 and name HB#  )    3.50    3.50    0.00
assign (resid   14 and name HN   ) (resid   14 and name HB#  )    2.97    2.97    0.00
assign (resid   16 and name HN   ) (resid   16 and name HG1  )    4.64    4.64    0.00
assign (resid   13 and name HN   ) (resid   13 and name HG2  )    4.49    4.49    0.00
assign (resid   13 and name HN   ) (resid   13 and name HG1  )    4.49    4.49    0.00
assign (resid   13 and name HN   ) (resid   13 and name HB#  )    2.84    2.84    0.00
assign (resid   12 and name HN   ) (resid   12 and name HB#  )    3.01    3.01    0.00
assign (resid    7 and name HN   ) (resid    7 and name HB   )    3.86    3.86    0.00
assign (resid    7 and name HN   ) (resid    7 and name HG2# )    3.99    3.99    0.00
assign (resid    5 and name HN   ) (resid    5 and name HG2# )    4.50    4.50    0.00
assign (resid    5 and name HN   ) (resid    5 and name HB   )    4.09    4.09    0.00
assign (resid   18 and name HN   ) (resid   18 and name HB#  )    2.95    2.95    0.00
assign (resid   20 and name HN   ) (resid   20 and name HB1  )    3.56    3.56    0.00
assign (resid   20 and name HN   ) (resid   20 and name HB2  )    3.35    3.35    0.00
assign (resid   20 and name HN   ) (resid   20 and name HG1  )    4.09    4.09    0.00
assign (resid   19 and name HN   ) (resid   19 and name HG2# )    3.77    3.77    0.00
assign (resid   19 and name HN   ) (resid   19 and name HG1# )    3.77    3.77    0.00
assign (resid   19 and name HN   ) (resid   19 and name HB   )    3.70    3.70    0.00
assign (resid   33 and name HN   ) (resid   33 and name HB2  )    4.02    4.02    0.00
assign (resid   33 and name HN   ) (resid   33 and name HB1  )    4.02    4.02    0.00
assign (resid   27 and name HB2  ) (resid   28 and name HN   )    4.43    4.43    0.00
assign (resid   23 and name HN   ) (resid   23 and name HB   )    3.12    3.12    0.00
assign (resid   23 and name HN   ) (resid   23 and name HD1# )    3.57    3.57    0.00
assign (resid   29 and name HN   ) (resid   29 and name HD1# )    3.69    3.69    0.00
assign (resid   29 and name HN   ) (resid   29 and name HB   )    3.88    3.88    0.00
assign (resid   26 and name HN   ) (resid   26 and name HB#  )    2.76    2.76    0.00
assign (resid   36 and name HN   ) (resid   36 and name HB2  )    3.50    3.50    0.00
assign (resid   36 and name HN   ) (resid   36 and name HB1  )    3.50    3.50    0.00
assign (resid   20 and name HN   ) (resid   20 and name HG2  )    3.69    3.69    0.00
assign (resid    4 and name HA#  ) (resid    5 and name HN   )    3.37    3.37    0.00
assign (resid    5 and name HB   ) (resid    6 and name HN   )    4.64    4.64    0.00
assign (resid    5 and name HA   ) (resid    6 and name HN   )    3.25    3.25    0.00
assign (resid    5 and name HG2# ) (resid    6 and name HN   )    5.00    5.00    0.00
assign (resid    6 and name HA   ) (resid    7 and name HN   )    3.13    3.13    0.00
assign (resid    6 and name HB2  ) (resid    7 and name HN   )    4.78    4.78    0.00
assign (resid    6 and name HB1  ) (resid    7 and name HN   )    4.78    4.78    0.00
assign (resid    7 and name HA   ) (resid    8 and name HN   )    3.09    3.09    0.00
assign (resid    7 and name HB   ) (resid    8 and name HN   )    4.72    4.72    0.00
assign (resid    7 and name HG2# ) (resid    8 and name HN   )    4.34    4.34    0.00
assign (resid   19 and name HA   ) (resid   21 and name HN   )    5.40    5.40    0.00
assign (resid   12 and name HN   ) (resid   12 and name HD#  )    4.85    4.85    0.00
assign (resid   12 and name HN   ) (resid   12 and name HG2  )    4.98    4.98    0.00
assign (resid   12 and name HG2  ) (resid   13 and name HN   )    5.37    5.37    0.00
assign (resid   12 and name HN   ) (resid   12 and name HG1  )    4.98    4.98    0.00
assign (resid   12 and name HG1  ) (resid   13 and name HN   )    5.37    5.37    0.00
assign (resid   29 and name HA   ) (resid   30 and name HN   )    3.52    3.52    0.00
assign (resid   29 and name HN   ) (resid   29 and name HG2# )    3.22    3.22    0.00
assign (resid   29 and name HA   ) (resid   29 and name HD1# )    3.90    3.90    0.00
assign (resid   29 and name HB   ) (resid   29 and name HD1# )    2.81    2.81    0.00
assign (resid   29 and name HG2# ) (resid   29 and name HG1# )    2.80    2.80    0.00
assign (resid   29 and name HG2# ) (resid   29 and name HD1# )    3.17    3.17    0.00
assign (resid   35 and name HN   ) (resid   35 and name HB1  )    3.79    3.79    0.00
assign (resid   35 and name HN   ) (resid   35 and name HB2  )    3.79    3.79    0.00
assign (resid   36 and name HA   ) (resid   37 and name HN   )    2.96    2.96    0.00
assign (resid   36 and name HB2  ) (resid   37 and name HN   )    4.48    4.48    0.00
assign (resid   36 and name HB1  ) (resid   37 and name HN   )    4.48    4.48    0.00
assign (resid   37 and name HB#  ) (resid   38 and name HN   )    4.19    4.19    0.00
assign (resid   37 and name HA   ) (resid   38 and name HN   )    3.48    3.48    0.00
assign (resid   38 and name HA   ) (resid   39 and name HN   )    3.10    3.10    0.00
assign (resid   38 and name HB2  ) (resid   39 and name HN   )    4.39    4.39    0.00
assign (resid   38 and name HB1  ) (resid   39 and name HN   )    4.39    4.39    0.00
assign (resid   39 and name HA   ) (resid   40 and name H1   )    3.55    3.55    0.00
assign (resid   34 and name HD#  ) (resid   35 and name HN   )    4.09    4.09    0.00
assign (resid   34 and name HG2  ) (resid   35 and name HN   )    4.44    4.44    0.00
assign (resid   34 and name HG1  ) (resid   35 and name HN   )    4.44    4.44    0.00
assign (resid   19 and name HG1# ) (resid   20 and name HN   )    4.16    4.16    0.00
assign (resid   19 and name HG2# ) (resid   20 and name HN   )    4.16    4.16    0.00
assign (resid   19 and name HB   ) (resid   20 and name HN   )    4.14    4.14    0.00
assign (resid   19 and name HA   ) (resid   19 and name HG1# )    3.28    3.28    0.00
assign (resid   19 and name HA   ) (resid   19 and name HG2# )    3.28    3.28    0.00
assign (resid   18 and name HB#  ) (resid   19 and name HN   )    3.44    3.44    0.00
assign (resid   18 and name HN   ) (resid   19 and name HN   )    3.22    3.22    0.00
assign (resid   20 and name HA   ) (resid   21 and name HN   )    3.57    3.57    0.00
assign (resid   20 and name HN   ) (resid   21 and name HN   )    3.41    3.41    0.00
assign (resid   20 and name HB1  ) (resid   21 and name HN   )    3.88    3.88    0.00
assign (resid   20 and name HB2  ) (resid   21 and name HN   )    3.80    3.80    0.00
assign (resid   20 and name HG2  ) (resid   21 and name HN   )    5.11    5.11    0.00
assign (resid   21 and name HB#  ) (resid   22 and name HN   )    3.74    3.74    0.00
assign (resid   21 and name HA   ) (resid   24 and name HN   )    4.32    4.32    0.00
assign (resid   22 and name HA   ) (resid   22 and name HB#  )    2.90    2.90    0.00
assign (resid   22 and name HB#  ) (resid   23 and name HN   )    3.30    3.30    0.00
assign (resid   23 and name HA   ) (resid   23 and name HG1# )    3.87    3.87    0.00
assign (resid   23 and name HA   ) (resid   23 and name HG2# )    3.51    3.51    0.00
assign (resid   23 and name HA   ) (resid   23 and name HD1# )    3.65    3.65    0.00
assign (resid   23 and name HG2# ) (resid   23 and name HG1# )    2.63    2.63    0.00
assign (resid   23 and name HB   ) (resid   23 and name HD1# )    3.40    3.40    0.00
assign (resid   23 and name HG2# ) (resid   23 and name HD1# )    3.35    3.35    0.00
assign (resid   26 and name HN   ) (resid   26 and name HD## )    4.11    4.11    0.00
assign (resid   23 and name HN   ) (resid   23 and name HG1# )    3.43    3.43    0.00
assign (resid   23 and name HN   ) (resid   23 and name HG2# )    3.99    3.99    0.00
assign (resid   24 and name HN   ) (resid   24 and name HG1  )    3.72    3.72    0.00
assign (resid   24 and name HA   ) (resid   24 and name HG1  )    3.86    3.86    0.00
assign (resid   24 and name HA   ) (resid   24 and name HG2  )    3.66    3.66    0.00
assign (resid   22 and name HN   ) (resid   23 and name HN   )    3.68    3.68    0.00
assign (resid   23 and name HN   ) (resid   24 and name HN   )    3.87    3.87    0.00
assign (resid   24 and name HG2  ) (resid   25 and name HN   )    3.75    3.75    0.00
assign (resid   24 and name HG1  ) (resid   25 and name HN   )    4.80    4.80    0.00
assign (resid   24 and name HN   ) (resid   25 and name HN   )    3.34    3.34    0.00
assign (resid   26 and name HA   ) (resid   26 and name HD## )    3.10    3.10    0.00
assign (resid   26 and name HB#  ) (resid   26 and name HD## )    2.63    2.63    0.00
assign (resid   25 and name HN   ) (resid   26 and name HN   )    3.46    3.46    0.00
assign (resid   39 and name HN   ) (resid   40 and name H1   )    3.89    3.89    0.00
assign (resid   25 and name HB2  ) (resid   26 and name HN   )    4.24    4.24    0.00
assign (resid   25 and name HB1  ) (resid   26 and name HN   )    3.64    3.64    0.00
assign (resid   26 and name HN   ) (resid   27 and name HN   )    3.54    3.54    0.00
assign (resid   26 and name HB#  ) (resid   27 and name HN   )    3.82    3.82    0.00
assign (resid   26 and name HD## ) (resid   27 and name HN   )    4.50    4.50    0.00
assign (resid   27 and name HB1  ) (resid   28 and name HN   )    4.43    4.43    0.00
assign (resid   29 and name HN   ) (resid   29 and name HG1# )    3.70    3.70    0.00
assign (resid   29 and name HB   ) (resid   30 and name HN   )    4.33    4.33    0.00
assign (resid   29 and name HG1# ) (resid   30 and name HN   )    4.74    4.74    0.00
assign (resid   29 and name HD1# ) (resid   30 and name HN   )    3.76    3.76    0.00
assign (resid   29 and name HN   ) (resid   30 and name HN   )    3.55    3.55    0.00
assign (resid   31 and name HN   ) (resid   32 and name HN   )    4.17    4.17    0.00
assign (resid   14 and name HN   ) (resid   14 and name HG2  )    5.14    5.14    0.00
assign (resid   31 and name HB#  ) (resid   32 and name HN   )    4.03    4.03    0.00
assign (resid   31 and name HA   ) (resid   32 and name HN   )    3.29    3.29    0.00
assign (resid   35 and name HB2  ) (resid   36 and name HN   )    4.50    4.50    0.00
assign (resid   34 and name HA   ) (resid   36 and name HN   )    4.84    4.84    0.00
assign (resid   17 and name HN   ) (resid   17 and name HG#  )    3.52    3.52    0.00
assign (resid    9 and name HN   ) (resid   10 and name HN   )    3.42    3.42    0.00
assign (resid    9 and name HA   ) (resid   10 and name HN   )    3.57    3.57    0.00
assign (resid    9 and name HA   ) (resid   12 and name HN   )    4.82    4.82    0.00
assign (resid   11 and name HN   ) (resid   12 and name HN   )    4.18    4.18    0.00
assign (resid   14 and name HN   ) (resid   14 and name HG1  )    5.14    5.14    0.00
assign (resid   23 and name HG2# ) (resid   24 and name HN   )    4.86    4.86    0.00
assign (resid   23 and name HG1# ) (resid   24 and name HN   )    4.33    4.33    0.00
assign (resid   23 and name HB   ) (resid   24 and name HN   )    3.30    3.30    0.00
assign (resid   12 and name HA   ) (resid   12 and name HD#  )    4.23    4.23    0.00
assign (resid   12 and name HA   ) (resid   12 and name HG2  )    3.87    3.87    0.00
assign (resid   12 and name HA   ) (resid   12 and name HG1  )    3.87    3.87    0.00
assign (resid    9 and name HB2  ) (resid   12 and name HN   )    5.50    5.50    0.00
assign (resid    9 and name HB1  ) (resid   12 and name HN   )    5.50    5.50    0.00
assign (resid    9 and name HB1  ) (resid   10 and name HN   )    4.40    4.40    0.00
assign (resid    9 and name HB2  ) (resid   10 and name HN   )    4.40    4.40    0.00
assign (resid   32 and name HA   ) (resid   33 and name HN   )    3.53    3.53    0.00
assign (resid   33 and name HA   ) (resid   33 and name HD#  )    3.19    3.19    0.00
assign (resid   33 and name HA   ) (resid   33 and name HE#  )    4.83    4.83    0.00
assign (resid   33 and name HN   ) (resid   33 and name HD#  )    3.84    3.84    0.00
assign (resid   33 and name HN   ) (resid   33 and name HE#  )    5.50    5.50    0.00
assign (resid    7 and name HA   ) (resid    7 and name HG2# )    3.70    3.70    0.00
assign (resid   33 and name HB2  ) (resid   34 and name HD#  )    3.68    3.68    0.00
assign (resid   33 and name HB1  ) (resid   34 and name HD#  )    3.68    3.68    0.00
assign (resid   33 and name HA   ) (resid   34 and name HD#  )    2.83    2.83    0.00
assign (resid    6 and name HN   ) (resid    6 and name HD#  )    5.26    5.26    0.00
assign (resid    6 and name HA   ) (resid    6 and name HD#  )    4.09    4.09    0.00
assign (resid   31 and name HA   ) (resid   33 and name HN   )    4.92    4.92    0.00
assign (resid   21 and name HB#  ) (resid   33 and name HN   )    5.20    5.20    0.00
assign (resid   31 and name HB#  ) (resid   33 and name HN   )    5.50    5.50    0.00
assign (resid   32 and name HN   ) (resid   32 and name HG2  )    4.91    4.91    0.00
assign (resid   32 and name HN   ) (resid   32 and name HG1  )    4.91    4.91    0.00
assign (resid   33 and name HB2  ) (resid   36 and name HN   )    4.65    4.65    0.00
assign (resid   33 and name HB2  ) (resid   35 and name HE#  )    4.29    4.29    0.00
assign (resid   33 and name HB2  ) (resid   35 and name HD#  )    4.19    4.19    0.00
assign (resid   33 and name HB2  ) (resid   35 and name HN   )    5.23    5.23    0.00
assign (resid   33 and name HB1  ) (resid   36 and name HN   )    4.65    4.65    0.00
assign (resid   33 and name HB1  ) (resid   35 and name HE#  )    4.29    4.29    0.00
assign (resid   33 and name HB1  ) (resid   35 and name HD#  )    4.19    4.19    0.00
assign (resid   33 and name HB1  ) (resid   35 and name HN   )    5.23    5.23    0.00
assign (resid   33 and name HD#  ) (resid   36 and name HB2  )    4.85    4.85    0.00
assign (resid   33 and name HD#  ) (resid   36 and name HB1  )    4.85    4.85    0.00
assign (resid   22 and name HE#  ) (resid   26 and name HD## )    3.60    3.60    0.00
assign (resid   22 and name HD#  ) (resid   26 and name HD## )    3.96    3.96    0.00
assign (resid   22 and name HD#  ) (resid   23 and name HG2# )    4.39    4.39    0.00
assign (resid   22 and name HE#  ) (resid   23 and name HG2# )    5.50    5.50    0.00
assign (resid   29 and name HG2# ) (resid   30 and name HN   )    4.97    4.97    0.00
assign (resid   29 and name HG2# ) (resid   33 and name HE#  )    5.50    5.50    0.00
assign (resid   32 and name HG2  ) (resid   33 and name HD#  )    5.16    5.16    0.00
assign (resid   33 and name HD#  ) (resid   34 and name HD#  )    3.98    3.98    0.00
assign (resid   34 and name HD#  ) (resid   35 and name HD#  )    4.09    4.09    0.00
assign (resid   34 and name HD#  ) (resid   35 and name HE#  )    4.66    4.66    0.00
assign (resid   33 and name HN   ) (resid   34 and name HD#  )    4.41    4.41    0.00
assign (resid   21 and name HA   ) (resid   25 and name HN   )    4.43    4.43    0.00
assign (resid   25 and name HA   ) (resid   27 and name HN   )    4.23    4.23    0.00
assign (resid    8 and name HA   ) (resid   10 and name HN   )    5.04    5.04    0.00
assign (resid   10 and name HN   ) (resid   10 and name HB#  )    3.04    3.04    0.00
assign (resid   10 and name HB#  ) (resid   11 and name HN   )    3.47    3.47    0.00
assign (resid   10 and name HD2# ) (resid   11 and name HN   )    5.38    5.38    0.00
assign (resid   10 and name HD1# ) (resid   11 and name HN   )    5.38    5.38    0.00
assign (resid   10 and name HA   ) (resid   10 and name HD1# )    4.14    4.14    0.00
assign (resid   10 and name HA   ) (resid   10 and name HD2# )    4.14    4.14    0.00
assign (resid   10 and name HB#  ) (resid   10 and name HD1# )    3.10    3.10    0.00
assign (resid   10 and name HB#  ) (resid   10 and name HD2# )    3.10    3.10    0.00
assign (resid   31 and name HA   ) (resid   31 and name HB#  )    2.85    2.85    0.00
assign (resid   22 and name HA   ) (resid   22 and name HE#  )    4.79    4.79    0.00
assign (resid   22 and name HA   ) (resid   22 and name HD#  )    3.52    3.52    0.00
assign (resid   22 and name HN   ) (resid   22 and name HD#  )    4.26    4.26    0.00
assign (resid   22 and name HE#  ) (resid   23 and name HG1# )    5.31    5.31    0.00
assign (resid   22 and name HD#  ) (resid   23 and name HG1# )    3.58    3.58    0.00
assign (resid   22 and name HD#  ) (resid   23 and name HD1# )    3.79    3.79    0.00
assign (resid   22 and name HE#  ) (resid   23 and name HD1# )    5.45    5.45    0.00
assign (resid   29 and name HD1# ) (resid   33 and name HD#  )    4.20    4.20    0.00
assign (resid   29 and name HD1# ) (resid   33 and name HE#  )    3.88    3.88    0.00
assign (resid   37 and name HA   ) (resid   37 and name HB#  )    2.96    2.96    0.00
assign (resid   35 and name HA   ) (resid   35 and name HE#  )    5.50    5.50    0.00
assign (resid   35 and name HN   ) (resid   35 and name HD#  )    4.08    4.08    0.00
assign (resid   35 and name HN   ) (resid   36 and name HN   )    3.41    3.41    0.00
assign (resid   22 and name HD#  ) (resid   23 and name HN   )    4.95    4.95    0.00
assign (resid    6 and name HN   ) (resid    7 and name HN   )    4.63    4.63    0.00
assign (resid    7 and name HN   ) (resid    8 and name HN   )    4.44    4.44    0.00
assign (resid   31 and name HB#  ) (resid   31 and name HD2  )    3.74    3.74    0.00
assign (resid   31 and name HN   ) (resid   31 and name HD2  )    5.25    5.25    0.00
assign (resid   37 and name HN   ) (resid   37 and name HD2  )    5.27    5.27    0.00
assign (resid   37 and name HB#  ) (resid   37 and name HD2  )    3.96    3.96    0.00
assign (resid   31 and name HA   ) (resid   31 and name HD2  )    5.15    5.15    0.00
assign (resid   32 and name HB1  ) (resid   33 and name HD#  )    4.20    4.20    0.00
assign (resid   32 and name HB2  ) (resid   33 and name HE#  )    4.33    4.33    0.00
assign (resid   22 and name HB#  ) (resid   26 and name HN   )    5.50    5.50    0.00
assign (resid   23 and name HA   ) (resid   26 and name HN   )    4.08    4.08    0.00
assign (resid   22 and name HA   ) (resid   26 and name HN   )    5.15    5.15    0.00
assign (resid   22 and name HE#  ) (resid   23 and name HA   )    5.49    5.49    0.00
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assign (resid   28 and name HA#  ) (resid   30 and name HN   )    4.81    4.81    0.00
assign (resid   29 and name HN   ) (resid   30 and name HA#  )    5.34    5.34    0.00
assign (resid   29 and name HA   ) (resid   30 and name HA#  )    4.87    4.87    0.00
assign (resid   29 and name HD1# ) (resid   30 and name HA#  )    4.22    4.22    0.00
assign (resid   30 and name HA#  ) (resid   31 and name HB#  )    4.87    4.87    0.00
assign (resid   30 and name HA#  ) (resid   32 and name HN   )    5.34    5.34    0.00
assign (resid   30 and name HA#  ) (resid   40 and name H2   )    4.72    4.72    0.00
assign (resid   31 and name HN   ) (resid   32 and name HB#  )    5.12    5.12    0.00
assign (resid   32 and name HN   ) (resid   32 and name HG#  )    4.24    4.24    0.00
assign (resid   32 and name HA   ) (resid   32 and name HG#  )    3.64    3.64    0.00
assign (resid   32 and name HB#  ) (resid   33 and name HD#  )    3.64    3.64    0.00
assign (resid   32 and name HB#  ) (resid   33 and name HE#  )    3.81    3.81    0.00
assign (resid   32 and name HG#  ) (resid   33 and name HD#  )    4.47    4.47    0.00
assign (resid   32 and name HG#  ) (resid   33 and name HE#  )    4.53    4.53    0.00
assign (resid   33 and name HN   ) (resid   33 and name HB#  )    3.19    3.19    0.00
assign (resid   33 and name HN   ) (resid   36 and name HB#  )    4.69    4.69    0.00
assign (resid   33 and name HB#  ) (resid   35 and name HN   )    4.55    4.55    0.00
assign (resid   33 and name HB#  ) (resid   35 and name HE#  )    3.74    3.74    0.00
assign (resid   33 and name HB#  ) (resid   36 and name HN   )    4.03    4.03    0.00
assign (resid   33 and name HB#  ) (resid   36 and name HB#  )    3.29    3.29    0.00
assign (resid   33 and name HD#  ) (resid   34 and name HG#  )    5.23    5.23    0.00
assign (resid   33 and name HE#  ) (resid   36 and name HB#  )    4.87    4.87    0.00
assign (resid   34 and name HG#  ) (resid   35 and name HN   )    3.85    3.85    0.00
assign (resid   34 and name HG#  ) (resid   35 and name HD#  )    3.62    3.62    0.00
assign (resid   34 and name HG#  ) (resid   35 and name HE#  )    3.92    3.92    0.00
assign (resid   35 and name HN   ) (resid   36 and name HB#  )    5.07    5.07    0.00
assign (resid   35 and name HB#  ) (resid   36 and name HN   )    3.93    3.93    0.00
assign (resid   35 and name HE#  ) (resid   36 and name HB#  )    5.34    5.34    0.00
assign (resid   36 and name HN   ) (resid   36 and name HB#  )    3.01    3.01    0.00
assign (resid   36 and name HB#  ) (resid   38 and name HN   )    4.56    4.56    0.00
assign (resid   36 and name HB#  ) (resid   38 and name HB#  )    5.18    5.18    0.00
assign (resid   38 and name HN   ) (resid   38 and name HB#  )    3.01    3.01    0.00
assign (resid   38 and name HB#  ) (resid   39 and name HN   )    3.85    3.85    0.00
assign (resid   39 and name HN   ) (resid   39 and name HB#  )    3.58    3.58    0.00
assign (resid   39 and name HN   ) (resid   39 and name HG#  )    4.02    4.02    0.00
assign (resid   39 and name HA   ) (resid   39 and name HG#  )    3.60    3.60    0.00
assign (resid   39 and name HB#  ) (resid   40 and name H1   )    4.01    4.01    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  100.7   29.7 2
assign (resid    2 and name N    ) (resid    2 and name CA   )
       (resid    2 and name C    ) (resid    3 and name N    )    1.0 -174.6   24.6 2
assign (resid    4 and name C    ) (resid    5 and name N    )
       (resid    5 and name CA   ) (resid    5 and name C    )    1.0 -118.7   23.1 2
assign (resid    5 and name N    ) (resid    5 and name CA   )
       (resid    5 and name C    ) (resid    6 and name N    )    1.0  130.3   20.6 2
assign (resid    5 and name C    ) (resid    6 and name N    )
       (resid    6 and name CA   ) (resid    6 and name C    )    1.0  -94.2   22.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name C    ) (resid    7 and name N    )    1.0  124.1   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 -110.5   20.2 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
       (resid    7 and name C    ) (resid    8 and name N    )    1.0  129.5   21.2 2
assign (resid    7 and name C    ) (resid    8 and name N    )
       (resid    8 and name CA   ) (resid    8 and name C    )    1.0  -98.4   62.3 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name C    ) (resid    9 and name N    )    1.0  123.5   74.0 2
assign (resid    9 and name C    ) (resid   10 and name N    )
       (resid   10 and name CA   ) (resid   10 and name C    )    1.0  -64.8   20.0 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name C    ) (resid   11 and name N    )    1.0  -22.1   20.3 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0  -90.0   20.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0    4.8   20.0 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0   57.6   20.0 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0   36.3   21.4 2
assign (resid   17 and name C    ) (resid   18 and name N    )
       (resid   18 and name CA   ) (resid   18 and name C    )    1.0   54.9   20.0 2
assign (resid   18 and name N    ) (resid   18 and name CA   )
       (resid   18 and name C    ) (resid   19 and name N    )    1.0   39.0   31.2 2 
assign (resid   18 and name C    ) (resid   19 and name N    )
       (resid   19 and name CA   ) (resid   19 and name C    )    1.0  -67.9   40.0 2 
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name C    ) (resid   20 and name N    )    1.0  -26.1   30.4 2
assign (resid   19 and name C    ) (resid   20 and name N    )
       (resid   20 and name CA   ) (resid   20 and name C    )    1.0  -64.9   20.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name C    ) (resid   21 and name N    )    1.0  -31.5   26.9 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )    1.0  -63.9   40.0 2 
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name C    ) (resid   22 and name N    )    1.0  -34.8   30.0 2
assign (resid   21 and name C    ) (resid   22 and name N    )
       (resid   22 and name CA   ) (resid   22 and name C    )    1.0  -66.6   30.0 2
assign (resid   22 and name N    ) (resid   22 and name CA   )
       (resid   22 and name C    ) (resid   23 and name N    )    1.0  -39.0   30.0 2
assign (resid   22 and name C    ) (resid   23 and name N    )
       (resid   23 and name CA   ) (resid   23 and name C    )    1.0  -69.7   20.0 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name C    ) (resid   24 and name N    )    1.0  -28.3   20.0 2
assign (resid   24 and name C    ) (resid   25 and name N    )
       (resid   25 and name CA   ) (resid   25 and name C    )    1.0  -71.9   30.0 2
assign (resid   25 and name N    ) (resid   25 and name CA   )
       (resid   25 and name C    ) (resid   26 and name N    )    1.0  -21.4   30.0 2
assign (resid   28 and name C    ) (resid   29 and name N    )
       (resid   29 and name CA   ) (resid   29 and name C    )    1.0 -107.2   32.1 2
assign (resid   29 and name N    ) (resid   29 and name CA   )
       (resid   29 and name C    ) (resid   30 and name N    )    1.0  127.7   37.8 2
assign (resid   29 and name C    ) (resid   30 and name N    )
       (resid   30 and name CA   ) (resid   30 and name C    )    1.0 -107.6   39.5 2
assign (resid   30 and name N    ) (resid   30 and name CA   )
       (resid   30 and name C    ) (resid   31 and name N    )    1.0  158.8   67.9 2
assign (resid   32 and name C    ) (resid   33 and name N    )
       (resid   33 and name CA   ) (resid   33 and name C    )    1.0 -102.8   56.8 2
assign (resid   33 and name N    ) (resid   33 and name CA   )
       (resid   33 and name C    ) (resid   34 and name N    )    1.0   99.7   70.0 2
assign (resid   34 and name C    ) (resid   35 and name N    )
       (resid   35 and name CA   ) (resid   35 and name C    )    1.0  -96.2   33.9 2
assign (resid   35 and name N    ) (resid   35 and name CA   )
       (resid   35 and name C    ) (resid   36 and name N    )    1.0   21.9   70.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   HIS   1           H        HIS   1  -8.602  -9.560 -14.079
    2    HA   HIS   1           HA       HIS   1  -6.823  -8.211 -14.544
    3    HB2  HIS   1           2HB      HIS   1  -7.706  -6.572 -12.162
    4    HB3  HIS   1           1HB      HIS   1  -6.356  -6.181 -13.218
    5    HD1  HIS   1           1HD      HIS   1  -9.698  -5.204 -12.641
    6    HD2  HIS   1           2HD      HIS   1  -7.429  -5.919 -16.043
    7    HE1  HIS   1           1HE      HIS   1 -10.873  -4.005 -14.505
    8    H    GLY   2           H        GLY   2  -7.700  -9.830 -11.816
    9    HA2  GLY   2           2HA      GLY   2  -6.345 -11.291 -10.562
   10    HA3  GLY   2           1HA      GLY   2  -4.921 -10.405 -11.108
   11    H    GLU   3           H        GLU   3  -4.551 -10.701  -8.648
   12    HA   GLU   3           HA       GLU   3  -6.028  -8.747  -7.180
   13    HB2  GLU   3           2HB      GLU   3  -4.658  -9.421  -5.192
   14    HB3  GLU   3           1HB      GLU   3  -5.616 -10.700  -5.905
   15    HG2  GLU   3           2HG      GLU   3  -3.636 -11.628  -6.950
   16    HG3  GLU   3           1HG      GLU   3  -2.672 -10.296  -6.318
   17    H    GLY   4           H        GLY   4  -5.566  -6.943  -8.201
   18    HA2  GLY   4           2HA      GLY   4  -2.871  -5.850  -7.906
   19    HA3  GLY   4           1HA      GLY   4  -4.200  -5.104  -8.808
   20    H    THR   5           H        THR   5  -2.930  -5.811  -5.678
   21    HA   THR   5           HA       THR   5  -5.100  -4.383  -4.410
   22    HB   THR   5           HB       THR   5  -2.814  -5.881  -3.143
   23    HG1  THR   5           1HG      THR   5  -3.826  -7.652  -3.581
   24   HG21  THR   5          3HG2      THR   5  -4.102  -4.390  -1.648
   25   HG22  THR   5          1HG2      THR   5  -4.383  -6.089  -1.261
   26   HG23  THR   5          2HG2      THR   5  -5.594  -5.178  -2.163
   27    H    PHE   6           H        PHE   6  -4.788  -2.250  -4.395
   28    HA   PHE   6           HA       PHE   6  -2.188  -1.126  -3.777
   29    HB2  PHE   6           2HB      PHE   6  -4.877   0.206  -4.282
   30    HB3  PHE   6           1HB      PHE   6  -3.362   1.061  -4.033
   31    HD1  PHE   6           2HD      PHE   6  -1.559   0.877  -5.737
   32    HD2  PHE   6           1HD      PHE   6  -5.462  -0.681  -6.397
   33    HE1  PHE   6           2HE      PHE   6  -1.112   0.780  -8.145
   34    HE2  PHE   6           1HE      PHE   6  -5.022  -0.788  -8.806
   35    HZ   PHE   6           HZ       PHE   6  -2.839  -0.054  -9.689
   36    H    THR   7           H        THR   7  -1.637  -1.061  -1.676
   37    HA   THR   7           HA       THR   7  -3.750  -1.327   0.219
   38    HB   THR   7           HB       THR   7  -1.713  -1.598   1.795
   39    HG1  THR   7           1HG      THR   7   0.069  -1.077   0.640
   40   HG21  THR   7          3HG2      THR   7  -2.260  -3.601  -0.403
   41   HG22  THR   7          1HG2      THR   7  -3.199  -3.428   1.080
   42   HG23  THR   7          2HG2      THR   7  -1.520  -3.957   1.157
   43    H    SER   8           H        SER   8  -4.164  -0.001   1.834
   44    HA   SER   8           HA       SER   8  -2.785   2.567   1.896
   45    HB2  SER   8           2HB      SER   8  -5.698   1.996   2.485
   46    HB3  SER   8           1HB      SER   8  -4.908   3.578   2.435
   47    HG   SER   8           HG       SER   8  -4.342   2.358   0.202
   48    H    ASP   9           H        ASP   9  -1.390   1.505   3.369
   49    HA   ASP   9           HA       ASP   9  -0.468   1.349   5.376
   50    HB2  ASP   9           2HB      ASP   9  -1.828   3.145   6.268
   51    HB3  ASP   9           1HB      ASP   9  -3.180   2.043   6.535
   52    H    LEU  10           H        LEU  10  -3.017  -0.426   4.357
   53    HA   LEU  10           HA       LEU  10  -3.355  -2.419   6.240
   54    HB2  LEU  10           2HB      LEU  10  -4.737  -2.047   4.216
   55    HB3  LEU  10           1HB      LEU  10  -3.443  -2.659   3.224
   56    HG   LEU  10           HG       LEU  10  -4.890  -4.383   5.261
   57   HD11  LEU  10          1HD1      LEU  10  -6.218  -5.204   3.369
   58   HD12  LEU  10          2HD1      LEU  10  -5.489  -3.976   2.334
   59   HD13  LEU  10          3HD1      LEU  10  -6.515  -3.497   3.687
   60   HD21  LEU  10          3HD2      LEU  10  -3.299  -5.078   2.781
   61   HD22  LEU  10          1HD2      LEU  10  -4.092  -6.222   3.863
   62   HD23  LEU  10          2HD2      LEU  10  -2.731  -5.257   4.441
   63    H    SER  11           H        SER  11  -0.960  -2.324   3.557
   64    HA   SER  11           HA       SER  11   0.495  -4.341   5.098
   65    HB2  SER  11           2HB      SER  11   0.716  -3.663   2.168
   66    HB3  SER  11           1HB      SER  11   1.654  -4.899   3.012
   67    HG   SER  11           HG       SER  11  -0.443  -5.734   3.659
   68    H    LYS  12           H        LYS  12   0.496  -1.078   4.148
   69    HA   LYS  12           HA       LYS  12   2.017   0.470   3.772
   70    HB2  LYS  12           2HB      LYS  12   1.611   0.431   6.213
   71    HB3  LYS  12           1HB      LYS  12   3.141  -0.448   6.381
   72    HG2  LYS  12           2HG      LYS  12   4.347   1.398   5.415
   73    HG3  LYS  12           1HG      LYS  12   2.842   2.274   5.131
   74    HD2  LYS  12           2HD      LYS  12   2.449   2.286   7.545
   75    HD3  LYS  12           1HD      LYS  12   4.018   1.497   7.770
   76    HE2  LYS  12           2HE      LYS  12   3.593   4.182   6.446
   77    HE3  LYS  12           1HE      LYS  12   4.152   3.955   8.100
   78    HZ1  LYS  12           3HZ      LYS  12   5.564   3.018   5.658
   79    HZ2  LYS  12           1HZ      LYS  12   6.103   2.828   7.247
   80    HZ3  LYS  12           2HZ      LYS  12   5.981   4.369   6.581
   81    H    GLN  13           H        GLN  13   2.734  -0.876   2.132
   82    HA   GLN  13           HA       GLN  13   5.673  -1.200   2.201
   83    HB2  GLN  13           2HB      GLN  13   3.799  -3.239   0.968
   84    HB3  GLN  13           1HB      GLN  13   5.550  -3.264   0.839
   85    HG2  GLN  13           2HG      GLN  13   5.743  -3.625   3.216
   86    HG3  GLN  13           1HG      GLN  13   3.994  -3.501   3.399
   87   HE21  GLN  13          1HE2      GLN  13   5.769  -5.653   4.060
   88   HE22  GLN  13          2HE2      GLN  13   5.226  -7.042   3.187
   89    H    MET  14           H        MET  14   3.334  -2.014  -0.338
   90    HA   MET  14           HA       MET  14   4.458   0.180  -1.907
   91    HB2  MET  14           2HB      MET  14   4.592  -2.187  -2.887
   92    HB3  MET  14           1HB      MET  14   2.844  -2.183  -2.953
   93    HG2  MET  14           2HG      MET  14   4.551  -0.156  -4.391
   94    HG3  MET  14           1HG      MET  14   4.055  -1.673  -5.114
   95    HE1  MET  14           3HE      MET  14   1.032  -2.008  -4.139
   96    HE2  MET  14           1HE      MET  14   1.569  -2.242  -5.805
   97    HE3  MET  14           2HE      MET  14   0.181  -1.209  -5.461
   98    H    GLU  15           H        GLU  15   3.312   1.696  -1.002
   99    HA   GLU  15           HA       GLU  15   0.412   1.458  -0.839
  100    HB2  GLU  15           2HB      GLU  15   2.224   3.630   0.194
  101    HB3  GLU  15           1HB      GLU  15   0.541   3.349   0.619
  102    HG2  GLU  15           2HG      GLU  15   2.871   1.569   1.283
  103    HG3  GLU  15           1HG      GLU  15   2.008   2.621   2.401
  104    H    GLU  16           H        GLU  16  -0.833   3.135  -1.729
  105    HA   GLU  16           HA       GLU  16   0.601   4.612  -3.809
  106    HB2  GLU  16           2HB      GLU  16  -1.099   3.075  -4.698
  107    HB3  GLU  16           1HB      GLU  16  -2.333   3.888  -3.746
  108    HG2  GLU  16           2HG      GLU  16  -1.948   5.944  -4.965
  109    HG3  GLU  16           1HG      GLU  16  -0.678   5.166  -5.903
  110    H    GLU  17           H        GLU  17  -1.978   4.927  -1.316
  111    HA   GLU  17           HA       GLU  17  -1.948   7.637  -1.787
  112    HB2  GLU  17           2HB      GLU  17  -3.643   7.675   0.084
  113    HB3  GLU  17           1HB      GLU  17  -4.100   6.810  -1.361
  114    HG2  GLU  17           2HG      GLU  17  -4.881   5.552   0.450
  115    HG3  GLU  17           1HG      GLU  17  -3.465   4.697  -0.142
  116    H    ALA  18           H        ALA  18  -1.797   8.913  -0.239
  117    HA   ALA  18           HA       ALA  18  -0.459  10.377   0.977
  118    HB1  ALA  18           1HB      ALA  18  -1.308   9.055   2.852
  119    HB2  ALA  18           2HB      ALA  18   0.343   9.627   3.150
  120    HB3  ALA  18           3HB      ALA  18   0.062   7.954   2.688
  121    H    VAL  19           H        VAL  19   1.017   8.023  -0.846
  122    HA   VAL  19           HA       VAL  19   3.557   9.336  -0.332
  123    HB   VAL  19           HB       VAL  19   4.680   7.530  -1.546
  124   HG11  VAL  19          1HG1      VAL  19   4.480   7.305   0.841
  125   HG12  VAL  19          2HG1      VAL  19   4.319   5.712   0.093
  126   HG13  VAL  19          3HG1      VAL  19   2.890   6.570   0.663
  127   HG21  VAL  19          3HG2      VAL  19   2.932   6.884  -3.051
  128   HG22  VAL  19          1HG2      VAL  19   1.968   6.263  -1.707
  129   HG23  VAL  19          2HG2      VAL  19   3.500   5.479  -2.133
  130    H    ARG  20           H        ARG  20   1.255   8.439  -2.803
  131    HA   ARG  20           HA       ARG  20   2.516   9.796  -4.927
  132    HB2  ARG  20           2HB      ARG  20  -0.154   8.614  -4.457
  133    HB3  ARG  20           1HB      ARG  20   0.048   9.629  -5.863
  134    HG2  ARG  20           2HG      ARG  20   1.682   7.169  -5.212
  135    HG3  ARG  20           1HG      ARG  20   0.281   7.210  -6.283
  136    HD2  ARG  20           2HD      ARG  20   2.260   7.284  -7.657
  137    HD3  ARG  20           1HD      ARG  20   1.504   8.875  -7.695
  138    HE   ARG  20           HE       ARG  20   3.827   8.213  -6.035
  139   HH11  ARG  20          1HH1      ARG  20   2.185  10.424  -8.298
  140   HH12  ARG  20          2HH1      ARG  20   3.403  11.598  -8.263
  141   HH21  ARG  20          1HH2      ARG  20   5.560   9.830  -6.066
  142   HH22  ARG  20          2HH2      ARG  20   5.386  11.213  -7.028
  143    H    CYS  21           H        CYS  21   0.873  10.920  -2.292
  144    HA   CYS  21           HA       CYS  21   0.409  13.476  -3.644
  145    HB2  CYS  21           2HB      CYS  21  -1.530  12.694  -2.380
  146    HB3  CYS  21           1HB      CYS  21  -0.548  12.543  -0.927
  147    H    PHE  22           H        PHE  22   2.163  11.833  -1.168
  148    HA   PHE  22           HA       PHE  22   3.204  13.827   0.408
  149    HB2  PHE  22           2HB      PHE  22   3.277  11.374   0.739
  150    HB3  PHE  22           1HB      PHE  22   4.517  11.283  -0.498
  151    HD1  PHE  22           1HD      PHE  22   3.707  12.591   2.803
  152    HD2  PHE  22           2HD      PHE  22   6.741  11.639   0.023
  153    HE1  PHE  22           1HE      PHE  22   5.358  12.894   4.561
  154    HE2  PHE  22           2HE      PHE  22   8.462  11.957   1.770
  155    HZ   PHE  22           HZ       PHE  22   7.774  12.587   4.056
  156    H    ILE  23           H        ILE  23   4.771  12.241  -2.331
  157    HA   ILE  23           HA       ILE  23   7.069  13.898  -2.342
  158    HB   ILE  23           HB       ILE  23   5.962  12.038  -4.481
  159   HG12  ILE  23          2HG1      ILE  23   6.415  10.923  -2.344
  160   HG13  ILE  23          1HG1      ILE  23   7.528  10.387  -3.594
  161   HG21  ILE  23          1HG2      ILE  23   7.585  13.591  -5.448
  162   HG22  ILE  23          2HG2      ILE  23   8.227  11.946  -5.386
  163   HG23  ILE  23          3HG2      ILE  23   8.742  13.139  -4.193
  164   HD11  ILE  23          3HD1      ILE  23   8.155  12.372  -1.406
  165   HD12  ILE  23          1HD1      ILE  23   9.265  11.833  -2.664
  166   HD13  ILE  23          2HD1      ILE  23   8.668  10.688  -1.464
  167    H    GLU  24           H        GLU  24   3.962  14.300  -3.645
  168    HA   GLU  24           HA       GLU  24   4.736  16.203  -5.705
  169    HB2  GLU  24           2HB      GLU  24   1.989  15.418  -4.765
  170    HB3  GLU  24           1HB      GLU  24   2.437  16.132  -6.313
  171    HG2  GLU  24           2HG      GLU  24   3.311  13.438  -5.364
  172    HG3  GLU  24           1HG      GLU  24   1.906  13.702  -6.377
  173    H    CYS  25           H        CYS  25   3.155  16.030  -2.610
  174    HA   CYS  25           HA       CYS  25   2.382  18.730  -2.324
  175    HB2  CYS  25           2HB      CYS  25   1.499  16.780  -1.057
  176    HB3  CYS  25           1HB      CYS  25   3.021  16.683  -0.189
  177    H    LEU  26           H        LEU  26   5.269  16.911  -1.730
  178    HA   LEU  26           HA       LEU  26   6.747  18.758  -0.241
  179    HB2  LEU  26           2HB      LEU  26   7.230  16.299  -0.689
  180    HB3  LEU  26           1HB      LEU  26   7.774  16.763  -2.277
  181    HG   LEU  26           HG       LEU  26   9.103  17.736   0.266
  182   HD11  LEU  26          1HD1      LEU  26   9.799  15.371  -1.468
  183   HD12  LEU  26          2HD1      LEU  26   9.173  15.304   0.180
  184   HD13  LEU  26          3HD1      LEU  26  10.767  15.990  -0.130
  185   HD21  LEU  26          3HD2      LEU  26  11.013  18.166  -1.205
  186   HD22  LEU  26          1HD2      LEU  26   9.597  19.057  -1.762
  187   HD23  LEU  26          2HD2      LEU  26  10.095  17.583  -2.592
  188    H    LYS  27           H        LYS  27   6.135  18.373  -3.663
  189    HA   LYS  27           HA       LYS  27   7.955  20.437  -4.516
  190    HB2  LYS  27           2HB      LYS  27   5.571  19.266  -5.978
  191    HB3  LYS  27           1HB      LYS  27   6.829  20.255  -6.695
  192    HG2  LYS  27           2HG      LYS  27   8.466  18.491  -6.236
  193    HG3  LYS  27           1HG      LYS  27   7.186  17.503  -5.525
  194    HD2  LYS  27           2HD      LYS  27   5.984  17.541  -7.671
  195    HD3  LYS  27           1HD      LYS  27   7.291  18.491  -8.377
  196    HE2  LYS  27           2HE      LYS  27   7.542  16.156  -8.985
  197    HE3  LYS  27           1HE      LYS  27   8.850  16.645  -7.911
  198    HZ1  LYS  27           3HZ      LYS  27   6.423  15.128  -7.105
  199    HZ2  LYS  27           1HZ      LYS  27   7.694  15.583  -6.071
  200    HZ3  LYS  27           2HZ      LYS  27   7.965  14.494  -7.326
  201    H    GLY  28           H        GLY  28   4.431  20.147  -4.351
  202    HA2  GLY  28           2HA      GLY  28   3.412  21.995  -2.950
  203    HA3  GLY  28           1HA      GLY  28   4.195  23.097  -4.053
  204    H    ILE  29           H        ILE  29   1.973  20.320  -4.099
  205    HA   ILE  29           HA       ILE  29   0.470  21.897  -5.840
  206    HB   ILE  29           HB       ILE  29  -0.210  19.927  -7.182
  207   HG12  ILE  29          2HG1      ILE  29   1.529  17.981  -7.296
  208   HG13  ILE  29          1HG1      ILE  29   1.942  18.474  -5.662
  209   HG21  ILE  29          1HG2      ILE  29   2.688  20.588  -7.417
  210   HG22  ILE  29          2HG2      ILE  29   1.326  21.412  -8.176
  211   HG23  ILE  29          3HG2      ILE  29   1.736  19.762  -8.648
  212   HD11  ILE  29          3HD1      ILE  29  -0.379  18.066  -4.972
  213   HD12  ILE  29          1HD1      ILE  29   0.359  16.612  -5.654
  214   HD13  ILE  29          2HD1      ILE  29  -0.773  17.580  -6.605
  215    H    GLY  30           H        GLY  30  -1.225  21.914  -5.259
  216    HA2  GLY  30           2HA      GLY  30  -2.339  20.882  -2.837
  217    HA3  GLY  30           1HA      GLY  30  -3.294  21.696  -4.066
  218    H    HIS  31           H        HIS  31  -4.990  20.461  -4.489
  219    HA   HIS  31           HA       HIS  31  -4.822  17.602  -4.126
  220    HB2  HIS  31           2HB      HIS  31  -7.211  19.349  -4.755
  221    HB3  HIS  31           1HB      HIS  31  -7.287  17.612  -4.519
  222    HD1  HIS  31           1HD      HIS  31  -8.100  17.042  -2.211
  223    HD2  HIS  31           2HD      HIS  31  -5.895  20.563  -2.267
  224    HE1  HIS  31           1HE      HIS  31  -8.148  17.920   0.139
  225    H    LYS  32           H        LYS  32  -3.467  17.173  -5.840
  226    HA   LYS  32           HA       LYS  32  -4.545  17.371  -8.543
  227    HB2  LYS  32           2HB      LYS  32  -2.148  17.719  -8.212
  228    HB3  LYS  32           1HB      LYS  32  -1.997  16.119  -7.503
  229    HG2  LYS  32           2HG      LYS  32  -2.510  15.103  -9.645
  230    HG3  LYS  32           1HG      LYS  32  -2.736  16.696 -10.372
  231    HD2  LYS  32           2HD      LYS  32  -0.401  17.250  -9.918
  232    HD3  LYS  32           1HD      LYS  32  -0.173  15.696  -9.120
  233    HE2  LYS  32           2HE      LYS  32  -0.925  16.057 -12.021
  234    HE3  LYS  32           1HE      LYS  32   0.709  15.759 -11.440
  235    HZ1  LYS  32           3HZ      LYS  32  -1.608  13.889 -11.167
  236    HZ2  LYS  32           1HZ      LYS  32  -0.045  13.613 -10.564
  237    HZ3  LYS  32           2HZ      LYS  32  -0.299  13.742 -12.207
  238    H    TYR  33           H        TYR  33  -4.062  15.008  -6.073
  239    HA   TYR  33           HA       TYR  33  -5.267  12.886  -7.744
  240    HB2  TYR  33           2HB      TYR  33  -3.634  12.534  -5.190
  241    HB3  TYR  33           1HB      TYR  33  -4.178  11.272  -6.269
  242    HD1  TYR  33           2HD      TYR  33  -1.883  14.180  -6.043
  243    HD2  TYR  33           1HD      TYR  33  -2.872  10.609  -8.142
  244    HE1  TYR  33           2HE      TYR  33   0.151  14.397  -7.326
  245    HE2  TYR  33           1HE      TYR  33  -0.808  10.809  -9.438
  246    HH   TYR  33           HH       TYR  33   1.718  12.985  -8.700
  247    HA   PRO  34           HA       PRO  34  -9.017  12.955  -5.350
  248    HB2  PRO  34           2HB      PRO  34  -9.077  10.208  -4.657
  249    HB3  PRO  34           1HB      PRO  34  -9.841  10.941  -6.061
  250    HG2  PRO  34           2HG      PRO  34  -7.251   9.509  -5.858
  251    HG3  PRO  34           1HG      PRO  34  -8.400   9.577  -7.203
  252    HD2  PRO  34           2HD      PRO  34  -6.105  10.914  -7.282
  253    HD3  PRO  34           1HD      PRO  34  -7.595  11.624  -7.937
  254    H    PHE  35           H        PHE  35  -6.538  10.877  -4.030
  255    HA   PHE  35           HA       PHE  35  -7.424  11.241  -1.314
  256    HB2  PHE  35           2HB      PHE  35  -5.556   9.591  -0.855
  257    HB3  PHE  35           1HB      PHE  35  -6.871   9.022  -1.879
  258    HD1  PHE  35           2HD      PHE  35  -3.361  10.054  -1.810
  259    HD2  PHE  35           1HD      PHE  35  -6.539   8.564  -4.189
  260    HE1  PHE  35           2HE      PHE  35  -1.766   9.507  -3.587
  261    HE2  PHE  35           1HE      PHE  35  -5.009   8.029  -5.968
  262    HZ   PHE  35           HZ       PHE  35  -2.576   8.482  -5.699
  263    H    CYS  36           H        CYS  36  -5.686  13.166  -3.199
  264    HA   CYS  36           HA       CYS  36  -3.408  13.537  -1.410
  265    HB2  CYS  36           2HB      CYS  36  -2.960  13.576  -3.793
  266    HB3  CYS  36           1HB      CYS  36  -4.077  14.927  -4.016
  267    H    HIS  37           H        HIS  37  -3.772  14.555   0.320
  268    HA   HIS  37           HA       HIS  37  -5.439  16.922   0.134
  269    HB2  HIS  37           2HB      HIS  37  -4.985  15.064   2.477
  270    HB3  HIS  37           1HB      HIS  37  -5.641  16.682   2.685
  271    HD1  HIS  37           1HD      HIS  37  -8.120  16.497   3.005
  272    HD2  HIS  37           2HD      HIS  37  -6.695  13.751   0.231
  273    HE1  HIS  37           1HE      HIS  37 -10.145  15.253   2.160
  274    H    CYS  38           H        CYS  38  -3.643  17.872  -0.743
  275    HA   CYS  38           HA       CYS  38  -1.716  18.719   1.282
  276    HB2  CYS  38           2HB      CYS  38  -0.725  17.630  -0.725
  277    HB3  CYS  38           1HB      CYS  38  -1.439  18.886  -1.730
  278    H    ARG  39           H        ARG  39  -1.330  20.953   1.511
  279    HA   ARG  39           HA       ARG  39  -3.596  22.598   0.593
  280    HB2  ARG  39           2HB      ARG  39  -1.786  22.963   2.945
  281    HB3  ARG  39           1HB      ARG  39  -3.094  24.055   2.511
  282    HG2  ARG  39           2HG      ARG  39  -4.730  22.284   2.909
  283    HG3  ARG  39           1HG      ARG  39  -3.431  21.154   3.288
  284    HD2  ARG  39           2HD      ARG  39  -4.419  21.963   5.347
  285    HD3  ARG  39           1HD      ARG  39  -2.784  22.586   5.191
  286    HE   ARG  39           HE       ARG  39  -4.589  24.451   4.133
  287   HH11  ARG  39          1HH1      ARG  39  -3.652  23.112   7.280
  288   HH12  ARG  39          2HH1      ARG  39  -4.000  24.512   8.150
  289   HH21  ARG  39          1HH2      ARG  39  -5.083  26.391   5.312
  290   HH22  ARG  39          2HH2      ARG  39  -4.847  26.453   6.998
  Start of MODEL    2
    1    H1   HIS   1           H        HIS   1 -18.602 -10.081 -15.594
    2    HA   HIS   1           HA       HIS   1 -17.334  -8.129 -16.903
    3    HB2  HIS   1           2HB      HIS   1 -16.791  -6.416 -15.170
    4    HB3  HIS   1           1HB      HIS   1 -18.485  -6.396 -15.626
    5    HD1  HIS   1           1HD      HIS   1 -16.224  -6.906 -12.670
    6    HD2  HIS   1           2HD      HIS   1 -20.259  -7.313 -13.615
    7    HE1  HIS   1           1HE      HIS   1 -17.434  -7.104 -10.481
    8    H    GLY   2           H        GLY   2 -15.131  -8.215 -16.572
    9    HA2  GLY   2           2HA      GLY   2 -13.171  -8.803 -15.440
   10    HA3  GLY   2           1HA      GLY   2 -14.122  -9.783 -14.330
   11    H    GLU   3           H        GLU   3 -11.980 -10.915 -15.148
   12    HA   GLU   3           HA       GLU   3 -11.044 -12.715 -16.016
   13    HB2  GLU   3           2HB      GLU   3 -13.148 -13.848 -15.358
   14    HB3  GLU   3           1HB      GLU   3 -13.820 -13.470 -16.936
   15    HG2  GLU   3           2HG      GLU   3 -12.268 -14.901 -18.023
   16    HG3  GLU   3           1HG      GLU   3 -11.379 -15.158 -16.523
   17    H    GLY   4           H        GLY   4  -9.712 -12.738 -17.622
   18    HA2  GLY   4           2HA      GLY   4  -8.975 -12.656 -19.845
   19    HA3  GLY   4           1HA      GLY   4 -10.601 -12.157 -20.333
   20    H    THR   5           H        THR   5 -11.248 -10.078 -19.149
   21    HA   THR   5           HA       THR   5  -9.210  -8.074 -19.653
   22    HB   THR   5           HB       THR   5 -12.172  -7.822 -19.022
   23    HG1  THR   5           1HG      THR   5 -11.895  -7.043 -21.412
   24   HG21  THR   5          3HG2      THR   5 -11.921  -5.492 -19.812
   25   HG22  THR   5          1HG2      THR   5 -10.190  -5.754 -20.017
   26   HG23  THR   5          2HG2      THR   5 -10.903  -5.803 -18.407
   27    H    PHE   6           H        PHE   6  -7.954  -7.798 -17.918
   28    HA   PHE   6           HA       PHE   6  -9.214  -7.761 -15.287
   29    HB2  PHE   6           2HB      PHE   6  -6.332  -8.393 -16.002
   30    HB3  PHE   6           1HB      PHE   6  -6.995  -8.366 -14.375
   31    HD1  PHE   6           1HD      PHE   6  -8.864 -10.043 -13.834
   32    HD2  PHE   6           2HD      PHE   6  -6.376 -10.355 -17.271
   33    HE1  PHE   6           1HE      PHE   6  -9.425 -12.427 -14.014
   34    HE2  PHE   6           2HE      PHE   6  -6.934 -12.741 -17.463
   35    HZ   PHE   6           HZ       PHE   6  -8.463 -13.787 -15.829
   36    H    THR   7           H        THR   7  -9.501  -5.760 -14.692
   37    HA   THR   7           HA       THR   7  -7.911  -3.677 -15.906
   38    HB   THR   7           HB       THR   7 -10.291  -3.334 -16.029
   39    HG1  THR   7           1HG      THR   7  -9.422  -1.393 -15.777
   40   HG21  THR   7          3HG2      THR   7 -11.019  -4.702 -14.131
   41   HG22  THR   7          1HG2      THR   7 -11.722  -3.087 -14.038
   42   HG23  THR   7          2HG2      THR   7 -10.355  -3.513 -13.010
   43    H    SER   8           H        SER   8  -6.411  -2.578 -14.904
   44    HA   SER   8           HA       SER   8  -5.978  -3.075 -12.063
   45    HB2  SER   8           2HB      SER   8  -4.148  -3.643 -13.658
   46    HB3  SER   8           1HB      SER   8  -4.098  -1.961 -14.168
   47    HG   SER   8           HG       SER   8  -3.389  -1.367 -12.129
   48    H    ASP   9           H        ASP   9  -5.649  -1.302 -10.702
   49    HA   ASP   9           HA       ASP   9  -5.791   0.789  -9.857
   50    HB2  ASP   9           2HB      ASP   9  -5.321   1.543 -12.725
   51    HB3  ASP   9           1HB      ASP   9  -5.395   2.737 -11.422
   52    H    LEU  10           H        LEU  10  -8.104  -0.675 -10.963
   53    HA   LEU  10           HA       LEU  10  -9.992   1.358 -11.744
   54    HB2  LEU  10           2HB      LEU  10 -10.053  -1.102 -12.443
   55    HB3  LEU  10           1HB      LEU  10 -10.499  -1.487 -10.804
   56    HG   LEU  10           HG       LEU  10 -12.390  -1.572 -12.396
   57   HD11  LEU  10          1HD1      LEU  10 -12.724   0.546 -10.295
   58   HD12  LEU  10          2HD1      LEU  10 -12.912  -1.194 -10.077
   59   HD13  LEU  10          3HD1      LEU  10 -14.029  -0.309 -11.117
   60   HD21  LEU  10          3HD2      LEU  10 -13.337   0.483 -13.309
   61   HD22  LEU  10          1HD2      LEU  10 -11.707   0.191 -13.909
   62   HD23  LEU  10          2HD2      LEU  10 -11.982   1.404 -12.656
   63    H    SER  11           H        SER  11  -9.245  -0.606  -8.896
   64    HA   SER  11           HA       SER  11 -10.977   0.976  -7.218
   65    HB2  SER  11           2HB      SER  11 -10.001  -0.582  -5.474
   66    HB3  SER  11           1HB      SER  11 -10.890  -1.378  -6.779
   67    HG   SER  11           HG       SER  11  -8.958  -2.440  -6.438
   68    H    LYS  12           H        LYS  12  -7.863   0.954  -8.440
   69    HA   LYS  12           HA       LYS  12  -5.926   2.073  -8.165
   70    HB2  LYS  12           2HB      LYS  12  -7.688   3.856  -8.303
   71    HB3  LYS  12           1HB      LYS  12  -7.545   3.985  -6.553
   72    HG2  LYS  12           2HG      LYS  12  -5.073   4.327  -6.953
   73    HG3  LYS  12           1HG      LYS  12  -5.511   4.574  -8.649
   74    HD2  LYS  12           2HD      LYS  12  -5.526   6.700  -7.710
   75    HD3  LYS  12           1HD      LYS  12  -7.197   6.054  -7.849
   76    HE2  LYS  12           2HE      LYS  12  -6.674   7.257  -5.657
   77    HE3  LYS  12           1HE      LYS  12  -7.420   5.671  -5.547
   78    HZ1  LYS  12           3HZ      LYS  12  -4.492   6.195  -5.281
   79    HZ2  LYS  12           1HZ      LYS  12  -5.281   4.718  -5.046
   80    HZ3  LYS  12           2HZ      LYS  12  -5.587   5.993  -3.983
   81    H    GLN  13           H        GLN  13  -6.711   0.185  -6.302
   82    HA   GLN  13           HA       GLN  13  -5.750   0.911  -3.678
   83    HB2  GLN  13           2HB      GLN  13  -7.740  -0.456  -3.959
   84    HB3  GLN  13           1HB      GLN  13  -6.825  -1.635  -4.877
   85    HG2  GLN  13           2HG      GLN  13  -5.486  -2.093  -2.959
   86    HG3  GLN  13           1HG      GLN  13  -6.419  -0.922  -2.014
   87   HE21  GLN  13          1HE2      GLN  13  -7.101  -2.506  -0.577
   88   HE22  GLN  13          2HE2      GLN  13  -8.273  -3.705  -0.985
   89    H    MET  14           H        MET  14  -4.615  -0.400  -6.605
   90    HA   MET  14           HA       MET  14  -2.573  -2.140  -5.773
   91    HB2  MET  14           2HB      MET  14  -3.474  -1.982  -8.053
   92    HB3  MET  14           1HB      MET  14  -2.684  -0.429  -8.259
   93    HG2  MET  14           2HG      MET  14  -1.426  -2.171  -9.357
   94    HG3  MET  14           1HG      MET  14  -0.506  -1.526  -7.997
   95    HE1  MET  14           3HE      MET  14   1.082  -3.654  -8.261
   96    HE2  MET  14           1HE      MET  14   0.059  -4.259  -9.562
   97    HE3  MET  14           2HE      MET  14   0.498  -5.320  -8.224
   98    H    GLU  15           H        GLU  15  -2.744   1.278  -5.815
   99    HA   GLU  15           HA       GLU  15   0.142   1.612  -5.368
  100    HB2  GLU  15           2HB      GLU  15  -0.377   4.030  -5.600
  101    HB3  GLU  15           1HB      GLU  15  -0.737   3.094  -7.045
  102    HG2  GLU  15           2HG      GLU  15  -3.095   3.090  -6.485
  103    HG3  GLU  15           1HG      GLU  15  -2.758   3.942  -4.984
  104    H    GLU  16           H        GLU  16   0.787   2.967  -3.631
  105    HA   GLU  16           HA       GLU  16  -0.950   2.658  -1.312
  106    HB2  GLU  16           2HB      GLU  16   1.484   1.860  -1.353
  107    HB3  GLU  16           1HB      GLU  16   1.907   3.570  -1.378
  108    HG2  GLU  16           2HG      GLU  16   0.860   3.911   0.750
  109    HG3  GLU  16           1HG      GLU  16   0.289   2.242   0.773
  110    H    GLU  17           H        GLU  17  -1.705   4.501  -0.221
  111    HA   GLU  17           HA       GLU  17  -1.504   6.814  -1.834
  112    HB2  GLU  17           2HB      GLU  17  -3.476   6.036   0.325
  113    HB3  GLU  17           1HB      GLU  17  -3.568   7.469  -0.698
  114    HG2  GLU  17           2HG      GLU  17  -3.778   6.048  -2.682
  115    HG3  GLU  17           1HG      GLU  17  -3.682   4.617  -1.668
  116    H    ALA  18           H        ALA  18  -1.673   8.633  -0.556
  117    HA   ALA  18           HA       ALA  18  -0.499  10.296   0.551
  118    HB1  ALA  18           1HB      ALA  18   0.066   9.967   2.888
  119    HB2  ALA  18           2HB      ALA  18  -0.024   8.214   2.687
  120    HB3  ALA  18           3HB      ALA  18  -1.485   9.193   2.543
  121    H    VAL  19           H        VAL  19   0.854   7.860  -0.853
  122    HA   VAL  19           HA       VAL  19   3.652   8.712  -0.504
  123    HB   VAL  19           HB       VAL  19   2.445   6.370  -2.036
  124   HG11  VAL  19          1HG1      VAL  19   5.350   6.996  -1.520
  125   HG12  VAL  19          2HG1      VAL  19   4.513   7.121  -3.069
  126   HG13  VAL  19          3HG1      VAL  19   4.721   5.545  -2.307
  127   HG21  VAL  19          3HG2      VAL  19   3.979   6.404   0.556
  128   HG22  VAL  19          1HG2      VAL  19   3.447   4.961  -0.310
  129   HG23  VAL  19          2HG2      VAL  19   2.255   6.074   0.359
  130    H    ARG  20           H        ARG  20   1.105   8.142  -2.790
  131    HA   ARG  20           HA       ARG  20   2.213   9.064  -5.190
  132    HB2  ARG  20           2HB      ARG  20  -0.658   9.173  -4.268
  133    HB3  ARG  20           1HB      ARG  20  -0.129   9.209  -5.935
  134    HG2  ARG  20           2HG      ARG  20   0.285   6.900  -4.033
  135    HG3  ARG  20           1HG      ARG  20  -1.008   7.021  -5.223
  136    HD2  ARG  20           2HD      ARG  20   1.910   7.128  -5.964
  137    HD3  ARG  20           1HD      ARG  20   1.005   5.622  -5.877
  138    HE   ARG  20           HE       ARG  20  -0.401   7.448  -7.458
  139   HH11  ARG  20          1HH1      ARG  20   2.553   5.506  -7.601
  140   HH12  ARG  20          2HH1      ARG  20   2.492   5.285  -9.279
  141   HH21  ARG  20          1HH2      ARG  20  -0.500   7.109  -9.734
  142   HH22  ARG  20          2HH2      ARG  20   0.694   6.206 -10.535
  143    H    CYS  21           H        CYS  21   0.905  10.727  -2.489
  144    HA   CYS  21           HA       CYS  21   0.848  13.322  -3.850
  145    HB2  CYS  21           2HB      CYS  21  -1.293  12.872  -2.885
  146    HB3  CYS  21           1HB      CYS  21  -0.570  12.224  -1.423
  147    H    PHE  22           H        PHE  22   2.918  11.468  -2.076
  148    HA   PHE  22           HA       PHE  22   3.564  13.139   0.127
  149    HB2  PHE  22           2HB      PHE  22   3.996  10.699   0.025
  150    HB3  PHE  22           1HB      PHE  22   5.260  11.021  -1.162
  151    HD1  PHE  22           1HD      PHE  22   4.247  11.319   2.286
  152    HD2  PHE  22           2HD      PHE  22   7.396  11.927  -0.475
  153    HE1  PHE  22           1HE      PHE  22   5.812  11.633   4.159
  154    HE2  PHE  22           2HE      PHE  22   8.985  12.251   1.374
  155    HZ   PHE  22           HZ       PHE  22   8.191  12.104   3.703
  156    H    ILE  23           H        ILE  23   5.538  12.341  -2.720
  157    HA   ILE  23           HA       ILE  23   7.413  14.418  -2.211
  158    HB   ILE  23           HB       ILE  23   6.935  12.970  -4.855
  159   HG12  ILE  23          2HG1      ILE  23   9.129  11.767  -4.127
  160   HG13  ILE  23          1HG1      ILE  23   8.709  12.357  -2.523
  161   HG21  ILE  23          1HG2      ILE  23   9.208  13.671  -5.466
  162   HG22  ILE  23          2HG2      ILE  23   9.337  14.548  -3.944
  163   HG23  ILE  23          3HG2      ILE  23   8.164  15.060  -5.152
  164   HD11  ILE  23          3HD1      ILE  23   8.045  10.038  -2.876
  165   HD12  ILE  23          1HD1      ILE  23   6.992  10.542  -4.197
  166   HD13  ILE  23          2HD1      ILE  23   6.670  11.083  -2.546
  167    H    GLU  24           H        GLU  24   4.541  14.159  -3.895
  168    HA   GLU  24           HA       GLU  24   4.607  16.483  -5.500
  169    HB2  GLU  24           2HB      GLU  24   2.173  15.185  -4.306
  170    HB3  GLU  24           1HB      GLU  24   2.267  16.154  -5.771
  171    HG2  GLU  24           2HG      GLU  24   3.477  13.499  -5.286
  172    HG3  GLU  24           1HG      GLU  24   2.081  13.814  -6.303
  173    H    CYS  25           H        CYS  25   3.681  15.820  -2.237
  174    HA   CYS  25           HA       CYS  25   2.621  18.408  -1.717
  175    HB2  CYS  25           2HB      CYS  25   2.118  16.308  -0.407
  176    HB3  CYS  25           1HB      CYS  25   3.691  16.489   0.358
  177    H    LEU  26           H        LEU  26   5.813  16.939  -1.465
  178    HA   LEU  26           HA       LEU  26   7.032  19.213  -0.253
  179    HB2  LEU  26           2HB      LEU  26   8.185  16.972  -1.902
  180    HB3  LEU  26           1HB      LEU  26   9.171  18.338  -1.447
  181    HG   LEU  26           HG       LEU  26   9.661  16.567   0.036
  182   HD11  LEU  26          1HD1      LEU  26   9.609  18.732   1.055
  183   HD12  LEU  26          2HD1      LEU  26   9.127  17.483   2.199
  184   HD13  LEU  26          3HD1      LEU  26   7.907  18.524   1.478
  185   HD21  LEU  26          3HD2      LEU  26   7.995  15.479   1.459
  186   HD22  LEU  26          1HD2      LEU  26   7.692  15.186  -0.254
  187   HD23  LEU  26          2HD2      LEU  26   6.717  16.365   0.623
  188    H    LYS  27           H        LYS  27   6.221  18.378  -3.495
  189    HA   LYS  27           HA       LYS  27   7.605  20.528  -4.773
  190    HB2  LYS  27           2HB      LYS  27   5.188  18.953  -5.691
  191    HB3  LYS  27           1HB      LYS  27   6.080  20.079  -6.695
  192    HG2  LYS  27           2HG      LYS  27   8.035  18.666  -6.618
  193    HG3  LYS  27           1HG      LYS  27   7.241  17.582  -5.472
  194    HD2  LYS  27           2HD      LYS  27   5.525  17.060  -7.171
  195    HD3  LYS  27           1HD      LYS  27   6.333  18.143  -8.294
  196    HE2  LYS  27           2HE      LYS  27   8.252  16.740  -8.401
  197    HE3  LYS  27           1HE      LYS  27   7.682  15.754  -7.057
  198    HZ1  LYS  27           3HZ      LYS  27   6.325  15.935  -9.709
  199    HZ2  LYS  27           1HZ      LYS  27   5.878  14.984  -8.384
  200    HZ3  LYS  27           2HZ      LYS  27   7.308  14.659  -9.196
  201    H    GLY  28           H        GLY  28   4.226  20.039  -3.877
  202    HA2  GLY  28           2HA      GLY  28   2.907  21.791  -2.875
  203    HA3  GLY  28           1HA      GLY  28   3.862  22.977  -3.768
  204    H    ILE  29           H        ILE  29   1.229  20.782  -3.866
  205    HA   ILE  29           HA       ILE  29   0.544  21.834  -6.361
  206    HB   ILE  29           HB       ILE  29  -0.228  19.556  -7.184
  207   HG12  ILE  29          2HG1      ILE  29   1.165  17.611  -6.361
  208   HG13  ILE  29          1HG1      ILE  29   1.524  18.562  -4.921
  209   HG21  ILE  29          1HG2      ILE  29   1.978  18.881  -8.019
  210   HG22  ILE  29          2HG2      ILE  29   2.700  20.023  -6.881
  211   HG23  ILE  29          3HG2      ILE  29   1.648  20.611  -8.169
  212   HD11  ILE  29          3HD1      ILE  29  -0.257  17.056  -4.401
  213   HD12  ILE  29          1HD1      ILE  29  -1.140  17.554  -5.864
  214   HD13  ILE  29          2HD1      ILE  29  -0.916  18.703  -4.569
  215    H    GLY  30           H        GLY  30  -1.114  22.494  -6.220
  216    HA2  GLY  30           2HA      GLY  30  -3.009  22.163  -4.064
  217    HA3  GLY  30           1HA      GLY  30  -3.259  23.219  -5.449
  218    H    HIS  31           H        HIS  31  -3.657  20.105  -4.130
  219    HA   HIS  31           HA       HIS  31  -4.833  18.278  -4.584
  220    HB2  HIS  31           2HB      HIS  31  -6.562  20.340  -5.811
  221    HB3  HIS  31           1HB      HIS  31  -7.124  18.671  -5.557
  222    HD1  HIS  31           1HD      HIS  31  -7.817  18.122  -3.063
  223    HD2  HIS  31           2HD      HIS  31  -6.295  21.938  -3.639
  224    HE1  HIS  31           1HE      HIS  31  -8.284  19.392  -0.930
  225    H    LYS  32           H        LYS  32  -3.144  17.514  -5.953
  226    HA   LYS  32           HA       LYS  32  -3.800  17.429  -8.798
  227    HB2  LYS  32           2HB      LYS  32  -1.409  17.602  -8.115
  228    HB3  LYS  32           1HB      LYS  32  -1.544  16.054  -7.293
  229    HG2  LYS  32           2HG      LYS  32  -2.026  14.971  -9.446
  230    HG3  LYS  32           1HG      LYS  32  -1.818  16.517 -10.260
  231    HD2  LYS  32           2HD      LYS  32   0.304  15.071  -8.662
  232    HD3  LYS  32           1HD      LYS  32   0.174  15.069 -10.417
  233    HE2  LYS  32           2HE      LYS  32   0.438  17.541 -10.376
  234    HE3  LYS  32           1HE      LYS  32   0.698  17.434  -8.636
  235    HZ1  LYS  32           3HZ      LYS  32   2.663  16.039  -9.059
  236    HZ2  LYS  32           1HZ      LYS  32   2.810  17.506  -9.886
  237    HZ3  LYS  32           2HZ      LYS  32   2.365  16.113 -10.698
  238    H    TYR  33           H        TYR  33  -4.433  15.723  -5.956
  239    HA   TYR  33           HA       TYR  33  -5.524  13.469  -7.460
  240    HB2  TYR  33           2HB      TYR  33  -4.134  13.138  -4.792
  241    HB3  TYR  33           1HB      TYR  33  -4.781  11.891  -5.812
  242    HD1  TYR  33           1HD      TYR  33  -2.039  14.330  -5.498
  243    HD2  TYR  33           2HD      TYR  33  -3.507  10.917  -7.553
  244    HE1  TYR  33           1HE      TYR  33   0.141  14.026  -6.494
  245    HE2  TYR  33           2HE      TYR  33  -1.316  10.580  -8.570
  246    HH   TYR  33           HH       TYR  33   1.440  12.172  -7.435
  247    HA   PRO  34           HA       PRO  34  -9.189  14.373  -4.963
  248    HB2  PRO  34           2HB      PRO  34  -9.307  11.399  -4.739
  249    HB3  PRO  34           1HB      PRO  34 -10.567  12.502  -5.267
  250    HG2  PRO  34           2HG      PRO  34  -9.291  11.026  -7.033
  251    HG3  PRO  34           1HG      PRO  34  -9.651  12.724  -7.399
  252    HD2  PRO  34           2HD      PRO  34  -7.077  11.455  -6.607
  253    HD3  PRO  34           1HD      PRO  34  -7.396  12.765  -7.763
  254    H    PHE  35           H        PHE  35  -7.002  11.859  -3.986
  255    HA   PHE  35           HA       PHE  35  -7.797  11.930  -1.185
  256    HB2  PHE  35           2HB      PHE  35  -6.485   9.804  -1.098
  257    HB3  PHE  35           1HB      PHE  35  -7.845   9.771  -2.221
  258    HD1  PHE  35           1HD      PHE  35  -7.404  10.036  -4.665
  259    HD2  PHE  35           2HD      PHE  35  -4.303   9.442  -1.843
  260    HE1  PHE  35           1HE      PHE  35  -5.955   9.450  -6.460
  261    HE2  PHE  35           2HE      PHE  35  -2.769   8.824  -3.622
  262    HZ   PHE  35           HZ       PHE  35  -3.561   8.809  -5.989
  263    H    CYS  36           H        CYS  36  -5.916  13.813  -2.723
  264    HA   CYS  36           HA       CYS  36  -3.471  13.363  -1.216
  265    HB2  CYS  36           2HB      CYS  36  -3.086  13.894  -3.489
  266    HB3  CYS  36           1HB      CYS  36  -4.134  15.311  -3.451
  267    H    HIS  37           H        HIS  37  -3.255  14.223   0.674
  268    HA   HIS  37           HA       HIS  37  -5.134  16.244   1.606
  269    HB2  HIS  37           2HB      HIS  37  -3.240  14.379   3.032
  270    HB3  HIS  37           1HB      HIS  37  -4.169  15.615   3.863
  271    HD1  HIS  37           1HD      HIS  37  -6.323  14.757   4.813
  272    HD2  HIS  37           2HD      HIS  37  -5.048  12.509   1.555
  273    HE1  HIS  37           1HE      HIS  37  -7.963  12.846   4.583
  274    H    CYS  38           H        CYS  38  -3.026  17.187  -0.132
  275    HA   CYS  38           HA       CYS  38  -1.249  18.504   1.785
  276    HB2  CYS  38           2HB      CYS  38  -0.235  17.214  -0.131
  277    HB3  CYS  38           1HB      CYS  38  -0.935  18.404  -1.219
  278    H    ARG  39           H        ARG  39  -4.083  19.048   0.500
  279    HA   ARG  39           HA       ARG  39  -5.383  20.782  -0.159
  280    HB2  ARG  39           2HB      ARG  39  -3.411  22.272   1.530
  281    HB3  ARG  39           1HB      ARG  39  -4.790  23.069   0.783
  282    HG2  ARG  39           2HG      ARG  39  -5.450  22.619   3.008
  283    HG3  ARG  39           1HG      ARG  39  -6.246  21.398   2.023
  284    HD2  ARG  39           2HD      ARG  39  -5.405  20.340   3.993
  285    HD3  ARG  39           1HD      ARG  39  -4.404  19.820   2.635
  286    HE   ARG  39           HE       ARG  39  -3.152  22.010   3.693
  287   HH11  ARG  39          1HH1      ARG  39  -4.052  18.805   4.894
  288   HH12  ARG  39          2HH1      ARG  39  -2.848  18.759   6.103
  289   HH21  ARG  39          1HH2      ARG  39  -1.479  21.928   5.352
  290   HH22  ARG  39          2HH2      ARG  39  -1.346  20.555   6.347
  Start of MODEL    3
    1    H1   HIS   1           H        HIS   1  -5.828   3.817  25.045
    2    HA   HIS   1           HA       HIS   1  -6.685   6.113  23.857
    3    HB2  HIS   1           2HB      HIS   1  -5.786   6.566  26.714
    4    HB3  HIS   1           1HB      HIS   1  -5.914   7.827  25.497
    5    HD1  HIS   1           1HD      HIS   1  -7.721   6.624  28.272
    6    HD2  HIS   1           2HD      HIS   1  -8.772   7.737  24.409
    7    HE1  HIS   1           1HE      HIS   1 -10.175   7.194  28.354
    8    H    GLY   2           H        GLY   2  -4.860   7.505  23.320
    9    HA2  GLY   2           2HA      GLY   2  -2.549   7.959  23.283
   10    HA3  GLY   2           1HA      GLY   2  -2.239   6.305  23.804
   11    H    GLU   3           H        GLU   3  -0.978   7.485  21.624
   12    HA   GLU   3           HA       GLU   3  -1.725   5.656  19.517
   13    HB2  GLU   3           2HB      GLU   3  -2.973   7.922  19.250
   14    HB3  GLU   3           1HB      GLU   3  -1.395   8.614  18.953
   15    HG2  GLU   3           2HG      GLU   3  -2.748   6.497  17.285
   16    HG3  GLU   3           1HG      GLU   3  -2.623   8.204  16.892
   17    H    GLY   4           H        GLY   4   0.230   4.756  19.081
   18    HA2  GLY   4           2HA      GLY   4   2.570   6.518  19.086
   19    HA3  GLY   4           1HA      GLY   4   2.600   5.057  20.063
   20    H    THR   5           H        THR   5   0.996   5.231  16.959
   21    HA   THR   5           HA       THR   5   3.128   3.546  15.945
   22    HB   THR   5           HB       THR   5   1.237   2.497  14.517
   23    HG1  THR   5           1HG      THR   5  -0.224   4.192  15.987
   24   HG21  THR   5          3HG2      THR   5   0.788   0.822  16.279
   25   HG22  THR   5          1HG2      THR   5   1.445   1.930  17.482
   26   HG23  THR   5          2HG2      THR   5   2.490   1.271  16.225
   27    H    PHE   6           H        PHE   6   4.191   4.628  14.490
   28    HA   PHE   6           HA       PHE   6   2.710   6.293  12.592
   29    HB2  PHE   6           2HB      PHE   6   4.341   7.425  14.244
   30    HB3  PHE   6           1HB      PHE   6   5.621   6.585  13.385
   31    HD1  PHE   6           1HD      PHE   6   3.091   9.211  13.206
   32    HD2  PHE   6           2HD      PHE   6   6.311   7.317  11.195
   33    HE1  PHE   6           1HE      PHE   6   3.187  11.072  11.628
   34    HE2  PHE   6           2HE      PHE   6   6.414   9.175   9.592
   35    HZ   PHE   6           HZ       PHE   6   4.852  11.065   9.801
   36    H    THR   7           H        THR   7   2.786   5.451  10.563
   37    HA   THR   7           HA       THR   7   4.739   3.323  10.108
   38    HB   THR   7           HB       THR   7   1.942   3.586   8.977
   39    HG1  THR   7           1HG      THR   7   1.820   3.165  11.114
   40   HG21  THR   7          3HG2      THR   7   3.890   1.282   8.977
   41   HG22  THR   7          1HG2      THR   7   3.519   2.300   7.585
   42   HG23  THR   7          2HG2      THR   7   2.266   1.272   8.285
   43    H    SER   8           H        SER   8   6.249   3.985   8.705
   44    HA   SER   8           HA       SER   8   5.398   5.589   6.394
   45    HB2  SER   8           2HB      SER   8   8.101   5.726   7.743
   46    HB3  SER   8           1HB      SER   8   7.468   6.795   6.492
   47    HG   SER   8           HG       SER   8   5.782   7.298   8.074
   48    H    ASP   9           H        ASP   9   5.230   3.822   4.996
   49    HA   ASP   9           HA       ASP   9   5.907   2.248   3.486
   50    HB2  ASP   9           2HB      ASP   9   8.611   3.400   4.106
   51    HB3  ASP   9           1HB      ASP   9   8.337   2.228   2.820
   52    H    LEU  10           H        LEU  10   5.750   1.569   6.318
   53    HA   LEU  10           HA       LEU  10   8.029   0.023   7.093
   54    HB2  LEU  10           2HB      LEU  10   6.321   1.098   8.615
   55    HB3  LEU  10           1HB      LEU  10   5.180  -0.107   8.092
   56    HG   LEU  10           HG       LEU  10   7.708  -0.800   9.606
   57   HD11  LEU  10          1HD1      LEU  10   6.341   0.735  10.922
   58   HD12  LEU  10          2HD1      LEU  10   6.288  -0.892  11.595
   59   HD13  LEU  10          3HD1      LEU  10   4.927  -0.284  10.654
   60   HD21  LEU  10          3HD2      LEU  10   6.494  -2.858  10.145
   61   HD22  LEU  10          1HD2      LEU  10   6.627  -2.667   8.397
   62   HD23  LEU  10          2HD2      LEU  10   5.106  -2.301   9.208
   63    H    SER  11           H        SER  11   4.798  -0.839   5.965
   64    HA   SER  11           HA       SER  11   5.944  -3.303   4.867
   65    HB2  SER  11           2HB      SER  11   3.032  -2.644   5.340
   66    HB3  SER  11           1HB      SER  11   3.708  -4.210   4.887
   67    HG   SER  11           HG       SER  11   3.803  -2.838   7.304
   68    H    LYS  12           H        LYS  12   4.841  -0.221   4.263
   69    HA   LYS  12           HA       LYS  12   4.399   1.088   2.523
   70    HB2  LYS  12           2HB      LYS  12   6.541  -0.033   1.752
   71    HB3  LYS  12           1HB      LYS  12   5.537  -1.100   0.786
   72    HG2  LYS  12           2HG      LYS  12   4.763   0.720  -0.541
   73    HG3  LYS  12           1HG      LYS  12   5.553   1.891   0.523
   74    HD2  LYS  12           2HD      LYS  12   7.695   0.858   0.006
   75    HD3  LYS  12           1HD      LYS  12   6.870  -0.216  -1.128
   76    HE2  LYS  12           2HE      LYS  12   7.942   1.747  -2.240
   77    HE3  LYS  12           1HE      LYS  12   6.200   1.659  -2.498
   78    HZ1  LYS  12           3HZ      LYS  12   7.204   3.891  -1.909
   79    HZ2  LYS  12           1HZ      LYS  12   7.362   3.334  -0.332
   80    HZ3  LYS  12           2HZ      LYS  12   5.846   3.434  -1.037
   81    H    GLN  13           H        GLN  13   2.666  -0.961   3.405
   82    HA   GLN  13           HA       GLN  13   0.938  -1.546   1.115
   83    HB2  GLN  13           2HB      GLN  13   0.899  -2.527   3.961
   84    HB3  GLN  13           1HB      GLN  13  -0.389  -2.866   2.825
   85    HG2  GLN  13           2HG      GLN  13   2.483  -3.638   2.409
   86    HG3  GLN  13           1HG      GLN  13   1.259  -4.692   3.112
   87   HE21  GLN  13          1HE2      GLN  13   1.355  -6.196   1.503
   88   HE22  GLN  13          2HE2      GLN  13   0.775  -5.888  -0.094
   89    H    MET  14           H        MET  14   0.936   0.196   4.151
   90    HA   MET  14           HA       MET  14  -1.798   0.926   4.107
   91    HB2  MET  14           2HB      MET  14  -0.529   0.964   6.194
   92    HB3  MET  14           1HB      MET  14   0.536   2.206   5.547
   93    HG2  MET  14           2HG      MET  14  -1.331   3.764   5.439
   94    HG3  MET  14           1HG      MET  14  -2.416   2.525   6.056
   95    HE1  MET  14           3HE      MET  14  -2.159   5.086   8.987
   96    HE2  MET  14           1HE      MET  14  -3.242   4.206   7.908
   97    HE3  MET  14           2HE      MET  14  -2.145   5.423   7.257
   98    H    GLU  15           H        GLU  15   1.155   2.565   3.161
   99    HA   GLU  15           HA       GLU  15  -0.348   4.799   2.259
  100    HB2  GLU  15           2HB      GLU  15   1.885   5.739   1.576
  101    HB3  GLU  15           1HB      GLU  15   1.575   5.528   3.287
  102    HG2  GLU  15           2HG      GLU  15   3.037   3.529   1.659
  103    HG3  GLU  15           1HG      GLU  15   3.854   4.919   2.404
  104    H    GLU  16           H        GLU  16  -1.535   3.541   0.830
  105    HA   GLU  16           HA       GLU  16  -0.316   3.157  -1.795
  106    HB2  GLU  16           2HB      GLU  16  -2.599   2.473  -2.468
  107    HB3  GLU  16           1HB      GLU  16  -1.999   1.556  -1.088
  108    HG2  GLU  16           2HG      GLU  16  -3.344   2.908   0.413
  109    HG3  GLU  16           1HG      GLU  16  -3.904   3.880  -0.940
  110    H    GLU  17           H        GLU  17  -1.798   5.481   0.078
  111    HA   GLU  17           HA       GLU  17  -2.249   7.300  -2.130
  112    HB2  GLU  17           2HB      GLU  17  -3.990   8.264  -0.708
  113    HB3  GLU  17           1HB      GLU  17  -4.372   6.572  -1.038
  114    HG2  GLU  17           2HG      GLU  17  -3.598   5.924   1.138
  115    HG3  GLU  17           1HG      GLU  17  -3.016   7.551   1.461
  116    H    ALA  18           H        ALA  18  -2.373   9.342  -0.884
  117    HA   ALA  18           HA       ALA  18  -1.182  11.165  -0.157
  118    HB1  ALA  18           1HB      ALA  18  -0.772  11.220   2.199
  119    HB2  ALA  18           2HB      ALA  18  -0.827   9.456   2.272
  120    HB3  ALA  18           3HB      ALA  18  -2.282  10.368   1.845
  121    H    VAL  19           H        VAL  19   0.691   8.576  -0.931
  122    HA   VAL  19           HA       VAL  19   3.112  10.091  -0.321
  123    HB   VAL  19           HB       VAL  19   4.371   8.010  -0.994
  124   HG11  VAL  19          1HG1      VAL  19   3.990   8.553   1.335
  125   HG12  VAL  19          2HG1      VAL  19   3.820   6.807   1.111
  126   HG13  VAL  19          3HG1      VAL  19   2.388   7.825   1.269
  127   HG21  VAL  19          3HG2      VAL  19   3.138   5.900  -1.031
  128   HG22  VAL  19          1HG2      VAL  19   2.623   6.970  -2.344
  129   HG23  VAL  19          2HG2      VAL  19   1.620   6.797  -0.898
  130    H    ARG  20           H        ARG  20   1.242   8.700  -2.814
  131    HA   ARG  20           HA       ARG  20   2.675   9.682  -5.034
  132    HB2  ARG  20           2HB      ARG  20  -0.018   8.689  -4.433
  133    HB3  ARG  20           1HB      ARG  20   0.056   9.614  -5.903
  134    HG2  ARG  20           2HG      ARG  20   1.656   7.128  -5.224
  135    HG3  ARG  20           1HG      ARG  20   0.232   7.200  -6.261
  136    HD2  ARG  20           2HD      ARG  20   2.188   7.106  -7.679
  137    HD3  ARG  20           1HD      ARG  20   1.497   8.722  -7.787
  138    HE   ARG  20           HE       ARG  20   3.693   8.240  -5.933
  139   HH11  ARG  20          1HH1      ARG  20   2.619   9.724  -8.970
  140   HH12  ARG  20          2HH1      ARG  20   3.972  10.727  -9.140
  141   HH21  ARG  20          1HH2      ARG  20   5.579   9.611  -6.159
  142   HH22  ARG  20          2HH2      ARG  20   5.717  10.672  -7.472
  143    H    CYS  21           H        CYS  21   0.993  11.137  -2.616
  144    HA   CYS  21           HA       CYS  21   0.575  13.660  -4.049
  145    HB2  CYS  21           2HB      CYS  21  -1.413  12.902  -2.935
  146    HB3  CYS  21           1HB      CYS  21  -0.519  12.579  -1.460
  147    H    PHE  22           H        PHE  22   2.318  12.051  -1.475
  148    HA   PHE  22           HA       PHE  22   3.061  14.147   0.160
  149    HB2  PHE  22           2HB      PHE  22   3.227  11.730   0.610
  150    HB3  PHE  22           1HB      PHE  22   4.648  11.651  -0.442
  151    HD1  PHE  22           2HD      PHE  22   3.226  12.706   2.660
  152    HD2  PHE  22           1HD      PHE  22   6.728  12.568   0.338
  153    HE1  PHE  22           2HE      PHE  22   4.524  13.272   4.654
  154    HE2  PHE  22           1HE      PHE  22   8.096  13.139   2.307
  155    HZ   PHE  22           HZ       PHE  22   6.989  13.498   4.494
  156    H    ILE  23           H        ILE  23   4.990  12.575  -2.353
  157    HA   ILE  23           HA       ILE  23   7.193  14.336  -2.166
  158    HB   ILE  23           HB       ILE  23   6.400  12.622  -4.548
  159   HG12  ILE  23          2HG1      ILE  23   6.453  11.278  -2.466
  160   HG13  ILE  23          1HG1      ILE  23   7.740  10.830  -3.576
  161   HG21  ILE  23          1HG2      ILE  23   9.098  13.617  -3.633
  162   HG22  ILE  23          2HG2      ILE  23   8.188  14.214  -5.022
  163   HG23  ILE  23          3HG2      ILE  23   8.807  12.563  -5.020
  164   HD11  ILE  23          3HD1      ILE  23   9.333  12.086  -2.251
  165   HD12  ILE  23          1HD1      ILE  23   8.512  10.881  -1.265
  166   HD13  ILE  23          2HD1      ILE  23   8.059  12.587  -1.150
  167    H    GLU  24           H        GLU  24   4.207  14.547  -3.805
  168    HA   GLU  24           HA       GLU  24   5.102  16.457  -5.784
  169    HB2  GLU  24           2HB      GLU  24   2.303  15.541  -5.158
  170    HB3  GLU  24           1HB      GLU  24   2.876  16.292  -6.645
  171    HG2  GLU  24           2HG      GLU  24   3.656  13.626  -5.569
  172    HG3  GLU  24           1HG      GLU  24   2.563  13.905  -6.921
  173    H    CYS  25           H        CYS  25   3.098  16.340  -2.944
  174    HA   CYS  25           HA       CYS  25   2.424  19.095  -2.857
  175    HB2  CYS  25           2HB      CYS  25   1.156  17.400  -1.638
  176    HB3  CYS  25           1HB      CYS  25   2.546  17.036  -0.631
  177    H    LEU  26           H        LEU  26   5.144  17.218  -1.839
  178    HA   LEU  26           HA       LEU  26   6.519  19.036  -0.215
  179    HB2  LEU  26           2HB      LEU  26   7.110  16.677  -0.442
  180    HB3  LEU  26           1HB      LEU  26   7.508  16.916  -2.125
  181    HG   LEU  26           HG       LEU  26   9.419  18.339  -1.440
  182   HD11  LEU  26          1HD1      LEU  26  10.144  18.329   0.875
  183   HD12  LEU  26          2HD1      LEU  26   8.691  17.451   1.344
  184   HD13  LEU  26          3HD1      LEU  26   8.565  19.098   0.716
  185   HD21  LEU  26          3HD2      LEU  26  10.800  16.497  -0.617
  186   HD22  LEU  26          1HD2      LEU  26   9.736  15.980  -1.923
  187   HD23  LEU  26          2HD2      LEU  26   9.346  15.571  -0.253
  188    H    LYS  27           H        LYS  27   6.112  18.785  -3.661
  189    HA   LYS  27           HA       LYS  27   8.081  20.825  -4.288
  190    HB2  LYS  27           2HB      LYS  27   5.935  19.586  -6.034
  191    HB3  LYS  27           1HB      LYS  27   7.258  20.596  -6.592
  192    HG2  LYS  27           2HG      LYS  27   8.856  18.889  -5.927
  193    HG3  LYS  27           1HG      LYS  27   7.537  17.885  -5.320
  194    HD2  LYS  27           2HD      LYS  27   6.578  17.788  -7.575
  195    HD3  LYS  27           1HD      LYS  27   7.906  18.780  -8.180
  196    HE2  LYS  27           2HE      LYS  27   8.321  16.437  -8.656
  197    HE3  LYS  27           1HE      LYS  27   9.496  17.046  -7.497
  198    HZ1  LYS  27           3HZ      LYS  27   7.116  15.351  -6.853
  199    HZ2  LYS  27           1HZ      LYS  27   8.179  16.033  -5.716
  200    HZ3  LYS  27           2HZ      LYS  27   8.741  14.920  -6.821
  201    H    GLY  28           H        GLY  28   4.574  20.424  -4.579
  202    HA2  GLY  28           2HA      GLY  28   3.410  22.321  -3.287
  203    HA3  GLY  28           1HA      GLY  28   4.219  23.363  -4.431
  204    H    ILE  29           H        ILE  29   2.058  20.557  -4.310
  205    HA   ILE  29           HA       ILE  29   0.520  21.915  -6.213
  206    HB   ILE  29           HB       ILE  29  -0.020  19.870  -7.473
  207   HG12  ILE  29          2HG1      ILE  29   1.732  17.924  -7.331
  208   HG13  ILE  29          1HG1      ILE  29   1.979  18.507  -5.692
  209   HG21  ILE  29          1HG2      ILE  29   1.624  21.270  -8.448
  210   HG22  ILE  29          2HG2      ILE  29   1.992  19.583  -8.810
  211   HG23  ILE  29          3HG2      ILE  29   2.909  20.441  -7.570
  212   HD11  ILE  29          3HD1      ILE  29  -0.599  17.489  -6.877
  213   HD12  ILE  29          1HD1      ILE  29  -0.434  18.141  -5.253
  214   HD13  ILE  29          2HD1      ILE  29   0.413  16.657  -5.695
  215    H    GLY  30           H        GLY  30  -1.156  22.057  -5.457
  216    HA2  GLY  30           2HA      GLY  30  -2.136  20.962  -3.024
  217    HA3  GLY  30           1HA      GLY  30  -3.133  21.832  -4.178
  218    H    HIS  31           H        HIS  31  -4.844  20.652  -4.532
  219    HA   HIS  31           HA       HIS  31  -4.779  17.796  -4.263
  220    HB2  HIS  31           2HB      HIS  31  -6.685  19.170  -3.405
  221    HB3  HIS  31           1HB      HIS  31  -7.111  19.554  -5.066
  222    HD1  HIS  31           1HD      HIS  31  -8.657  17.889  -6.237
  223    HD2  HIS  31           2HD      HIS  31  -6.957  16.399  -2.750
  224    HE1  HIS  31           1HE      HIS  31  -9.760  15.656  -5.813
  225    H    LYS  32           H        LYS  32  -3.538  17.129  -5.913
  226    HA   LYS  32           HA       LYS  32  -4.535  17.463  -8.656
  227    HB2  LYS  32           2HB      LYS  32  -2.140  17.718  -8.293
  228    HB3  LYS  32           1HB      LYS  32  -2.049  16.096  -7.622
  229    HG2  LYS  32           2HG      LYS  32  -2.686  15.161  -9.796
  230    HG3  LYS  32           1HG      LYS  32  -2.791  16.793 -10.455
  231    HD2  LYS  32           2HD      LYS  32  -0.275  15.582  -9.292
  232    HD3  LYS  32           1HD      LYS  32  -0.660  15.600 -11.010
  233    HE2  LYS  32           2HE      LYS  32  -0.358  18.066  -9.277
  234    HE3  LYS  32           1HE      LYS  32   0.887  17.418 -10.333
  235    HZ1  LYS  32           3HZ      LYS  32  -1.777  18.332 -11.260
  236    HZ2  LYS  32           1HZ      LYS  32  -0.503  17.811 -12.222
  237    HZ3  LYS  32           2HZ      LYS  32  -0.364  19.245 -11.346
  238    H    TYR  33           H        TYR  33  -3.981  15.039  -6.242
  239    HA   TYR  33           HA       TYR  33  -5.242  12.977  -7.911
  240    HB2  TYR  33           2HB      TYR  33  -3.677  12.640  -5.334
  241    HB3  TYR  33           1HB      TYR  33  -4.201  11.374  -6.397
  242    HD1  TYR  33           2HD      TYR  33  -1.906  14.279  -6.159
  243    HD2  TYR  33           1HD      TYR  33  -2.819  10.676  -8.235
  244    HE1  TYR  33           2HE      TYR  33   0.183  14.462  -7.330
  245    HE2  TYR  33           1HE      TYR  33  -0.683  10.825  -9.421
  246    HH   TYR  33           HH       TYR  33   1.795  12.988  -8.496
  247    HA   PRO  34           HA       PRO  34  -8.988  13.186  -5.412
  248    HB2  PRO  34           2HB      PRO  34  -9.398  10.429  -5.144
  249    HB3  PRO  34           1HB      PRO  34  -9.944  11.402  -6.509
  250    HG2  PRO  34           2HG      PRO  34  -7.501   9.720  -6.251
  251    HG3  PRO  34           1HG      PRO  34  -8.593   9.918  -7.634
  252    HD2  PRO  34           2HD      PRO  34  -6.248  11.124  -7.603
  253    HD3  PRO  34           1HD      PRO  34  -7.683  11.994  -8.196
  254    H    PHE  35           H        PHE  35  -6.416  11.081  -4.472
  255    HA   PHE  35           HA       PHE  35  -7.219  11.123  -1.657
  256    HB2  PHE  35           2HB      PHE  35  -5.538   9.254  -1.473
  257    HB3  PHE  35           1HB      PHE  35  -6.968   8.928  -2.452
  258    HD1  PHE  35           2HD      PHE  35  -3.382   9.709  -2.601
  259    HD2  PHE  35           1HD      PHE  35  -6.818   8.466  -4.732
  260    HE1  PHE  35           2HE      PHE  35  -1.972   9.155  -4.502
  261    HE2  PHE  35           1HE      PHE  35  -5.480   7.924  -6.655
  262    HZ   PHE  35           HZ       PHE  35  -3.004   8.241  -6.585
  263    H    CYS  36           H        CYS  36  -5.760  13.211  -3.277
  264    HA   CYS  36           HA       CYS  36  -3.278  13.279  -1.778
  265    HB2  CYS  36           2HB      CYS  36  -3.022  13.813  -4.076
  266    HB3  CYS  36           1HB      CYS  36  -4.253  15.060  -4.059
  267    H    HIS  37           H        HIS  37  -3.733  13.693   0.179
  268    HA   HIS  37           HA       HIS  37  -5.726  15.688   0.834
  269    HB2  HIS  37           2HB      HIS  37  -4.419  13.589   2.572
  270    HB3  HIS  37           1HB      HIS  37  -5.737  14.651   3.064
  271    HD1  HIS  37           1HD      HIS  37  -5.404  11.268   2.220
  272    HD2  HIS  37           2HD      HIS  37  -7.887  14.293   0.818
  273    HE1  HIS  37           1HE      HIS  37  -7.320  10.116   1.112
  274    H    CYS  38           H        CYS  38  -2.819  16.160   0.056
  275    HA   CYS  38           HA       CYS  38  -1.940  17.561   2.471
  276    HB2  CYS  38           2HB      CYS  38  -0.326  15.944   1.454
  277    HB3  CYS  38           1HB      CYS  38  -0.370  16.881  -0.028
  278    H    ARG  39           H        ARG  39  -1.410  19.759   2.315
  279    HA   ARG  39           HA       ARG  39  -1.799  21.167  -0.128
  280    HB2  ARG  39           2HB      ARG  39  -3.561  22.690   0.679
  281    HB3  ARG  39           1HB      ARG  39  -4.127  21.046   0.474
  282    HG2  ARG  39           2HG      ARG  39  -3.343  22.164   3.163
  283    HG3  ARG  39           1HG      ARG  39  -4.974  22.329   2.518
  284    HD2  ARG  39           2HD      ARG  39  -5.125  19.863   2.386
  285    HD3  ARG  39           1HD      ARG  39  -3.510  19.745   3.082
  286    HE   ARG  39           HE       ARG  39  -4.863  21.255   4.858
  287   HH11  ARG  39          1HH1      ARG  39  -5.449  18.013   3.473
  288   HH12  ARG  39          2HH1      ARG  39  -6.350  17.477   4.810
  289   HH21  ARG  39          1HH2      ARG  39  -6.085  20.419   6.717
  290   HH22  ARG  39          2HH2      ARG  39  -6.702  18.822   6.650
  Start of MODEL    4
    1    H1   HIS   1           H        HIS   1  10.380 -12.322  -3.794
    2    HA   HIS   1           HA       HIS   1  10.735 -10.854  -1.441
    3    HB2  HIS   1           2HB      HIS   1  12.958 -12.763  -2.245
    4    HB3  HIS   1           1HB      HIS   1  13.103 -11.481  -1.056
    5    HD1  HIS   1           1HD      HIS   1  12.281 -15.019  -1.363
    6    HD2  HIS   1           2HD      HIS   1  11.427 -11.936   1.287
    7    HE1  HIS   1           1HE      HIS   1  11.498 -16.130   0.758
    8    H    GLY   2           H        GLY   2  12.861  -9.500  -1.884
    9    HA2  GLY   2           2HA      GLY   2  14.289  -8.579  -3.553
   10    HA3  GLY   2           1HA      GLY   2  13.100  -9.044  -4.764
   11    H    GLU   3           H        GLU   3  14.175  -6.483  -4.565
   12    HA   GLU   3           HA       GLU   3  11.760  -4.944  -4.250
   13    HB2  GLU   3           2HB      GLU   3  12.944  -4.814  -2.028
   14    HB3  GLU   3           1HB      GLU   3  14.357  -4.194  -2.861
   15    HG2  GLU   3           2HG      GLU   3  13.045  -2.238  -3.588
   16    HG3  GLU   3           1HG      GLU   3  11.663  -2.857  -2.690
   17    H    GLY   4           H        GLY   4  11.998  -2.949  -5.461
   18    HA2  GLY   4           2HA      GLY   4  13.731  -1.602  -6.698
   19    HA3  GLY   4           1HA      GLY   4  14.177  -3.140  -7.431
   20    H    THR   5           H        THR   5  11.051  -3.584  -7.117
   21    HA   THR   5           HA       THR   5  10.486  -2.496  -9.739
   22    HB   THR   5           HB       THR   5   8.462  -4.087  -9.389
   23    HG1  THR   5           1HG      THR   5   9.464  -5.855  -7.918
   24   HG21  THR   5          3HG2      THR   5  11.266  -5.179  -9.580
   25   HG22  THR   5          1HG2      THR   5  10.328  -4.531 -10.926
   26   HG23  THR   5          2HG2      THR   5   9.801  -6.007 -10.108
   27    H    PHE   6           H        PHE   6   9.627  -0.504  -9.571
   28    HA   PHE   6           HA       PHE   6   7.552  -0.045  -7.559
   29    HB2  PHE   6           2HB      PHE   6   9.385   1.988  -8.845
   30    HB3  PHE   6           1HB      PHE   6   8.190   2.308  -7.597
   31    HD1  PHE   6           1HD      PHE   6   8.530   1.128  -5.328
   32    HD2  PHE   6           2HD      PHE   6  11.566   1.474  -8.279
   33    HE1  PHE   6           1HE      PHE   6  10.257   0.723  -3.614
   34    HE2  PHE   6           2HE      PHE   6  13.281   1.075  -6.566
   35    HZ   PHE   6           HZ       PHE   6  12.620   0.698  -4.232
   36    H    THR   7           H        THR   7   5.576   0.273  -8.437
   37    HA   THR   7           HA       THR   7   5.493   1.374 -11.133
   38    HB   THR   7           HB       THR   7   3.394  -0.157 -11.422
   39    HG1  THR   7           1HG      THR   7   4.887  -1.772  -9.647
   40   HG21  THR   7          3HG2      THR   7   6.187  -1.302 -11.557
   41   HG22  THR   7          1HG2      THR   7   5.401  -0.336 -12.806
   42   HG23  THR   7          2HG2      THR   7   4.774  -1.936 -12.405
   43    H    SER   8           H        SER   8   4.624   3.321 -10.867
   44    HA   SER   8           HA       SER   8   2.691   3.761  -8.807
   45    HB2  SER   8           2HB      SER   8   3.933   5.630 -10.823
   46    HB3  SER   8           1HB      SER   8   2.871   6.124  -9.497
   47    HG   SER   8           HG       SER   8   4.366   4.996  -8.122
   48    H    ASP   9           H        ASP   9   0.968   2.679  -9.362
   49    HA   ASP   9           HA       ASP   9  -1.130   2.381 -10.118
   50    HB2  ASP   9           2HB      ASP   9  -1.324   4.862 -10.030
   51    HB3  ASP   9           1HB      ASP   9  -0.731   4.951 -11.678
   52    H    LEU  10           H        LEU  10   1.466   2.103 -11.911
   53    HA   LEU  10           HA       LEU  10   0.405   1.452 -14.476
   54    HB2  LEU  10           2HB      LEU  10   2.810   2.106 -13.928
   55    HB3  LEU  10           1HB      LEU  10   3.020   0.516 -13.251
   56    HG   LEU  10           HG       LEU  10   2.352   0.983 -16.167
   57   HD11  LEU  10          1HD1      LEU  10   4.733   0.642 -16.600
   58   HD12  LEU  10          2HD1      LEU  10   5.044   0.596 -14.865
   59   HD13  LEU  10          3HD1      LEU  10   4.458   2.079 -15.618
   60   HD21  LEU  10          3HD2      LEU  10   3.231  -1.278 -16.464
   61   HD22  LEU  10          1HD2      LEU  10   1.891  -1.287 -15.318
   62   HD23  LEU  10          2HD2      LEU  10   3.552  -1.395 -14.734
   63    H    SER  11           H        SER  11   1.312  -0.466 -11.592
   64    HA   SER  11           HA       SER  11   0.171  -2.860 -12.752
   65    HB2  SER  11           2HB      SER  11   0.785  -3.775 -10.495
   66    HB3  SER  11           1HB      SER  11   2.151  -3.049 -11.356
   67    HG   SER  11           HG       SER  11   2.383  -1.819  -9.694
   68    H    LYS  12           H        LYS  12  -0.652  -0.151 -11.009
   69    HA   LYS  12           HA       LYS  12  -2.357   0.718  -9.879
   70    HB2  LYS  12           2HB      LYS  12  -3.312  -0.003 -12.156
   71    HB3  LYS  12           1HB      LYS  12  -4.181  -1.226 -11.233
   72    HG2  LYS  12           2HG      LYS  12  -5.220   0.491  -9.890
   73    HG3  LYS  12           1HG      LYS  12  -4.305   1.734 -10.746
   74    HD2  LYS  12           2HD      LYS  12  -5.324   0.926 -12.833
   75    HD3  LYS  12           1HD      LYS  12  -6.358  -0.120 -11.851
   76    HE2  LYS  12           2HE      LYS  12  -7.562   1.931 -12.382
   77    HE3  LYS  12           1HE      LYS  12  -7.201   1.868 -10.657
   78    HZ1  LYS  12           3HZ      LYS  12  -5.780   3.472 -12.719
   79    HZ2  LYS  12           1HZ      LYS  12  -5.245   3.349 -11.130
   80    HZ3  LYS  12           2HZ      LYS  12  -6.723   4.064 -11.468
   81    H    GLN  13           H        GLN  13  -1.109  -1.680  -8.871
   82    HA   GLN  13           HA       GLN  13  -2.997  -2.300  -6.710
   83    HB2  GLN  13           2HB      GLN  13  -1.383  -4.304  -8.280
   84    HB3  GLN  13           1HB      GLN  13  -2.099  -4.656  -6.717
   85    HG2  GLN  13           2HG      GLN  13  -3.680  -3.755  -9.102
   86    HG3  GLN  13           1HG      GLN  13  -3.411  -5.449  -8.699
   87   HE21  GLN  13          1HE2      GLN  13  -5.033  -2.519  -7.814
   88   HE22  GLN  13          2HE2      GLN  13  -6.103  -3.248  -6.668
   89    H    MET  14           H        MET  14   0.384  -2.756  -7.807
   90    HA   MET  14           HA       MET  14   1.191  -2.589  -5.059
   91    HB2  MET  14           2HB      MET  14   2.287  -4.269  -6.462
   92    HB3  MET  14           1HB      MET  14   2.884  -3.005  -7.529
   93    HG2  MET  14           2HG      MET  14   4.193  -2.065  -5.695
   94    HG3  MET  14           1HG      MET  14   3.596  -3.322  -4.621
   95    HE1  MET  14           3HE      MET  14   3.643  -5.903  -6.491
   96    HE2  MET  14           1HE      MET  14   4.205  -5.854  -4.816
   97    HE3  MET  14           2HE      MET  14   5.236  -6.529  -6.074
   98    H    GLU  15           H        GLU  15   0.401  -0.521  -4.810
   99    HA   GLU  15           HA       GLU  15   2.462   1.396  -4.834
  100    HB2  GLU  15           2HB      GLU  15   1.545   1.755  -7.146
  101    HB3  GLU  15           1HB      GLU  15  -0.051   1.999  -6.455
  102    HG2  GLU  15           2HG      GLU  15   1.051   4.108  -7.074
  103    HG3  GLU  15           1HG      GLU  15   0.688   4.015  -5.353
  104    H    GLU  16           H        GLU  16   1.908   3.039  -3.333
  105    HA   GLU  16           HA       GLU  16  -0.372   2.277  -1.651
  106    HB2  GLU  16           2HB      GLU  16   1.819   1.773  -0.679
  107    HB3  GLU  16           1HB      GLU  16   2.334   3.425  -0.940
  108    HG2  GLU  16           2HG      GLU  16   1.809   2.922   1.365
  109    HG3  GLU  16           1HG      GLU  16   0.799   4.215   0.720
  110    H    GLU  17           H        GLU  17  -1.372   4.168  -0.438
  111    HA   GLU  17           HA       GLU  17  -1.344   6.484  -2.124
  112    HB2  GLU  17           2HB      GLU  17  -3.182   5.607   0.132
  113    HB3  GLU  17           1HB      GLU  17  -3.301   7.148  -0.677
  114    HG2  GLU  17           2HG      GLU  17  -4.992   5.745  -1.544
  115    HG3  GLU  17           1HG      GLU  17  -3.773   5.938  -2.794
  116    H    ALA  18           H        ALA  18  -1.996   8.195  -0.343
  117    HA   ALA  18           HA       ALA  18  -0.980  10.008   0.661
  118    HB1  ALA  18           1HB      ALA  18  -0.271   9.631   2.938
  119    HB2  ALA  18           2HB      ALA  18  -0.079   7.908   2.623
  120    HB3  ALA  18           3HB      ALA  18  -1.684   8.637   2.578
  121    H    VAL  19           H        VAL  19   1.062   7.879  -0.831
  122    HA   VAL  19           HA       VAL  19   3.339   9.584  -0.251
  123    HB   VAL  19           HB       VAL  19   3.750   7.152   0.031
  124   HG11  VAL  19          1HG1      VAL  19   3.204   6.954  -2.905
  125   HG12  VAL  19          2HG1      VAL  19   2.228   6.266  -1.601
  126   HG13  VAL  19          3HG1      VAL  19   3.869   5.666  -1.894
  127   HG21  VAL  19          3HG2      VAL  19   5.598   8.587  -0.544
  128   HG22  VAL  19          1HG2      VAL  19   5.245   8.379  -2.260
  129   HG23  VAL  19          2HG2      VAL  19   5.795   6.998  -1.300
  130    H    ARG  20           H        ARG  20   1.167   8.466  -2.693
  131    HA   ARG  20           HA       ARG  20   2.322   9.585  -4.994
  132    HB2  ARG  20           2HB      ARG  20  -0.550   9.014  -4.281
  133    HB3  ARG  20           1HB      ARG  20  -0.062   9.469  -5.890
  134    HG2  ARG  20           2HG      ARG  20   0.722   6.967  -4.391
  135    HG3  ARG  20           1HG      ARG  20  -0.399   7.095  -5.747
  136    HD2  ARG  20           2HD      ARG  20   2.541   7.745  -5.863
  137    HD3  ARG  20           1HD      ARG  20   1.825   6.232  -6.402
  138    HE   ARG  20           HE       ARG  20   0.481   7.847  -7.935
  139   HH11  ARG  20          1HH1      ARG  20   3.925   8.093  -7.113
  140   HH12  ARG  20          2HH1      ARG  20   4.311   8.940  -8.546
  141   HH21  ARG  20          1HH2      ARG  20   1.076   8.919  -9.894
  142   HH22  ARG  20          2HH2      ARG  20   2.690   9.423 -10.137
  143    H    CYS  21           H        CYS  21   0.718  10.969  -2.384
  144    HA   CYS  21           HA       CYS  21   0.351  13.535  -3.762
  145    HB2  CYS  21           2HB      CYS  21  -1.668  12.794  -2.684
  146    HB3  CYS  21           1HB      CYS  21  -0.815  12.457  -1.186
  147    H    PHE  22           H        PHE  22   2.215  11.831  -1.467
  148    HA   PHE  22           HA       PHE  22   2.922  13.822   0.371
  149    HB2  PHE  22           2HB      PHE  22   3.136  11.363   0.654
  150    HB3  PHE  22           1HB      PHE  22   4.482  11.381  -0.478
  151    HD1  PHE  22           1HD      PHE  22   6.603  12.338   0.196
  152    HD2  PHE  22           2HD      PHE  22   3.328  12.078   2.846
  153    HE1  PHE  22           1HE      PHE  22   8.137  12.732   2.091
  154    HE2  PHE  22           2HE      PHE  22   4.824  12.473   4.767
  155    HZ   PHE  22           HZ       PHE  22   7.241  12.802   4.387
  156    H    ILE  23           H        ILE  23   4.878  12.375  -2.205
  157    HA   ILE  23           HA       ILE  23   7.021  14.163  -2.026
  158    HB   ILE  23           HB       ILE  23   6.105  12.509  -4.395
  159   HG12  ILE  23          2HG1      ILE  23   6.460  11.146  -2.384
  160   HG13  ILE  23          1HG1      ILE  23   7.679  10.807  -3.601
  161   HG21  ILE  23          1HG2      ILE  23   8.440  12.599  -5.146
  162   HG22  ILE  23          2HG2      ILE  23   8.810  13.701  -3.818
  163   HG23  ILE  23          3HG2      ILE  23   7.699  14.200  -5.093
  164   HD11  ILE  23          3HD1      ILE  23   9.291  12.157  -2.372
  165   HD12  ILE  23          1HD1      ILE  23   8.633  10.877  -1.358
  166   HD13  ILE  23          2HD1      ILE  23   8.076  12.541  -1.161
  167    H    GLU  24           H        GLU  24   4.126  14.196  -3.944
  168    HA   GLU  24           HA       GLU  24   4.761  16.326  -5.666
  169    HB2  GLU  24           2HB      GLU  24   2.019  15.501  -4.735
  170    HB3  GLU  24           1HB      GLU  24   2.458  16.358  -6.214
  171    HG2  GLU  24           2HG      GLU  24   3.164  13.577  -5.484
  172    HG3  GLU  24           1HG      GLU  24   1.926  14.053  -6.631
  173    H    CYS  25           H        CYS  25   3.020  16.138  -2.637
  174    HA   CYS  25           HA       CYS  25   2.349  18.882  -2.517
  175    HB2  CYS  25           2HB      CYS  25   1.159  17.153  -1.206
  176    HB3  CYS  25           1HB      CYS  25   2.576  16.961  -0.184
  177    H    LEU  26           H        LEU  26   5.189  17.110  -1.421
  178    HA   LEU  26           HA       LEU  26   6.308  19.262   0.039
  179    HB2  LEU  26           2HB      LEU  26   7.421  16.732  -1.079
  180    HB3  LEU  26           1HB      LEU  26   8.551  17.992  -0.643
  181    HG   LEU  26           HG       LEU  26   8.387  16.397   1.145
  182   HD11  LEU  26          1HD1      LEU  26   7.017  18.950   1.916
  183   HD12  LEU  26          2HD1      LEU  26   8.750  18.698   1.747
  184   HD13  LEU  26          3HD1      LEU  26   7.856  17.843   2.999
  185   HD21  LEU  26          3HD2      LEU  26   6.176  15.483   0.753
  186   HD22  LEU  26          1HD2      LEU  26   5.439  17.016   1.214
  187   HD23  LEU  26          2HD2      LEU  26   6.306  16.058   2.416
  188    H    LYS  27           H        LYS  27   6.025  18.698  -3.269
  189    HA   LYS  27           HA       LYS  27   7.994  20.736  -3.907
  190    HB2  LYS  27           2HB      LYS  27   6.218  19.025  -5.665
  191    HB3  LYS  27           1HB      LYS  27   7.376  20.202  -6.277
  192    HG2  LYS  27           2HG      LYS  27   9.217  18.968  -5.310
  193    HG3  LYS  27           1HG      LYS  27   8.098  17.843  -4.555
  194    HD2  LYS  27           2HD      LYS  27   8.336  18.225  -7.535
  195    HD3  LYS  27           1HD      LYS  27   9.210  16.985  -6.638
  196    HE2  LYS  27           2HE      LYS  27   7.002  16.131  -5.835
  197    HE3  LYS  27           1HE      LYS  27   6.228  17.297  -6.903
  198    HZ1  LYS  27           3HZ      LYS  27   7.157  16.195  -8.800
  199    HZ2  LYS  27           1HZ      LYS  27   6.369  15.074  -7.824
  200    HZ3  LYS  27           2HZ      LYS  27   8.049  15.128  -7.828
  201    H    GLY  28           H        GLY  28   4.544  20.126  -4.488
  202    HA2  GLY  28           2HA      GLY  28   3.206  22.088  -3.494
  203    HA3  GLY  28           1HA      GLY  28   4.102  23.032  -4.673
  204    H    ILE  29           H        ILE  29   1.427  20.965  -4.132
  205    HA   ILE  29           HA       ILE  29   0.690  21.367  -6.813
  206    HB   ILE  29           HB       ILE  29  -0.148  19.086  -7.114
  207   HG12  ILE  29          2HG1      ILE  29   0.870  17.246  -5.512
  208   HG13  ILE  29          1HG1      ILE  29   0.913  18.564  -4.350
  209   HG21  ILE  29          1HG2      ILE  29   2.776  18.972  -6.462
  210   HG22  ILE  29          2HG2      ILE  29   2.066  19.560  -7.956
  211   HG23  ILE  29          3HG2      ILE  29   1.894  17.862  -7.516
  212   HD11  ILE  29          3HD1      ILE  29  -1.066  17.186  -4.096
  213   HD12  ILE  29          1HD1      ILE  29  -1.531  17.513  -5.765
  214   HD13  ILE  29          2HD1      ILE  29  -1.501  18.821  -4.580
  215    H    GLY  30           H        GLY  30  -1.012  22.174  -6.704
  216    HA2  GLY  30           2HA      GLY  30  -2.842  21.949  -4.407
  217    HA3  GLY  30           1HA      GLY  30  -3.051  23.082  -5.739
  218    H    HIS  31           H        HIS  31  -4.044  20.133  -4.400
  219    HA   HIS  31           HA       HIS  31  -5.407  18.458  -4.980
  220    HB2  HIS  31           2HB      HIS  31  -6.545  20.794  -6.391
  221    HB3  HIS  31           1HB      HIS  31  -7.349  19.225  -6.525
  222    HD1  HIS  31           1HD      HIS  31  -6.581  21.999  -4.096
  223    HD2  HIS  31           2HD      HIS  31  -8.717  18.446  -4.275
  224    HE1  HIS  31           1HE      HIS  31  -7.985  21.935  -2.019
  225    H    LYS  32           H        LYS  32  -4.019  17.028  -6.027
  226    HA   LYS  32           HA       LYS  32  -4.539  16.950  -8.907
  227    HB2  LYS  32           2HB      LYS  32  -1.882  16.443  -7.592
  228    HB3  LYS  32           1HB      LYS  32  -2.234  15.938  -9.234
  229    HG2  LYS  32           2HG      LYS  32  -2.217  18.752  -8.175
  230    HG3  LYS  32           1HG      LYS  32  -1.019  18.011  -9.247
  231    HD2  LYS  32           2HD      LYS  32  -2.802  17.703 -10.967
  232    HD3  LYS  32           1HD      LYS  32  -3.940  18.512  -9.900
  233    HE2  LYS  32           2HE      LYS  32  -1.495  19.737 -11.168
  234    HE3  LYS  32           1HE      LYS  32  -3.172  20.019 -11.614
  235    HZ1  LYS  32           3HZ      LYS  32  -2.461  21.836 -10.284
  236    HZ2  LYS  32           1HZ      LYS  32  -1.809  20.818  -9.119
  237    HZ3  LYS  32           2HZ      LYS  32  -3.481  20.927  -9.305
  238    H    TYR  33           H        TYR  33  -5.000  15.282  -6.107
  239    HA   TYR  33           HA       TYR  33  -5.619  12.887  -7.599
  240    HB2  TYR  33           2HB      TYR  33  -3.932  12.681  -5.051
  241    HB3  TYR  33           1HB      TYR  33  -4.561  11.370  -5.994
  242    HD1  TYR  33           1HD      TYR  33  -2.006  14.092  -6.031
  243    HD2  TYR  33           2HD      TYR  33  -3.438  10.531  -7.915
  244    HE1  TYR  33           1HE      TYR  33   0.030  13.967  -7.335
  245    HE2  TYR  33           2HE      TYR  33  -1.388  10.411  -9.227
  246    HH   TYR  33           HH       TYR  33   1.366  12.060  -8.541
  247    HA   PRO  34           HA       PRO  34  -9.377  13.086  -5.256
  248    HB2  PRO  34           2HB      PRO  34  -8.969  10.223  -4.591
  249    HB3  PRO  34           1HB      PRO  34 -10.353  10.995  -5.356
  250    HG2  PRO  34           2HG      PRO  34  -8.579   9.497  -6.715
  251    HG3  PRO  34           1HG      PRO  34  -9.436  10.855  -7.442
  252    HD2  PRO  34           2HD      PRO  34  -6.605  10.606  -6.676
  253    HD3  PRO  34           1HD      PRO  34  -7.364  11.693  -7.851
  254    H    PHE  35           H        PHE  35  -6.971  11.015  -3.868
  255    HA   PHE  35           HA       PHE  35  -7.839  11.455  -1.154
  256    HB2  PHE  35           2HB      PHE  35  -6.140   9.648  -0.712
  257    HB3  PHE  35           1HB      PHE  35  -7.484   9.208  -1.763
  258    HD1  PHE  35           1HD      PHE  35  -7.143   8.824  -4.158
  259    HD2  PHE  35           2HD      PHE  35  -3.907   9.812  -1.575
  260    HE1  PHE  35           1HE      PHE  35  -5.586   8.116  -5.868
  261    HE2  PHE  35           2HE      PHE  35  -2.321   9.102  -3.284
  262    HZ   PHE  35           HZ       PHE  35  -3.147   8.243  -5.465
  263    H    CYS  36           H        CYS  36  -6.159  13.349  -2.971
  264    HA   CYS  36           HA       CYS  36  -3.793  13.578  -1.268
  265    HB2  CYS  36           2HB      CYS  36  -3.315  13.577  -3.594
  266    HB3  CYS  36           1HB      CYS  36  -4.438  14.914  -3.898
  267    H    HIS  37           H        HIS  37  -4.047  14.648   0.441
  268    HA   HIS  37           HA       HIS  37  -5.497  17.159   0.258
  269    HB2  HIS  37           2HB      HIS  37  -5.042  15.425   2.704
  270    HB3  HIS  37           1HB      HIS  37  -5.805  17.008   2.726
  271    HD1  HIS  37           1HD      HIS  37  -8.324  17.030   2.377
  272    HD2  HIS  37           2HD      HIS  37  -6.570  13.420   1.313
  273    HE1  HIS  37           1HE      HIS  37 -10.229  15.443   1.885
  274    H    CYS  38           H        CYS  38  -3.537  17.916  -0.682
  275    HA   CYS  38           HA       CYS  38  -1.134  18.067   0.833
  276    HB2  CYS  38           2HB      CYS  38  -1.150  18.307  -1.636
  277    HB3  CYS  38           1HB      CYS  38  -2.063  19.809  -1.491
  278    H    ARG  39           H        ARG  39  -0.273  20.427   1.351
  279    HA   ARG  39           HA       ARG  39  -2.387  22.023   2.547
  280    HB2  ARG  39           2HB      ARG  39  -1.477  21.844   4.787
  281    HB3  ARG  39           1HB      ARG  39  -1.912  20.265   4.138
  282    HG2  ARG  39           2HG      ARG  39   0.513  19.949   3.534
  283    HG3  ARG  39           1HG      ARG  39   0.859  21.407   4.455
  284    HD2  ARG  39           2HD      ARG  39  -0.371  18.864   5.521
  285    HD3  ARG  39           1HD      ARG  39   1.278  19.421   5.779
  286    HE   ARG  39           HE       ARG  39  -0.463  21.392   6.674
  287   HH11  ARG  39          1HH1      ARG  39   0.640  18.146   7.561
  288   HH12  ARG  39          2HH1      ARG  39   0.210  18.264   9.191
  289   HH21  ARG  39          1HH2      ARG  39  -1.031  21.606   8.946
  290   HH22  ARG  39          2HH2      ARG  39  -0.764  20.293  10.002
  Start of MODEL    5
    1    H1   HIS   1           H        HIS   1  16.711  17.075   5.055
    2    HA   HIS   1           HA       HIS   1  15.595  19.178   3.545
    3    HB2  HIS   1           2HB      HIS   1  17.940  19.337   2.531
    4    HB3  HIS   1           1HB      HIS   1  17.813  19.579   4.260
    5    HD1  HIS   1           1HD      HIS   1  19.172  18.013   5.745
    6    HD2  HIS   1           2HD      HIS   1  19.172  16.917   1.740
    7    HE1  HIS   1           1HE      HIS   1  20.939  16.236   5.516
    8    H    GLY   2           H        GLY   2  14.871  16.301   3.065
    9    HA2  GLY   2           2HA      GLY   2  13.600  16.027   0.940
   10    HA3  GLY   2           1HA      GLY   2  15.099  16.449   0.123
   11    H    GLU   3           H        GLU   3  13.867  14.216  -0.610
   12    HA   GLU   3           HA       GLU   3  15.753  12.162   0.198
   13    HB2  GLU   3           2HB      GLU   3  13.793  11.703   1.602
   14    HB3  GLU   3           1HB      GLU   3  12.732  11.821   0.214
   15    HG2  GLU   3           2HG      GLU   3  13.059   9.503   0.894
   16    HG3  GLU   3           1HG      GLU   3  13.698   9.788  -0.720
   17    H    GLY   4           H        GLY   4  16.484  11.112  -1.570
   18    HA2  GLY   4           2HA      GLY   4  15.045  11.595  -4.101
   19    HA3  GLY   4           1HA      GLY   4  16.800  11.552  -3.972
   20    H    THR   5           H        THR   5  15.588   9.305  -1.913
   21    HA   THR   5           HA       THR   5  16.074   7.140  -3.815
   22    HB   THR   5           HB       THR   5  15.673   6.928  -0.836
   23    HG1  THR   5           1HG      THR   5  17.209   8.353  -0.951
   24   HG21  THR   5          3HG2      THR   5  17.153   4.972  -1.090
   25   HG22  THR   5          1HG2      THR   5  17.296   5.304  -2.816
   26   HG23  THR   5          2HG2      THR   5  15.739   4.835  -2.134
   27    H    PHE   6           H        PHE   6  14.177   6.530  -4.791
   28    HA   PHE   6           HA       PHE   6  11.746   6.498  -3.141
   29    HB2  PHE   6           2HB      PHE   6  11.923   6.765  -6.155
   30    HB3  PHE   6           1HB      PHE   6  10.471   6.892  -5.169
   31    HD1  PHE   6           1HD      PHE   6  10.295   8.825  -3.543
   32    HD2  PHE   6           2HD      PHE   6  13.256   8.638  -6.590
   33    HE1  PHE   6           1HE      PHE   6  10.668  11.245  -3.336
   34    HE2  PHE   6           2HE      PHE   6  13.625  11.059  -6.389
   35    HZ   PHE   6           HZ       PHE   6  12.327  12.366  -4.755
   36    H    THR   7           H        THR   7  11.531   4.421  -2.497
   37    HA   THR   7           HA       THR   7  11.624   2.435  -4.596
   38    HB   THR   7           HB       THR   7  13.757   2.207  -3.499
   39    HG1  THR   7           1HG      THR   7  13.446   0.051  -2.495
   40   HG21  THR   7          3HG2      THR   7  14.002   1.749  -1.103
   41   HG22  THR   7          1HG2      THR   7  12.259   1.936  -0.888
   42   HG23  THR   7          2HG2      THR   7  13.241   3.315  -1.380
   43    H    SER   8           H        SER   8  10.095   0.841  -4.451
   44    HA   SER   8           HA       SER   8   8.123   1.169  -2.301
   45    HB2  SER   8           2HB      SER   8   7.678   0.072  -5.091
   46    HB3  SER   8           1HB      SER   8   6.448   0.441  -3.884
   47    HG   SER   8           HG       SER   8   7.764   2.622  -4.092
   48    H    ASP   9           H        ASP   9   7.218  -0.732  -1.469
   49    HA   ASP   9           HA       ASP   9   7.055  -2.864  -0.752
   50    HB2  ASP   9           2HB      ASP   9   6.917  -3.468  -3.201
   51    HB3  ASP   9           1HB      ASP   9   8.658  -3.682  -3.200
   52    H    LEU  10           H        LEU  10   9.436  -1.064  -0.494
   53    HA   LEU  10           HA       LEU  10  11.568  -2.855   0.319
   54    HB2  LEU  10           2HB      LEU  10  11.888  -0.570  -0.777
   55    HB3  LEU  10           1HB      LEU  10  11.306   0.145   0.700
   56    HG   LEU  10           HG       LEU  10  13.746   0.293   0.422
   57   HD11  LEU  10          1HD1      LEU  10  12.885   0.399   2.651
   58   HD12  LEU  10          2HD1      LEU  10  14.426  -0.464   2.629
   59   HD13  LEU  10          3HD1      LEU  10  12.913  -1.361   2.778
   60   HD21  LEU  10          3HD2      LEU  10  13.707  -2.702   0.677
   61   HD22  LEU  10          1HD2      LEU  10  15.141  -1.676   0.660
   62   HD23  LEU  10          2HD2      LEU  10  14.113  -1.776  -0.769
   63    H    SER  11           H        SER  11   9.251  -0.628   1.726
   64    HA   SER  11           HA       SER  11   9.770  -1.547   4.423
   65    HB2  SER  11           2HB      SER  11   9.168   0.859   3.693
   66    HB3  SER  11           1HB      SER  11   7.532   0.260   3.447
   67    HG   SER  11           HG       SER  11   9.056   0.361   5.797
   68    H    LYS  12           H        LYS  12   7.990  -2.279   1.720
   69    HA   LYS  12           HA       LYS  12   6.404  -3.624   1.079
   70    HB2  LYS  12           2HB      LYS  12   8.128  -5.173   2.032
   71    HB3  LYS  12           1HB      LYS  12   7.010  -5.379   3.390
   72    HG2  LYS  12           2HG      LYS  12   5.284  -6.158   1.903
   73    HG3  LYS  12           1HG      LYS  12   6.329  -5.893   0.509
   74    HD2  LYS  12           2HD      LYS  12   7.916  -7.490   1.540
   75    HD3  LYS  12           1HD      LYS  12   6.653  -7.862   2.727
   76    HE2  LYS  12           2HE      LYS  12   6.537  -9.498   0.932
   77    HE3  LYS  12           1HE      LYS  12   5.128  -8.443   0.857
   78    HZ1  LYS  12           3HZ      LYS  12   6.013  -8.748  -1.341
   79    HZ2  LYS  12           1HZ      LYS  12   7.547  -8.291  -0.845
   80    HZ3  LYS  12           2HZ      LYS  12   6.338  -7.142  -0.907
   81    H    GLN  13           H        GLN  13   5.138  -1.878   1.824
   82    HA   GLN  13           HA       GLN  13   2.825  -2.993   3.210
   83    HB2  GLN  13           2HB      GLN  13   2.412  -0.856   4.299
   84    HB3  GLN  13           1HB      GLN  13   4.062  -1.392   4.623
   85    HG2  GLN  13           2HG      GLN  13   4.914   0.153   2.970
   86    HG3  GLN  13           1HG      GLN  13   3.272   0.689   2.614
   87   HE21  GLN  13          1HE2      GLN  13   3.672   2.783   3.219
   88   HE22  GLN  13          2HE2      GLN  13   3.894   3.243   4.869
   89    H    MET  14           H        MET  14   0.821  -1.568   2.481
   90    HA   MET  14           HA       MET  14   0.991  -1.445  -0.374
   91    HB2  MET  14           2HB      MET  14  -1.317  -0.871   1.499
   92    HB3  MET  14           1HB      MET  14  -1.430  -0.617  -0.231
   93    HG2  MET  14           2HG      MET  14  -2.419  -2.723   0.258
   94    HG3  MET  14           1HG      MET  14  -0.895  -3.024  -0.563
   95    HE1  MET  14           3HE      MET  14  -2.951  -3.314   2.731
   96    HE2  MET  14           1HE      MET  14  -1.726  -2.142   3.217
   97    HE3  MET  14           2HE      MET  14  -1.726  -3.757   3.921
   98    H    GLU  15           H        GLU  15   2.170   0.084  -1.128
   99    HA   GLU  15           HA       GLU  15   2.000   2.771  -0.029
  100    HB2  GLU  15           2HB      GLU  15   3.930   1.516  -1.971
  101    HB3  GLU  15           1HB      GLU  15   4.046   3.160  -1.363
  102    HG2  GLU  15           2HG      GLU  15   4.385   2.389   0.865
  103    HG3  GLU  15           1HG      GLU  15   4.036   0.731   0.392
  104    H    GLU  16           H        GLU  16   0.228   3.685  -0.868
  105    HA   GLU  16           HA       GLU  16   0.250   4.146  -3.726
  106    HB2  GLU  16           2HB      GLU  16  -1.265   2.255  -3.302
  107    HB3  GLU  16           1HB      GLU  16  -2.138   3.214  -2.129
  108    HG2  GLU  16           2HG      GLU  16  -2.957   4.668  -3.817
  109    HG3  GLU  16           1HG      GLU  16  -1.901   3.921  -5.021
  110    H    GLU  17           H        GLU  17  -2.024   4.889  -1.033
  111    HA   GLU  17           HA       GLU  17  -1.922   7.553  -1.889
  112    HB2  GLU  17           2HB      GLU  17  -3.828   7.821  -0.301
  113    HB3  GLU  17           1HB      GLU  17  -4.125   6.636  -1.549
  114    HG2  GLU  17           2HG      GLU  17  -3.608   4.849   0.083
  115    HG3  GLU  17           1HG      GLU  17  -3.454   6.087   1.333
  116    H    ALA  18           H        ALA  18  -1.542   8.982  -0.557
  117    HA   ALA  18           HA       ALA  18  -0.228  10.320   0.801
  118    HB1  ALA  18           1HB      ALA  18  -1.313   9.187   2.663
  119    HB2  ALA  18           2HB      ALA  18   0.373   9.563   3.050
  120    HB3  ALA  18           3HB      ALA  18  -0.097   7.911   2.609
  121    H    VAL  19           H        VAL  19   0.805   7.908  -0.910
  122    HA   VAL  19           HA       VAL  19   3.625   8.542  -0.453
  123    HB   VAL  19           HB       VAL  19   2.411   6.318  -2.140
  124   HG11  VAL  19          1HG1      VAL  19   5.270   6.846  -1.346
  125   HG12  VAL  19          2HG1      VAL  19   4.581   7.057  -2.956
  126   HG13  VAL  19          3HG1      VAL  19   4.701   5.440  -2.252
  127   HG21  VAL  19          3HG2      VAL  19   2.021   5.947   0.242
  128   HG22  VAL  19          1HG2      VAL  19   3.737   6.178   0.567
  129   HG23  VAL  19          2HG2      VAL  19   3.199   4.791  -0.381
  130    H    ARG  20           H        ARG  20   1.232   8.020  -2.982
  131    HA   ARG  20           HA       ARG  20   2.536   9.195  -5.140
  132    HB2  ARG  20           2HB      ARG  20  -0.361   8.866  -4.495
  133    HB3  ARG  20           1HB      ARG  20   0.129   9.433  -6.058
  134    HG2  ARG  20           2HG      ARG  20   0.688   6.759  -4.782
  135    HG3  ARG  20           1HG      ARG  20  -0.354   7.095  -6.162
  136    HD2  ARG  20           2HD      ARG  20   1.596   7.709  -7.501
  137    HD3  ARG  20           1HD      ARG  20   2.649   7.449  -6.110
  138    HE   ARG  20           HE       ARG  20   1.047   5.183  -6.773
  139   HH11  ARG  20          1HH1      ARG  20   4.130   6.798  -7.498
  140   HH12  ARG  20          2HH1      ARG  20   4.877   5.348  -8.019
  141   HH21  ARG  20          1HH2      ARG  20   2.127   3.255  -7.480
  142   HH22  ARG  20          2HH2      ARG  20   3.746   3.335  -8.012
  143    H    CYS  21           H        CYS  21   0.877  10.710  -2.536
  144    HA   CYS  21           HA       CYS  21   0.764  13.289  -3.917
  145    HB2  CYS  21           2HB      CYS  21  -1.321  12.720  -2.913
  146    HB3  CYS  21           1HB      CYS  21  -0.504  12.177  -1.454
  147    H    PHE  22           H        PHE  22   2.600  11.517  -1.670
  148    HA   PHE  22           HA       PHE  22   3.202  13.438   0.278
  149    HB2  PHE  22           2HB      PHE  22   3.534  10.951   0.383
  150    HB3  PHE  22           1HB      PHE  22   4.941  11.146  -0.633
  151    HD1  PHE  22           2HD      PHE  22   6.864  12.602   0.286
  152    HD2  PHE  22           1HD      PHE  22   3.630  11.169   2.619
  153    HE1  PHE  22           2HE      PHE  22   8.198  12.946   2.308
  154    HE2  PHE  22           1HE      PHE  22   4.952  11.493   4.668
  155    HZ   PHE  22           HZ       PHE  22   7.247  12.392   4.521
  156    H    ILE  23           H        ILE  23   5.186  12.324  -2.439
  157    HA   ILE  23           HA       ILE  23   7.190  14.277  -1.979
  158    HB   ILE  23           HB       ILE  23   6.746  12.657  -4.527
  159   HG12  ILE  23          2HG1      ILE  23   8.715  11.318  -3.637
  160   HG13  ILE  23          1HG1      ILE  23   8.391  12.095  -2.079
  161   HG21  ILE  23          1HG2      ILE  23   9.115  13.090  -4.959
  162   HG22  ILE  23          2HG2      ILE  23   9.162  14.142  -3.541
  163   HG23  ILE  23          3HG2      ILE  23   8.146  14.564  -4.923
  164   HD11  ILE  23          3HD1      ILE  23   7.494   9.834  -2.190
  165   HD12  ILE  23          1HD1      ILE  23   6.525  10.286  -3.598
  166   HD13  ILE  23          2HD1      ILE  23   6.219  11.041  -2.032
  167    H    GLU  24           H        GLU  24   4.397  14.112  -3.920
  168    HA   GLU  24           HA       GLU  24   4.881  16.414  -5.551
  169    HB2  GLU  24           2HB      GLU  24   2.137  15.457  -4.740
  170    HB3  GLU  24           1HB      GLU  24   2.594  16.393  -6.159
  171    HG2  GLU  24           2HG      GLU  24   3.138  13.566  -5.545
  172    HG3  GLU  24           1HG      GLU  24   2.142  14.209  -6.851
  173    H    CYS  25           H        CYS  25   3.299  15.893  -2.507
  174    HA   CYS  25           HA       CYS  25   2.360  18.520  -2.142
  175    HB2  CYS  25           2HB      CYS  25   1.565  16.550  -0.836
  176    HB3  CYS  25           1HB      CYS  25   3.102  16.543   0.023
  177    H    LEU  26           H        LEU  26   5.450  16.979  -1.417
  178    HA   LEU  26           HA       LEU  26   6.458  19.267  -0.091
  179    HB2  LEU  26           2HB      LEU  26   7.736  16.790  -1.141
  180    HB3  LEU  26           1HB      LEU  26   8.766  18.153  -0.756
  181    HG   LEU  26           HG       LEU  26   8.787  16.678   1.112
  182   HD11  LEU  26          1HD1      LEU  26   6.975  18.971   1.817
  183   HD12  LEU  26          2HD1      LEU  26   8.713  19.067   1.600
  184   HD13  LEU  26          3HD1      LEU  26   8.047  18.089   2.905
  185   HD21  LEU  26          3HD2      LEU  26   5.773  16.827   1.142
  186   HD22  LEU  26          1HD2      LEU  26   6.774  16.018   2.348
  187   HD23  LEU  26          2HD2      LEU  26   6.737  15.423   0.689
  188    H    LYS  27           H        LYS  27   6.014  18.574  -3.377
  189    HA   LYS  27           HA       LYS  27   7.810  20.650  -4.307
  190    HB2  LYS  27           2HB      LYS  27   5.421  19.423  -5.699
  191    HB3  LYS  27           1HB      LYS  27   6.581  20.496  -6.437
  192    HG2  LYS  27           2HG      LYS  27   8.308  18.731  -6.100
  193    HG3  LYS  27           1HG      LYS  27   7.014  17.660  -5.532
  194    HD2  LYS  27           2HD      LYS  27   5.801  18.000  -7.634
  195    HD3  LYS  27           1HD      LYS  27   7.082  19.062  -8.204
  196    HE2  LYS  27           2HE      LYS  27   7.346  16.927  -9.221
  197    HE3  LYS  27           1HE      LYS  27   8.648  17.143  -8.055
  198    HZ1  LYS  27           3HZ      LYS  27   7.467  15.738  -6.512
  199    HZ2  LYS  27           1HZ      LYS  27   7.663  14.942  -7.988
  200    HZ3  LYS  27           2HZ      LYS  27   6.162  15.586  -7.605
  201    H    GLY  28           H        GLY  28   4.353  20.189  -3.932
  202    HA2  GLY  28           2HA      GLY  28   2.973  21.983  -2.941
  203    HA3  GLY  28           1HA      GLY  28   3.893  23.117  -3.941
  204    H    ILE  29           H        ILE  29   1.199  21.061  -3.804
  205    HA   ILE  29           HA       ILE  29   0.818  21.546  -6.531
  206    HB   ILE  29           HB       ILE  29  -0.005  19.234  -6.904
  207   HG12  ILE  29          2HG1      ILE  29   1.163  17.452  -5.355
  208   HG13  ILE  29          1HG1      ILE  29   1.159  18.749  -4.172
  209   HG21  ILE  29          1HG2      ILE  29   2.103  19.875  -7.813
  210   HG22  ILE  29          2HG2      ILE  29   2.186  18.198  -7.273
  211   HG23  ILE  29          3HG2      ILE  29   2.922  19.475  -6.303
  212   HD11  ILE  29          3HD1      ILE  29  -1.237  17.545  -5.527
  213   HD12  ILE  29          1HD1      ILE  29  -1.269  18.882  -4.381
  214   HD13  ILE  29          2HD1      ILE  29  -0.728  17.281  -3.855
  215    H    GLY  30           H        GLY  30  -0.849  22.176  -6.746
  216    HA2  GLY  30           2HA      GLY  30  -3.073  22.297  -4.871
  217    HA3  GLY  30           1HA      GLY  30  -3.132  22.932  -6.512
  218    H    HIS  31           H        HIS  31  -4.200  20.554  -4.462
  219    HA   HIS  31           HA       HIS  31  -5.546  18.784  -4.567
  220    HB2  HIS  31           2HB      HIS  31  -7.090  20.206  -5.823
  221    HB3  HIS  31           1HB      HIS  31  -6.275  19.803  -7.327
  222    HD1  HIS  31           1HD      HIS  31  -7.308  17.839  -8.624
  223    HD2  HIS  31           2HD      HIS  31  -8.426  17.877  -4.619
  224    HE1  HIS  31           1HE      HIS  31  -8.933  15.956  -8.349
  225    H    LYS  32           H        LYS  32  -4.868  18.538  -7.890
  226    HA   LYS  32           HA       LYS  32  -4.150  16.865  -9.232
  227    HB2  LYS  32           2HB      LYS  32  -2.319  16.262  -6.931
  228    HB3  LYS  32           1HB      LYS  32  -2.275  15.406  -8.462
  229    HG2  LYS  32           2HG      LYS  32  -1.850  17.593  -9.587
  230    HG3  LYS  32           1HG      LYS  32  -1.730  18.325  -7.989
  231    HD2  LYS  32           2HD      LYS  32   0.485  17.803  -8.823
  232    HD3  LYS  32           1HD      LYS  32   0.109  16.786  -7.435
  233    HE2  LYS  32           2HE      LYS  32   1.213  15.490  -9.173
  234    HE3  LYS  32           1HE      LYS  32  -0.431  14.926  -8.966
  235    HZ1  LYS  32           3HZ      LYS  32   0.499  16.774 -11.078
  236    HZ2  LYS  32           1HZ      LYS  32  -1.075  16.189 -10.924
  237    HZ3  LYS  32           2HZ      LYS  32   0.183  15.136 -11.294
  238    H    TYR  33           H        TYR  33  -4.104  15.172  -6.141
  239    HA   TYR  33           HA       TYR  33  -5.556  13.011  -7.511
  240    HB2  TYR  33           2HB      TYR  33  -3.947  12.763  -4.959
  241    HB3  TYR  33           1HB      TYR  33  -4.619  11.468  -5.912
  242    HD1  TYR  33           2HD      TYR  33  -1.941  13.979  -5.743
  243    HD2  TYR  33           1HD      TYR  33  -3.472  10.636  -7.885
  244    HE1  TYR  33           2HE      TYR  33   0.171  13.787  -6.923
  245    HE2  TYR  33           1HE      TYR  33  -1.348  10.426  -9.079
  246    HH   TYR  33           HH       TYR  33   0.569  11.911  -9.693
  247    HA   PRO  34           HA       PRO  34  -9.176  13.723  -4.999
  248    HB2  PRO  34           2HB      PRO  34  -9.827  11.019  -4.621
  249    HB3  PRO  34           1HB      PRO  34 -10.337  12.013  -5.979
  250    HG2  PRO  34           2HG      PRO  34  -8.118  10.057  -5.815
  251    HG3  PRO  34           1HG      PRO  34  -9.190  10.450  -7.164
  252    HD2  PRO  34           2HD      PRO  34  -6.666  11.300  -7.087
  253    HD3  PRO  34           1HD      PRO  34  -7.960  12.310  -7.765
  254    H    PHE  35           H        PHE  35  -6.794  11.409  -3.943
  255    HA   PHE  35           HA       PHE  35  -7.780  11.466  -1.190
  256    HB2  PHE  35           2HB      PHE  35  -6.170   9.506  -0.936
  257    HB3  PHE  35           1HB      PHE  35  -7.565   9.245  -1.981
  258    HD1  PHE  35           2HD      PHE  35  -7.304   9.083  -4.347
  259    HD2  PHE  35           1HD      PHE  35  -3.963   9.627  -1.833
  260    HE1  PHE  35           2HE      PHE  35  -5.883   8.527  -6.206
  261    HE2  PHE  35           1HE      PHE  35  -2.451   9.056  -3.650
  262    HZ   PHE  35           HZ       PHE  35  -3.393   8.483  -5.904
  263    H    CYS  36           H        CYS  36  -5.763  13.270  -2.881
  264    HA   CYS  36           HA       CYS  36  -3.373  13.177  -1.226
  265    HB2  CYS  36           2HB      CYS  36  -3.118  13.646  -3.563
  266    HB3  CYS  36           1HB      CYS  36  -4.245  14.997  -3.489
  267    H    HIS  37           H        HIS  37  -3.429  13.806   0.702
  268    HA   HIS  37           HA       HIS  37  -5.018  16.129   1.261
  269    HB2  HIS  37           2HB      HIS  37  -4.511  15.629   3.728
  270    HB3  HIS  37           1HB      HIS  37  -5.576  14.522   2.885
  271    HD1  HIS  37           1HD      HIS  37  -5.035  12.111   3.247
  272    HD2  HIS  37           2HD      HIS  37  -1.755  14.560   3.877
  273    HE1  HIS  37           1HE      HIS  37  -3.228  10.604   4.100
  274    H    CYS  38           H        CYS  38  -3.699  17.380   0.053
  275    HA   CYS  38           HA       CYS  38  -1.533  18.474   1.697
  276    HB2  CYS  38           2HB      CYS  38  -0.741  17.301  -0.419
  277    HB3  CYS  38           1HB      CYS  38  -1.623  18.518  -1.334
  278    H    ARG  39           H        ARG  39  -1.269  20.888   1.292
  279    HA   ARG  39           HA       ARG  39  -3.499  22.232   0.102
  280    HB2  ARG  39           2HB      ARG  39  -4.280  21.646   2.391
  281    HB3  ARG  39           1HB      ARG  39  -2.888  22.487   3.052
  282    HG2  ARG  39           2HG      ARG  39  -3.666  24.557   2.074
  283    HG3  ARG  39           1HG      ARG  39  -5.053  23.694   1.401
  284    HD2  ARG  39           2HD      ARG  39  -5.712  24.845   3.453
  285    HD3  ARG  39           1HD      ARG  39  -5.768  23.099   3.688
  286    HE   ARG  39           HE       ARG  39  -3.486  24.733   4.555
  287   HH11  ARG  39          1HH1      ARG  39  -5.962  22.291   5.289
  288   HH12  ARG  39          2HH1      ARG  39  -5.396  21.986   6.863
  289   HH21  ARG  39          1HH2      ARG  39  -2.710  24.284   6.755
  290   HH22  ARG  39          2HH2      ARG  39  -3.527  23.142   7.710
  Start of MODEL    6
    1    H1   HIS   1           H        HIS   1  18.693   3.233   4.696
    2    HA   HIS   1           HA       HIS   1  20.445   2.091   6.648
    3    HB2  HIS   1           2HB      HIS   1  21.534   3.572   4.236
    4    HB3  HIS   1           1HB      HIS   1  22.465   3.123   5.658
    5    HD1  HIS   1           1HD      HIS   1  23.190   0.626   5.847
    6    HD2  HIS   1           2HD      HIS   1  20.950   1.525   2.471
    7    HE1  HIS   1           1HE      HIS   1  23.388  -1.376   4.328
    8    H    GLY   2           H        GLY   2  20.387   3.448   8.282
    9    HA2  GLY   2           2HA      GLY   2  20.937   5.838   8.818
   10    HA3  GLY   2           1HA      GLY   2  19.596   6.213   7.740
   11    H    GLU   3           H        GLU   3  19.705   6.997  10.344
   12    HA   GLU   3           HA       GLU   3  18.174   5.263  12.058
   13    HB2  GLU   3           2HB      GLU   3  18.942   8.167  12.312
   14    HB3  GLU   3           1HB      GLU   3  18.315   7.155  13.608
   15    HG2  GLU   3           2HG      GLU   3  20.266   5.894  13.730
   16    HG3  GLU   3           1HG      GLU   3  20.817   6.411  12.142
   17    H    GLY   4           H        GLY   4  17.657   8.273  10.270
   18    HA2  GLY   4           2HA      GLY   4  14.771   7.793  10.321
   19    HA3  GLY   4           1HA      GLY   4  15.403   9.364  10.808
   20    H    THR   5           H        THR   5  16.173   7.092   8.212
   21    HA   THR   5           HA       THR   5  16.212   9.294   6.349
   22    HB   THR   5           HB       THR   5  17.176   7.430   4.828
   23    HG1  THR   5           1HG      THR   5  18.201   5.790   6.124
   24   HG21  THR   5          3HG2      THR   5  18.676   8.289   7.303
   25   HG22  THR   5          1HG2      THR   5  18.517   9.232   5.821
   26   HG23  THR   5          2HG2      THR   5  19.403   7.706   5.806
   27    H    PHE   6           H        PHE   6  14.355   9.727   5.380
   28    HA   PHE   6           HA       PHE   6  12.469   7.540   4.929
   29    HB2  PHE   6           2HB      PHE   6  11.987  10.516   5.122
   30    HB3  PHE   6           1HB      PHE   6  10.749   9.327   4.741
   31    HD1  PHE   6           2HD      PHE   6  10.038   7.702   6.452
   32    HD2  PHE   6           1HD      PHE   6  12.738  10.869   7.351
   33    HE1  PHE   6           2HE      PHE   6   9.622   7.378   8.851
   34    HE2  PHE   6           1HE      PHE   6  12.324  10.543   9.747
   35    HZ   PHE   6           HZ       PHE   6  10.766   8.794  10.496
   36    H    THR   7           H        THR   7  12.614   6.765   2.974
   37    HA   THR   7           HA       THR   7  12.569   8.637   0.745
   38    HB   THR   7           HB       THR   7  14.030   5.979   0.790
   39    HG1  THR   7           1HG      THR   7  14.715   8.437   1.637
   40   HG21  THR   7          3HG2      THR   7  13.198   6.668  -1.432
   41   HG22  THR   7          1HG2      THR   7  14.959   6.745  -1.356
   42   HG23  THR   7          2HG2      THR   7  14.006   8.224  -1.245
   43    H    SER   8           H        SER   8  10.646   8.383  -0.170
   44    HA   SER   8           HA       SER   8   8.961   6.190   0.401
   45    HB2  SER   8           2HB      SER   8   8.690   8.376  -1.656
   46    HB3  SER   8           1HB      SER   8   7.396   7.371  -1.001
   47    HG   SER   8           HG       SER   8   7.791   8.278   1.041
   48    H    ASP   9           H        ASP   9   8.377   4.516  -0.880
   49    HA   ASP   9           HA       ASP   9   8.221   3.046  -2.596
   50    HB2  ASP   9           2HB      ASP   9   7.887   4.849  -4.154
   51    HB3  ASP   9           1HB      ASP   9   9.599   5.221  -4.179
   52    H    LEU  10           H        LEU  10  10.797   3.827  -0.974
   53    HA   LEU  10           HA       LEU  10  12.866   2.411  -2.327
   54    HB2  LEU  10           2HB      LEU  10  13.351   4.170  -0.680
   55    HB3  LEU  10           1HB      LEU  10  12.583   3.238   0.576
   56    HG   LEU  10           HG       LEU  10  15.074   2.211  -0.800
   57   HD11  LEU  10          1HD1      LEU  10  16.368   3.254   0.989
   58   HD12  LEU  10          2HD1      LEU  10  14.912   4.038   1.597
   59   HD13  LEU  10          3HD1      LEU  10  15.554   4.473   0.012
   60   HD21  LEU  10          3HD2      LEU  10  13.768   0.689   0.659
   61   HD22  LEU  10          1HD2      LEU  10  13.978   1.821   1.990
   62   HD23  LEU  10          2HD2      LEU  10  15.382   1.013   1.286
   63    H    SER  11           H        SER  11  10.642   1.613   0.286
   64    HA   SER  11           HA       SER  11  11.273  -1.218  -0.148
   65    HB2  SER  11           2HB      SER  11  11.660  -0.336   2.171
   66    HB3  SER  11           1HB      SER  11   9.948   0.057   2.275
   67    HG   SER  11           HG       SER  11  11.000  -2.529   1.811
   68    H    LYS  12           H        LYS  12   8.972   1.208  -0.613
   69    HA   LYS  12           HA       LYS  12   6.784   1.342  -0.956
   70    HB2  LYS  12           2HB      LYS  12   5.944   0.096  -2.936
   71    HB3  LYS  12           1HB      LYS  12   7.458   0.940  -3.188
   72    HG2  LYS  12           2HG      LYS  12   8.684  -1.097  -3.128
   73    HG3  LYS  12           1HG      LYS  12   7.260  -1.995  -2.593
   74    HD2  LYS  12           2HD      LYS  12   6.138  -1.462  -4.613
   75    HD3  LYS  12           1HD      LYS  12   7.524  -0.534  -5.190
   76    HE2  LYS  12           2HE      LYS  12   7.482  -2.790  -6.200
   77    HE3  LYS  12           1HE      LYS  12   8.895  -2.577  -5.172
   78    HZ1  LYS  12           3HZ      LYS  12   6.396  -4.015  -4.402
   79    HZ2  LYS  12           1HZ      LYS  12   7.739  -3.789  -3.412
   80    HZ3  LYS  12           2HZ      LYS  12   7.877  -4.720  -4.779
   81    H    GLN  13           H        GLN  13   6.558   0.603   1.136
   82    HA   GLN  13           HA       GLN  13   5.387  -1.989   1.749
   83    HB2  GLN  13           2HB      GLN  13   5.493   0.523   3.410
   84    HB3  GLN  13           1HB      GLN  13   5.201  -1.109   3.978
   85    HG2  GLN  13           2HG      GLN  13   7.423  -1.704   3.745
   86    HG3  GLN  13           1HG      GLN  13   7.744  -0.399   2.597
   87   HE21  GLN  13          1HE2      GLN  13   7.947   1.665   3.331
   88   HE22  GLN  13          2HE2      GLN  13   8.324   2.044   4.974
   89    H    MET  14           H        MET  14   4.254   1.273   2.476
   90    HA   MET  14           HA       MET  14   1.484   0.531   1.835
   91    HB2  MET  14           2HB      MET  14   2.040   0.803   4.292
   92    HB3  MET  14           1HB      MET  14   2.538   2.444   3.939
   93    HG2  MET  14           2HG      MET  14   0.248   2.988   3.251
   94    HG3  MET  14           1HG      MET  14  -0.248   1.338   3.614
   95    HE1  MET  14           3HE      MET  14   2.278   3.632   5.656
   96    HE2  MET  14           1HE      MET  14   1.170   4.381   6.801
   97    HE3  MET  14           2HE      MET  14   1.038   4.746   5.082
   98    H    GLU  15           H        GLU  15   3.843   1.688   0.468
   99    HA   GLU  15           HA       GLU  15   3.322   4.475   0.300
  100    HB2  GLU  15           2HB      GLU  15   5.464   2.825  -1.012
  101    HB3  GLU  15           1HB      GLU  15   5.273   4.536  -1.312
  102    HG2  GLU  15           2HG      GLU  15   7.005   4.321   0.297
  103    HG3  GLU  15           1HG      GLU  15   5.604   4.920   1.159
  104    H    GLU  16           H        GLU  16   1.220   4.102  -0.466
  105    HA   GLU  16           HA       GLU  16   1.208   4.301  -3.359
  106    HB2  GLU  16           2HB      GLU  16   0.225   2.165  -2.718
  107    HB3  GLU  16           1HB      GLU  16  -0.777   2.946  -1.514
  108    HG2  GLU  16           2HG      GLU  16  -2.021   2.286  -3.411
  109    HG3  GLU  16           1HG      GLU  16  -2.051   4.038  -3.256
  110    H    GLU  17           H        GLU  17  -1.341   4.718  -0.884
  111    HA   GLU  17           HA       GLU  17  -1.927   7.234  -1.905
  112    HB2  GLU  17           2HB      GLU  17  -3.736   7.116  -0.224
  113    HB3  GLU  17           1HB      GLU  17  -3.714   5.714  -1.279
  114    HG2  GLU  17           2HG      GLU  17  -2.592   4.418   0.462
  115    HG3  GLU  17           1HG      GLU  17  -2.626   5.823   1.522
  116    H    ALA  18           H        ALA  18  -1.954   8.823  -0.753
  117    HA   ALA  18           HA       ALA  18  -0.968  10.664   0.258
  118    HB1  ALA  18           1HB      ALA  18  -1.941   9.694   2.284
  119    HB2  ALA  18           2HB      ALA  18  -0.413  10.535   2.614
  120    HB3  ALA  18           3HB      ALA  18  -0.452   8.777   2.545
  121    H    VAL  19           H        VAL  19   0.809   8.281  -0.883
  122    HA   VAL  19           HA       VAL  19   3.313   9.648  -0.250
  123    HB   VAL  19           HB       VAL  19   2.836   6.889  -1.446
  124   HG11  VAL  19          1HG1      VAL  19   5.440   8.301  -0.855
  125   HG12  VAL  19          2HG1      VAL  19   4.808   7.935  -2.462
  126   HG13  VAL  19          3HG1      VAL  19   5.280   6.623  -1.379
  127   HG21  VAL  19          3HG2      VAL  19   4.056   6.196   0.649
  128   HG22  VAL  19          1HG2      VAL  19   2.457   6.910   0.919
  129   HG23  VAL  19          2HG2      VAL  19   3.910   7.861   1.182
  130    H    ARG  20           H        ARG  20   1.263   8.432  -2.792
  131    HA   ARG  20           HA       ARG  20   2.493   9.716  -4.951
  132    HB2  ARG  20           2HB      ARG  20  -0.252   8.708  -4.371
  133    HB3  ARG  20           1HB      ARG  20   0.014   9.536  -5.878
  134    HG2  ARG  20           2HG      ARG  20   1.463   7.060  -4.923
  135    HG3  ARG  20           1HG      ARG  20   0.145   7.090  -6.095
  136    HD2  ARG  20           2HD      ARG  20   1.504   8.392  -7.633
  137    HD3  ARG  20           1HD      ARG  20   2.807   8.474  -6.452
  138    HE   ARG  20           HE       ARG  20   2.506   5.868  -6.691
  139   HH11  ARG  20          1HH1      ARG  20   2.702   8.323  -9.263
  140   HH12  ARG  20          2HH1      ARG  20   3.495   7.293 -10.353
  141   HH21  ARG  20          1HH2      ARG  20   3.616   4.497  -8.169
  142   HH22  ARG  20          2HH2      ARG  20   4.015   5.035  -9.728
  143    H    CYS  21           H        CYS  21   0.794  10.937  -2.339
  144    HA   CYS  21           HA       CYS  21   0.268  13.490  -3.688
  145    HB2  CYS  21           2HB      CYS  21  -1.692  12.665  -2.545
  146    HB3  CYS  21           1HB      CYS  21  -0.770  12.325  -1.086
  147    H    PHE  22           H        PHE  22   2.311  11.865  -1.499
  148    HA   PHE  22           HA       PHE  22   3.044  13.972   0.245
  149    HB2  PHE  22           2HB      PHE  22   3.228  11.517   0.676
  150    HB3  PHE  22           1HB      PHE  22   4.588  11.481  -0.438
  151    HD1  PHE  22           2HD      PHE  22   3.344  12.711   2.736
  152    HD2  PHE  22           1HD      PHE  22   6.733  12.214   0.252
  153    HE1  PHE  22           2HE      PHE  22   4.768  13.261   4.625
  154    HE2  PHE  22           1HE      PHE  22   8.217  12.762   2.118
  155    HZ   PHE  22           HZ       PHE  22   7.249  13.296   4.342
  156    H    ILE  23           H        ILE  23   4.847  12.303  -2.308
  157    HA   ILE  23           HA       ILE  23   7.093  13.987  -2.250
  158    HB   ILE  23           HB       ILE  23   6.093  12.344  -4.604
  159   HG12  ILE  23          2HG1      ILE  23   6.316  10.969  -2.567
  160   HG13  ILE  23          1HG1      ILE  23   7.528  10.542  -3.767
  161   HG21  ILE  23          1HG2      ILE  23   8.856  13.317  -3.911
  162   HG22  ILE  23          2HG2      ILE  23   7.844  13.946  -5.213
  163   HG23  ILE  23          3HG2      ILE  23   8.456  12.287  -5.289
  164   HD11  ILE  23          3HD1      ILE  23   8.439  10.574  -1.505
  165   HD12  ILE  23          1HD1      ILE  23   8.000  12.274  -1.344
  166   HD13  ILE  23          2HD1      ILE  23   9.210  11.786  -2.528
  167    H    GLU  24           H        GLU  24   4.149  14.093  -4.075
  168    HA   GLU  24           HA       GLU  24   4.816  16.176  -5.866
  169    HB2  GLU  24           2HB      GLU  24   2.078  15.530  -4.801
  170    HB3  GLU  24           1HB      GLU  24   2.515  16.290  -6.330
  171    HG2  GLU  24           2HG      GLU  24   3.090  13.495  -5.533
  172    HG3  GLU  24           1HG      GLU  24   1.773  14.003  -6.572
  173    H    CYS  25           H        CYS  25   3.284  16.053  -2.703
  174    HA   CYS  25           HA       CYS  25   2.662  18.818  -2.626
  175    HB2  CYS  25           2HB      CYS  25   1.427  17.172  -1.275
  176    HB3  CYS  25           1HB      CYS  25   2.841  16.896  -0.275
  177    H    LEU  26           H        LEU  26   5.512  17.018  -1.720
  178    HA   LEU  26           HA       LEU  26   6.681  19.274  -0.410
  179    HB2  LEU  26           2HB      LEU  26   7.736  16.608  -1.239
  180    HB3  LEU  26           1HB      LEU  26   8.885  17.877  -0.879
  181    HG   LEU  26           HG       LEU  26   8.610  16.442   1.048
  182   HD11  LEU  26          1HD1      LEU  26   7.319  19.115   1.535
  183   HD12  LEU  26          2HD1      LEU  26   9.047  18.775   1.482
  184   HD13  LEU  26          3HD1      LEU  26   8.050  18.071   2.752
  185   HD21  LEU  26          3HD2      LEU  26   5.684  17.185   0.991
  186   HD22  LEU  26          1HD2      LEU  26   6.487  16.266   2.264
  187   HD23  LEU  26          2HD2      LEU  26   6.358  15.593   0.640
  188    H    LYS  27           H        LYS  27   6.175  18.498  -3.600
  189    HA   LYS  27           HA       LYS  27   8.206  20.329  -4.607
  190    HB2  LYS  27           2HB      LYS  27   5.895  18.978  -6.039
  191    HB3  LYS  27           1HB      LYS  27   7.169  19.903  -6.812
  192    HG2  LYS  27           2HG      LYS  27   8.803  18.235  -6.116
  193    HG3  LYS  27           1HG      LYS  27   7.525  17.312  -5.324
  194    HD2  LYS  27           2HD      LYS  27   6.386  17.031  -7.472
  195    HD3  LYS  27           1HD      LYS  27   7.648  17.971  -8.265
  196    HE2  LYS  27           2HE      LYS  27   8.051  15.349  -6.828
  197    HE3  LYS  27           1HE      LYS  27   7.963  15.556  -8.574
  198    HZ1  LYS  27           3HZ      LYS  27   9.935  16.983  -8.432
  199    HZ2  LYS  27           1HZ      LYS  27  10.229  15.420  -7.885
  200    HZ3  LYS  27           2HZ      LYS  27  10.042  16.691  -6.785
  201    H    GLY  28           H        GLY  28   4.708  20.018  -4.364
  202    HA2  GLY  28           2HA      GLY  28   3.615  22.012  -3.297
  203    HA3  GLY  28           1HA      GLY  28   4.413  22.958  -4.549
  204    H    ILE  29           H        ILE  29   1.734  20.899  -3.779
  205    HA   ILE  29           HA       ILE  29   0.697  21.502  -6.317
  206    HB   ILE  29           HB       ILE  29  -0.181  19.228  -6.720
  207   HG12  ILE  29          2HG1      ILE  29   1.130  17.314  -5.467
  208   HG13  ILE  29          1HG1      ILE  29   1.266  18.519  -4.193
  209   HG21  ILE  29          1HG2      ILE  29   1.779  19.790  -7.898
  210   HG22  ILE  29          2HG2      ILE  29   1.874  18.090  -7.423
  211   HG23  ILE  29          3HG2      ILE  29   2.795  19.305  -6.544
  212   HD11  ILE  29          3HD1      ILE  29  -1.267  17.426  -5.389
  213   HD12  ILE  29          1HD1      ILE  29  -1.175  18.694  -4.168
  214   HD13  ILE  29          2HD1      ILE  29  -0.607  17.063  -3.790
  215    H    GLY  30           H        GLY  30  -0.934  22.300  -5.981
  216    HA2  GLY  30           2HA      GLY  30  -2.566  21.980  -3.578
  217    HA3  GLY  30           1HA      GLY  30  -2.922  23.112  -4.890
  218    H    HIS  31           H        HIS  31  -3.221  19.929  -3.691
  219    HA   HIS  31           HA       HIS  31  -4.522  18.138  -4.116
  220    HB2  HIS  31           2HB      HIS  31  -6.296  19.720  -3.528
  221    HB3  HIS  31           1HB      HIS  31  -6.409  20.245  -5.201
  222    HD1  HIS  31           1HD      HIS  31  -8.368  19.216  -6.375
  223    HD2  HIS  31           2HD      HIS  31  -6.872  16.772  -3.367
  224    HE1  HIS  31           1HE      HIS  31  -9.813  17.147  -6.370
  225    H    LYS  32           H        LYS  32  -3.261  17.016  -5.555
  226    HA   LYS  32           HA       LYS  32  -3.916  17.398  -8.387
  227    HB2  LYS  32           2HB      LYS  32  -1.504  17.388  -7.881
  228    HB3  LYS  32           1HB      LYS  32  -1.646  15.786  -7.171
  229    HG2  LYS  32           2HG      LYS  32  -2.361  14.909  -9.377
  230    HG3  LYS  32           1HG      LYS  32  -2.107  16.508 -10.061
  231    HD2  LYS  32           2HD      LYS  32   0.044  14.846  -8.743
  232    HD3  LYS  32           1HD      LYS  32  -0.257  14.902 -10.476
  233    HE2  LYS  32           2HE      LYS  32   0.184  17.335 -10.426
  234    HE3  LYS  32           1HE      LYS  32   0.570  17.198  -8.713
  235    HZ1  LYS  32           3HZ      LYS  32   2.423  15.725  -9.270
  236    HZ2  LYS  32           1HZ      LYS  32   2.560  17.150 -10.149
  237    HZ3  LYS  32           2HZ      LYS  32   1.997  15.754 -10.881
  238    H    TYR  33           H        TYR  33  -4.408  15.197  -5.798
  239    HA   TYR  33           HA       TYR  33  -5.558  13.226  -7.667
  240    HB2  TYR  33           2HB      TYR  33  -4.150  12.566  -5.055
  241    HB3  TYR  33           1HB      TYR  33  -4.876  11.424  -6.156
  242    HD1  TYR  33           1HD      TYR  33  -2.137  13.890  -5.857
  243    HD2  TYR  33           2HD      TYR  33  -3.608  10.475  -7.899
  244    HE1  TYR  33           1HE      TYR  33  -0.009  13.656  -6.950
  245    HE2  TYR  33           2HE      TYR  33  -1.447  10.212  -9.021
  246    HH   TYR  33           HH       TYR  33   0.512  11.604  -9.614
  247    HA   PRO  34           HA       PRO  34  -9.357  13.787  -5.430
  248    HB2  PRO  34           2HB      PRO  34 -10.153  11.107  -5.275
  249    HB3  PRO  34           1HB      PRO  34 -10.440  12.173  -6.648
  250    HG2  PRO  34           2HG      PRO  34  -8.282  10.160  -6.254
  251    HG3  PRO  34           1HG      PRO  34  -9.215  10.545  -7.711
  252    HD2  PRO  34           2HD      PRO  34  -6.730  11.407  -7.430
  253    HD3  PRO  34           1HD      PRO  34  -7.969  12.461  -8.144
  254    H    PHE  35           H        PHE  35  -7.091  11.435  -4.274
  255    HA   PHE  35           HA       PHE  35  -8.212  11.462  -1.566
  256    HB2  PHE  35           2HB      PHE  35  -6.606   9.498  -1.259
  257    HB3  PHE  35           1HB      PHE  35  -7.964   9.257  -2.358
  258    HD1  PHE  35           2HD      PHE  35  -4.331   9.749  -2.149
  259    HD2  PHE  35           1HD      PHE  35  -7.646   9.000  -4.682
  260    HE1  PHE  35           2HE      PHE  35  -2.797   9.197  -3.966
  261    HE2  PHE  35           1HE      PHE  35  -6.178   8.473  -6.514
  262    HZ   PHE  35           HZ       PHE  35  -3.694   8.551  -6.185
  263    H    CYS  36           H        CYS  36  -6.211  13.349  -3.107
  264    HA   CYS  36           HA       CYS  36  -3.953  13.234  -1.280
  265    HB2  CYS  36           2HB      CYS  36  -3.392  13.548  -3.589
  266    HB3  CYS  36           1HB      CYS  36  -4.495  14.903  -3.751
  267    H    HIS  37           H        HIS  37  -4.060  14.186   0.537
  268    HA   HIS  37           HA       HIS  37  -5.880  16.476   0.887
  269    HB2  HIS  37           2HB      HIS  37  -5.159  14.287   2.856
  270    HB3  HIS  37           1HB      HIS  37  -6.229  15.639   3.185
  271    HD1  HIS  37           1HD      HIS  37  -6.467  12.184   2.470
  272    HD2  HIS  37           2HD      HIS  37  -8.417  15.554   1.028
  273    HE1  HIS  37           1HE      HIS  37  -8.635  11.367   1.520
  274    H    CYS  38           H        CYS  38  -3.087  16.694   0.171
  275    HA   CYS  38           HA       CYS  38  -1.815  17.453   2.681
  276    HB2  CYS  38           2HB      CYS  38  -0.467  16.206   0.986
  277    HB3  CYS  38           1HB      CYS  38  -0.618  17.599  -0.080
  278    H    ARG  39           H        ARG  39  -1.860  19.076  -0.264
  279    HA   ARG  39           HA       ARG  39  -2.721  21.518   1.182
  280    HB2  ARG  39           2HB      ARG  39  -0.525  21.503  -0.883
  281    HB3  ARG  39           1HB      ARG  39  -1.216  22.951  -0.177
  282    HG2  ARG  39           2HG      ARG  39  -0.440  22.193   2.036
  283    HG3  ARG  39           1HG      ARG  39   0.334  20.810   1.257
  284    HD2  ARG  39           2HD      ARG  39   1.978  22.528   1.596
  285    HD3  ARG  39           1HD      ARG  39   1.630  22.393  -0.125
  286    HE   ARG  39           HE       ARG  39  -0.074  24.324   0.733
  287   HH11  ARG  39          1HH1      ARG  39   3.438  23.936   0.835
  288   HH12  ARG  39          2HH1      ARG  39   3.761  25.596   0.812
  289   HH21  ARG  39          1HH2      ARG  39   0.363  26.602   0.741
  290   HH22  ARG  39          2HH2      ARG  39   1.965  27.157   0.766
  Start of MODEL    7
    1    H1   HIS   1           H        HIS   1  -9.405 -17.045  -7.953
    2    HA   HIS   1           HA       HIS   1  -8.555 -14.751  -7.994
    3    HB2  HIS   1           2HB      HIS   1  -8.527 -15.190  -4.998
    4    HB3  HIS   1           1HB      HIS   1  -7.810 -13.813  -5.821
    5    HD1  HIS   1           1HD      HIS   1 -11.035 -15.139  -4.552
    6    HD2  HIS   1           2HD      HIS   1  -9.683 -11.977  -6.889
    7    HE1  HIS   1           1HE      HIS   1 -12.949 -13.513  -4.683
    8    H    GLY   2           H        GLY   2  -7.872 -17.651  -6.336
    9    HA2  GLY   2           2HA      GLY   2  -5.864 -18.844  -7.209
   10    HA3  GLY   2           1HA      GLY   2  -4.990 -17.348  -6.874
   11    H    GLU   3           H        GLU   3  -3.604 -18.420  -5.430
   12    HA   GLU   3           HA       GLU   3  -4.776 -19.701  -3.124
   13    HB2  GLU   3           2HB      GLU   3  -1.947 -19.327  -4.049
   14    HB3  GLU   3           1HB      GLU   3  -2.297 -19.843  -2.411
   15    HG2  GLU   3           2HG      GLU   3  -1.782 -21.735  -3.843
   16    HG3  GLU   3           1HG      GLU   3  -3.438 -21.816  -3.259
   17    H    GLY   4           H        GLY   4  -3.717 -16.630  -4.012
   18    HA2  GLY   4           2HA      GLY   4  -3.736 -15.813  -1.197
   19    HA3  GLY   4           1HA      GLY   4  -2.991 -14.903  -2.515
   20    H    THR   5           H        THR   5  -5.303 -14.450  -0.512
   21    HA   THR   5           HA       THR   5  -7.371 -13.768  -2.445
   22    HB   THR   5           HB       THR   5  -7.317 -13.349   0.557
   23    HG1  THR   5           1HG      THR   5  -7.901 -15.598  -1.011
   24   HG21  THR   5          3HG2      THR   5  -9.755 -13.218   0.333
   25   HG22  THR   5          1HG2      THR   5  -9.610 -13.442  -1.411
   26   HG23  THR   5          2HG2      THR   5  -8.965 -11.987  -0.651
   27    H    PHE   6           H        PHE   6  -7.028 -11.909  -3.471
   28    HA   PHE   6           HA       PHE   6  -5.194  -9.961  -2.460
   29    HB2  PHE   6           2HB      PHE   6  -6.890  -9.910  -4.969
   30    HB3  PHE   6           1HB      PHE   6  -5.562  -8.814  -4.601
   31    HD1  PHE   6           1HD      PHE   6  -3.229  -9.741  -4.433
   32    HD2  PHE   6           2HD      PHE   6  -6.494 -12.034  -5.930
   33    HE1  PHE   6           1HE      PHE   6  -1.650 -11.321  -5.466
   34    HE2  PHE   6           2HE      PHE   6  -4.917 -13.615  -6.958
   35    HZ   PHE   6           HZ       PHE   6  -2.491 -13.258  -6.726
   36    H    THR   7           H        THR   7  -5.869  -8.736  -0.870
   37    HA   THR   7           HA       THR   7  -8.389  -7.340  -1.199
   38    HB   THR   7           HB       THR   7  -8.678  -9.199   0.433
   39    HG1  THR   7           1HG      THR   7  -8.955  -7.373   2.301
   40   HG21  THR   7          3HG2      THR   7  -6.402  -9.332   1.329
   41   HG22  THR   7          1HG2      THR   7  -7.569  -9.104   2.632
   42   HG23  THR   7          2HG2      THR   7  -6.595  -7.745   2.075
   43    H    SER   8           H        SER   8  -8.413  -5.247  -0.184
   44    HA   SER   8           HA       SER   8  -5.979  -3.887  -0.508
   45    HB2  SER   8           2HB      SER   8  -7.383  -1.981   0.382
   46    HB3  SER   8           1HB      SER   8  -7.940  -2.766  -1.107
   47    HG   SER   8           HG       SER   8  -8.875  -3.304   1.526
   48    H    ASP   9           H        ASP   9  -4.588  -3.084   0.945
   49    HA   ASP   9           HA       ASP   9  -3.377  -2.831   2.834
   50    HB2  ASP   9           2HB      ASP   9  -6.107  -2.854   4.088
   51    HB3  ASP   9           1HB      ASP   9  -4.641  -2.509   5.005
   52    H    LEU  10           H        LEU  10  -3.943  -5.437   1.810
   53    HA   LEU  10           HA       LEU  10  -4.489  -7.414   3.730
   54    HB2  LEU  10           2HB      LEU  10  -4.364  -7.617   1.245
   55    HB3  LEU  10           1HB      LEU  10  -2.641  -7.474   1.340
   56    HG   LEU  10           HG       LEU  10  -4.232  -9.820   2.443
   57   HD11  LEU  10          1HD1      LEU  10  -4.366  -9.684   0.025
   58   HD12  LEU  10          2HD1      LEU  10  -3.340 -11.034   0.513
   59   HD13  LEU  10          3HD1      LEU  10  -2.612  -9.541  -0.080
   60   HD21  LEU  10          3HD2      LEU  10  -2.051  -9.529   3.574
   61   HD22  LEU  10          1HD2      LEU  10  -1.250  -9.515   2.003
   62   HD23  LEU  10          2HD2      LEU  10  -2.071 -10.972   2.560
   63    H    SER  11           H        SER  11  -1.413  -6.038   2.613
   64    HA   SER  11           HA       SER  11  -0.195  -6.992   5.105
   65    HB2  SER  11           2HB      SER  11   0.828  -7.887   3.028
   66    HB3  SER  11           1HB      SER  11   1.119  -6.253   2.460
   67    HG   SER  11           HG       SER  11   2.174  -6.693   4.940
   68    H    LYS  12           H        LYS  12  -1.234  -4.316   3.294
   69    HA   LYS  12           HA       LYS  12  -1.156  -2.077   3.422
   70    HB2  LYS  12           2HB      LYS  12  -2.213  -2.849   5.615
   71    HB3  LYS  12           1HB      LYS  12  -0.673  -2.465   6.365
   72    HG2  LYS  12           2HG      LYS  12  -0.910  -0.145   5.561
   73    HG3  LYS  12           1HG      LYS  12  -2.508  -0.562   4.938
   74    HD2  LYS  12           2HD      LYS  12  -3.134  -1.296   7.186
   75    HD3  LYS  12           1HD      LYS  12  -1.563  -0.721   7.758
   76    HE2  LYS  12           2HE      LYS  12  -3.189   1.018   8.224
   77    HE3  LYS  12           1HE      LYS  12  -2.153   1.558   6.905
   78    HZ1  LYS  12           3HZ      LYS  12  -4.393   2.086   6.348
   79    HZ2  LYS  12           1HZ      LYS  12  -4.930   0.539   6.718
   80    HZ3  LYS  12           2HZ      LYS  12  -4.004   0.749   5.372
   81    H    GLN  13           H        GLN  13   1.374  -3.501   3.126
   82    HA   GLN  13           HA       GLN  13   3.409  -1.899   4.375
   83    HB2  GLN  13           2HB      GLN  13   3.838  -4.241   4.179
   84    HB3  GLN  13           1HB      GLN  13   3.403  -4.242   2.481
   85    HG2  GLN  13           2HG      GLN  13   5.752  -4.418   2.680
   86    HG3  GLN  13           1HG      GLN  13   5.298  -2.851   1.998
   87   HE21  GLN  13          1HE2      GLN  13   5.172  -3.681   5.405
   88   HE22  GLN  13          2HE2      GLN  13   6.416  -2.611   5.913
   89    H    MET  14           H        MET  14   2.086  -2.537   1.180
   90    HA   MET  14           HA       MET  14   3.571  -0.242   0.135
   91    HB2  MET  14           2HB      MET  14   2.216  -2.489  -1.362
   92    HB3  MET  14           1HB      MET  14   3.099  -1.161  -2.090
   93    HG2  MET  14           2HG      MET  14   5.160  -1.999  -1.051
   94    HG3  MET  14           1HG      MET  14   4.247  -3.345  -0.368
   95    HE1  MET  14           3HE      MET  14   5.880  -5.124  -1.507
   96    HE2  MET  14           1HE      MET  14   6.835  -3.795  -2.168
   97    HE3  MET  14           2HE      MET  14   6.298  -5.103  -3.221
   98    H    GLU  15           H        GLU  15   2.193   1.392   0.708
   99    HA   GLU  15           HA       GLU  15  -0.537   1.200  -0.303
  100    HB2  GLU  15           2HB      GLU  15  -1.111   2.982   1.206
  101    HB3  GLU  15           1HB      GLU  15  -0.327   1.700   2.108
  102    HG2  GLU  15           2HG      GLU  15   1.004   4.176   1.152
  103    HG3  GLU  15           1HG      GLU  15   0.268   3.994   2.753
  104    H    GLU  16           H        GLU  16  -1.351   3.090  -1.432
  105    HA   GLU  16           HA       GLU  16   0.884   4.546  -2.637
  106    HB2  GLU  16           2HB      GLU  16  -0.283   4.742  -4.719
  107    HB3  GLU  16           1HB      GLU  16  -0.309   3.060  -4.237
  108    HG2  GLU  16           2HG      GLU  16  -2.610   3.205  -3.613
  109    HG3  GLU  16           1HG      GLU  16  -2.607   4.956  -3.843
  110    H    GLU  17           H        GLU  17  -2.260   4.797  -1.185
  111    HA   GLU  17           HA       GLU  17  -2.633   7.457  -1.757
  112    HB2  GLU  17           2HB      GLU  17  -3.764   5.671   0.380
  113    HB3  GLU  17           1HB      GLU  17  -4.316   7.319   0.110
  114    HG2  GLU  17           2HG      GLU  17  -5.053   6.707  -2.129
  115    HG3  GLU  17           1HG      GLU  17  -4.456   5.067  -1.894
  116    H    ALA  18           H        ALA  18  -1.925   8.913  -0.957
  117    HA   ALA  18           HA       ALA  18  -0.804  10.582   0.179
  118    HB1  ALA  18           1HB      ALA  18  -1.958   9.796   2.194
  119    HB2  ALA  18           2HB      ALA  18  -0.348  10.420   2.564
  120    HB3  ALA  18           3HB      ALA  18  -0.635   8.675   2.514
  121    H    VAL  19           H        VAL  19   0.474   7.902  -0.938
  122    HA   VAL  19           HA       VAL  19   3.233   8.709  -0.364
  123    HB   VAL  19           HB       VAL  19   2.181   6.258  -1.845
  124   HG11  VAL  19          1HG1      VAL  19   4.464   5.401  -1.662
  125   HG12  VAL  19          2HG1      VAL  19   4.957   6.902  -0.874
  126   HG13  VAL  19          3HG1      VAL  19   4.424   6.925  -2.554
  127   HG21  VAL  19          3HG2      VAL  19   3.281   6.497   0.948
  128   HG22  VAL  19          1HG2      VAL  19   2.834   4.992   0.142
  129   HG23  VAL  19          2HG2      VAL  19   1.599   6.199   0.513
  130    H    ARG  20           H        ARG  20   0.925   7.998  -2.860
  131    HA   ARG  20           HA       ARG  20   2.096   8.869  -5.200
  132    HB2  ARG  20           2HB      ARG  20  -0.686   9.024  -4.141
  133    HB3  ARG  20           1HB      ARG  20  -0.404   9.513  -5.772
  134    HG2  ARG  20           2HG      ARG  20   0.031   6.796  -4.558
  135    HG3  ARG  20           1HG      ARG  20  -1.261   7.257  -5.662
  136    HD2  ARG  20           2HD      ARG  20   0.399   7.648  -7.422
  137    HD3  ARG  20           1HD      ARG  20   1.682   7.209  -6.293
  138    HE   ARG  20           HE       ARG  20  -0.402   5.249  -6.760
  139   HH11  ARG  20          1HH1      ARG  20   2.869   6.364  -7.540
  140   HH12  ARG  20          2HH1      ARG  20   3.419   4.834  -8.070
  141   HH21  ARG  20          1HH2      ARG  20   0.396   3.140  -7.510
  142   HH22  ARG  20          2HH2      ARG  20   1.999   3.000  -8.058
  143    H    CYS  21           H        CYS  21   0.757  10.698  -2.577
  144    HA   CYS  21           HA       CYS  21   0.931  13.216  -4.054
  145    HB2  CYS  21           2HB      CYS  21  -1.238  12.733  -3.095
  146    HB3  CYS  21           1HB      CYS  21  -0.540  12.404  -1.529
  147    H    PHE  22           H        PHE  22   2.893  11.391  -2.126
  148    HA   PHE  22           HA       PHE  22   3.572  13.145   0.007
  149    HB2  PHE  22           2HB      PHE  22   3.909  10.621  -0.132
  150    HB3  PHE  22           1HB      PHE  22   5.297  11.027  -1.154
  151    HD1  PHE  22           1HD      PHE  22   7.303  11.983  -0.215
  152    HD2  PHE  22           2HD      PHE  22   3.957  11.064   2.210
  153    HE1  PHE  22           1HE      PHE  22   8.712  12.208   1.785
  154    HE2  PHE  22           2HE      PHE  22   5.357  11.292   4.240
  155    HZ   PHE  22           HZ       PHE  22   7.740  11.866   4.017
  156    H    ILE  23           H        ILE  23   5.553  12.092  -2.785
  157    HA   ILE  23           HA       ILE  23   7.487  14.114  -2.291
  158    HB   ILE  23           HB       ILE  23   7.147  12.288  -4.712
  159   HG12  ILE  23          2HG1      ILE  23   7.593  11.101  -2.591
  160   HG13  ILE  23          1HG1      ILE  23   8.925  10.945  -3.727
  161   HG21  ILE  23          1HG2      ILE  23   8.436  14.262  -5.328
  162   HG22  ILE  23          2HG2      ILE  23   9.447  12.817  -5.302
  163   HG23  ILE  23          3HG2      ILE  23   9.530  13.974  -3.975
  164   HD11  ILE  23          3HD1      ILE  23  10.183  12.624  -2.481
  165   HD12  ILE  23          1HD1      ILE  23   9.714  11.279  -1.445
  166   HD13  ILE  23          2HD1      ILE  23   8.847  12.811  -1.350
  167    H    GLU  24           H        GLU  24   4.603  13.962  -4.097
  168    HA   GLU  24           HA       GLU  24   5.040  16.221  -5.774
  169    HB2  GLU  24           2HB      GLU  24   2.362  15.447  -4.613
  170    HB3  GLU  24           1HB      GLU  24   2.675  16.317  -6.101
  171    HG2  GLU  24           2HG      GLU  24   3.105  13.432  -5.515
  172    HG3  GLU  24           1HG      GLU  24   1.951  14.144  -6.630
  173    H    CYS  25           H        CYS  25   3.682  15.719  -2.547
  174    HA   CYS  25           HA       CYS  25   2.948  18.399  -2.116
  175    HB2  CYS  25           2HB      CYS  25   1.950  16.472  -0.881
  176    HB3  CYS  25           1HB      CYS  25   3.419  16.312   0.059
  177    H    LEU  26           H        LEU  26   5.978  16.887  -1.976
  178    HA   LEU  26           HA       LEU  26   7.224  18.807  -0.303
  179    HB2  LEU  26           2HB      LEU  26   8.240  16.894  -2.342
  180    HB3  LEU  26           1HB      LEU  26   9.303  18.202  -1.868
  181    HG   LEU  26           HG       LEU  26   9.249  17.420   0.458
  182   HD11  LEU  26          1HD1      LEU  26   8.253  15.282   1.055
  183   HD12  LEU  26          2HD1      LEU  26   7.527  15.166  -0.548
  184   HD13  LEU  26          3HD1      LEU  26   7.033  16.450   0.552
  185   HD21  LEU  26          3HD2      LEU  26  10.484  15.339   0.139
  186   HD22  LEU  26          1HD2      LEU  26  10.972  16.584  -1.011
  187   HD23  LEU  26          2HD2      LEU  26   9.919  15.267  -1.530
  188    H    LYS  27           H        LYS  27   5.781  19.209  -3.298
  189    HA   LYS  27           HA       LYS  27   7.036  21.839  -3.611
  190    HB2  LYS  27           2HB      LYS  27   5.839  20.032  -5.731
  191    HB3  LYS  27           1HB      LYS  27   6.321  21.694  -6.008
  192    HG2  LYS  27           2HG      LYS  27   8.159  19.442  -5.218
  193    HG3  LYS  27           1HG      LYS  27   7.970  20.097  -6.845
  194    HD2  LYS  27           2HD      LYS  27   8.747  22.294  -6.005
  195    HD3  LYS  27           1HD      LYS  27   8.998  21.568  -4.416
  196    HE2  LYS  27           2HE      LYS  27  10.380  20.751  -6.972
  197    HE3  LYS  27           1HE      LYS  27  11.089  21.718  -5.687
  198    HZ1  LYS  27           3HZ      LYS  27  10.213  18.877  -5.473
  199    HZ2  LYS  27           1HZ      LYS  27  10.798  19.806  -4.186
  200    HZ3  LYS  27           2HZ      LYS  27  11.793  19.453  -5.481
  201    H    GLY  28           H        GLY  28   5.305  23.251  -4.918
  202    HA2  GLY  28           2HA      GLY  28   2.998  23.350  -3.196
  203    HA3  GLY  28           1HA      GLY  28   3.385  24.473  -4.496
  204    H    ILE  29           H        ILE  29   1.660  21.577  -3.632
  205    HA   ILE  29           HA       ILE  29   0.462  21.596  -6.206
  206    HB   ILE  29           HB       ILE  29   0.478  19.130  -6.365
  207   HG12  ILE  29          2HG1      ILE  29   2.177  17.977  -4.645
  208   HG13  ILE  29          1HG1      ILE  29   1.570  19.259  -3.604
  209   HG21  ILE  29          1HG2      ILE  29   3.227  20.183  -5.828
  210   HG22  ILE  29          2HG2      ILE  29   2.374  20.172  -7.370
  211   HG23  ILE  29          3HG2      ILE  29   2.876  18.653  -6.620
  212   HD11  ILE  29          3HD1      ILE  29  -0.704  18.497  -4.007
  213   HD12  ILE  29          1HD1      ILE  29   0.296  17.232  -3.279
  214   HD13  ILE  29          2HD1      ILE  29  -0.083  17.179  -5.004
  215    H    GLY  30           H        GLY  30  -1.353  22.014  -5.865
  216    HA2  GLY  30           2HA      GLY  30  -2.715  21.521  -3.306
  217    HA3  GLY  30           1HA      GLY  30  -3.258  22.673  -4.521
  218    H    HIS  31           H        HIS  31  -3.177  19.361  -3.539
  219    HA   HIS  31           HA       HIS  31  -4.481  17.585  -3.951
  220    HB2  HIS  31           2HB      HIS  31  -6.337  19.044  -3.350
  221    HB3  HIS  31           1HB      HIS  31  -6.401  19.690  -4.982
  222    HD1  HIS  31           1HD      HIS  31  -7.884  18.459  -6.633
  223    HD2  HIS  31           2HD      HIS  31  -7.291  16.362  -3.106
  224    HE1  HIS  31           1HE      HIS  31  -9.468  16.503  -6.724
  225    H    LYS  32           H        LYS  32  -3.075  16.644  -5.401
  226    HA   LYS  32           HA       LYS  32  -3.661  16.973  -8.249
  227    HB2  LYS  32           2HB      LYS  32  -1.590  15.387  -6.790
  228    HB3  LYS  32           1HB      LYS  32  -1.900  15.095  -8.495
  229    HG2  LYS  32           2HG      LYS  32  -1.371  17.537  -8.827
  230    HG3  LYS  32           1HG      LYS  32  -0.773  17.538  -7.160
  231    HD2  LYS  32           2HD      LYS  32   0.811  15.762  -7.703
  232    HD3  LYS  32           1HD      LYS  32   0.178  15.668  -9.345
  233    HE2  LYS  32           2HE      LYS  32   0.872  18.018  -9.678
  234    HE3  LYS  32           1HE      LYS  32   1.628  17.992  -8.088
  235    HZ1  LYS  32           3HZ      LYS  32   2.372  16.406 -10.481
  236    HZ2  LYS  32           1HZ      LYS  32   3.055  16.116  -8.959
  237    HZ3  LYS  32           2HZ      LYS  32   3.278  17.597  -9.729
  238    H    TYR  33           H        TYR  33  -4.117  14.718  -5.712
  239    HA   TYR  33           HA       TYR  33  -5.388  12.788  -7.549
  240    HB2  TYR  33           2HB      TYR  33  -4.112  12.135  -4.876
  241    HB3  TYR  33           1HB      TYR  33  -4.653  11.018  -6.102
  242    HD1  TYR  33           2HD      TYR  33  -2.070  13.585  -5.367
  243    HD2  TYR  33           1HD      TYR  33  -3.181  10.281  -7.812
  244    HE1  TYR  33           2HE      TYR  33   0.150  13.523  -6.228
  245    HE2  TYR  33           1HE      TYR  33  -0.913  10.190  -8.696
  246    HH   TYR  33           HH       TYR  33   1.636  11.714  -7.197
  247    HA   PRO  34           HA       PRO  34  -9.177  13.395  -5.167
  248    HB2  PRO  34           2HB      PRO  34  -9.700  10.694  -4.537
  249    HB3  PRO  34           1HB      PRO  34 -10.290  11.563  -5.948
  250    HG2  PRO  34           2HG      PRO  34  -7.964   9.736  -5.694
  251    HG3  PRO  34           1HG      PRO  34  -9.069   9.977  -7.056
  252    HD2  PRO  34           2HD      PRO  34  -6.600  10.951  -7.107
  253    HD3  PRO  34           1HD      PRO  34  -7.955  11.886  -7.771
  254    H    PHE  35           H        PHE  35  -6.821  11.184  -3.856
  255    HA   PHE  35           HA       PHE  35  -7.731  11.617  -1.108
  256    HB2  PHE  35           2HB      PHE  35  -6.171   9.682  -0.658
  257    HB3  PHE  35           1HB      PHE  35  -7.595   9.322  -1.639
  258    HD1  PHE  35           1HD      PHE  35  -3.978   9.678  -1.603
  259    HD2  PHE  35           2HD      PHE  35  -7.376   8.811  -3.964
  260    HE1  PHE  35           1HE      PHE  35  -2.519   8.797  -3.356
  261    HE2  PHE  35           2HE      PHE  35  -5.984   7.952  -5.733
  262    HZ   PHE  35           HZ       PHE  35  -3.511   7.920  -5.467
  263    H    CYS  36           H        CYS  36  -5.919  13.296  -2.941
  264    HA   CYS  36           HA       CYS  36  -3.495  13.405  -1.327
  265    HB2  CYS  36           2HB      CYS  36  -3.177  13.388  -3.696
  266    HB3  CYS  36           1HB      CYS  36  -4.320  14.699  -3.921
  267    H    HIS  37           H        HIS  37  -3.801  14.509   0.424
  268    HA   HIS  37           HA       HIS  37  -5.814  16.596   0.498
  269    HB2  HIS  37           2HB      HIS  37  -4.291  15.275   2.749
  270    HB3  HIS  37           1HB      HIS  37  -5.617  16.417   2.938
  271    HD1  HIS  37           1HD      HIS  37  -5.169  12.985   3.314
  272    HD2  HIS  37           2HD      HIS  37  -7.917  15.240   1.161
  273    HE1  HIS  37           1HE      HIS  37  -7.149  11.485   2.903
  274    H    CYS  38           H        CYS  38  -2.637  16.455  -0.131
  275    HA   CYS  38           HA       CYS  38  -1.531  18.563   1.365
  276    HB2  CYS  38           2HB      CYS  38  -0.201  16.975   0.046
  277    HB3  CYS  38           1HB      CYS  38  -0.844  17.691  -1.431
  278    H    ARG  39           H        ARG  39  -2.062  20.710   1.266
  279    HA   ARG  39           HA       ARG  39  -2.558  22.017  -1.198
  280    HB2  ARG  39           2HB      ARG  39  -4.818  22.706  -0.836
  281    HB3  ARG  39           1HB      ARG  39  -4.765  20.954  -0.750
  282    HG2  ARG  39           2HG      ARG  39  -4.743  21.137   1.733
  283    HG3  ARG  39           1HG      ARG  39  -4.984  22.875   1.561
  284    HD2  ARG  39           2HD      ARG  39  -7.137  22.016   1.896
  285    HD3  ARG  39           1HD      ARG  39  -7.028  22.258   0.153
  286    HE   ARG  39           HE       ARG  39  -6.632  19.664   1.474
  287   HH11  ARG  39          1HH1      ARG  39  -7.895  21.508  -1.332
  288   HH12  ARG  39          2HH1      ARG  39  -8.753  20.178  -1.952
  289   HH21  ARG  39          1HH2      ARG  39  -7.867  17.867   0.549
  290   HH22  ARG  39          2HH2      ARG  39  -8.716  18.112  -0.916
  Start of MODEL    8
    1    H1   HIS   1           H        HIS   1  10.847 -25.432   3.453
    2    HA   HIS   1           HA       HIS   1  12.294 -23.065   2.896
    3    HB2  HIS   1           2HB      HIS   1  14.034 -24.891   2.667
    4    HB3  HIS   1           1HB      HIS   1  13.015 -25.643   1.456
    5    HD1  HIS   1           1HD      HIS   1  13.093 -24.606  -0.953
    6    HD2  HIS   1           2HD      HIS   1  15.406 -22.604   1.862
    7    HE1  HIS   1           1HE      HIS   1  14.579 -23.051  -2.255
    8    H    GLY   2           H        GLY   2  11.527 -22.243   0.818
    9    HA2  GLY   2           2HA      GLY   2  10.108 -22.967  -1.163
   10    HA3  GLY   2           1HA      GLY   2   8.990 -23.513   0.075
   11    H    GLU   3           H        GLU   3   8.307 -21.674  -1.863
   12    HA   GLU   3           HA       GLU   3   7.104 -19.841  -2.115
   13    HB2  GLU   3           2HB      GLU   3   7.475 -19.461   0.857
   14    HB3  GLU   3           1HB      GLU   3   6.529 -18.364  -0.137
   15    HG2  GLU   3           2HG      GLU   3   5.998 -21.303   0.248
   16    HG3  GLU   3           1HG      GLU   3   5.107 -19.977   1.000
   17    H    GLY   4           H        GLY   4   7.215 -17.366  -1.844
   18    HA2  GLY   4           2HA      GLY   4   8.780 -15.503  -1.578
   19    HA3  GLY   4           1HA      GLY   4  10.049 -16.584  -2.156
   20    H    THR   5           H        THR   5   6.851 -16.506  -3.559
   21    HA   THR   5           HA       THR   5   8.041 -15.172  -5.855
   22    HB   THR   5           HB       THR   5   7.400 -17.515  -6.378
   23    HG1  THR   5           1HG      THR   5   5.693 -16.927  -8.033
   24   HG21  THR   5          3HG2      THR   5   5.584 -17.850  -4.781
   25   HG22  THR   5          1HG2      THR   5   5.025 -18.208  -6.414
   26   HG23  THR   5          2HG2      THR   5   4.584 -16.684  -5.644
   27    H    PHE   6           H        PHE   6   7.301 -13.219  -6.238
   28    HA   PHE   6           HA       PHE   6   5.240 -12.113  -4.592
   29    HB2  PHE   6           2HB      PHE   6   6.721 -10.850  -6.914
   30    HB3  PHE   6           1HB      PHE   6   5.714  -9.997  -5.755
   31    HD1  PHE   6           1HD      PHE   6   6.398 -10.102  -3.296
   32    HD2  PHE   6           2HD      PHE   6   9.008 -11.154  -6.491
   33    HE1  PHE   6           1HE      PHE   6   8.333  -9.778  -1.819
   34    HE2  PHE   6           2HE      PHE   6  10.945 -10.838  -5.021
   35    HZ   PHE   6           HZ       PHE   6  10.615 -10.148  -2.678
   36    H    THR   7           H        THR   7   3.151 -12.132  -4.977
   37    HA   THR   7           HA       THR   7   2.245 -12.568  -7.735
   38    HB   THR   7           HB       THR   7   0.885 -13.425  -5.177
   39    HG1  THR   7           1HG      THR   7   2.867 -14.493  -5.559
   40   HG21  THR   7          3HG2      THR   7  -0.472 -14.833  -6.680
   41   HG22  THR   7          1HG2      THR   7   0.394 -14.188  -8.074
   42   HG23  THR   7          2HG2      THR   7  -0.631 -13.130  -7.107
   43    H    SER   8           H        SER   8   1.068 -10.937  -8.559
   44    HA   SER   8           HA       SER   8   0.451  -8.593  -7.180
   45    HB2  SER   8           2HB      SER   8  -0.719  -9.646  -9.755
   46    HB3  SER   8           1HB      SER   8  -0.711  -7.964  -9.220
   47    HG   SER   8           HG       SER   8   0.952  -8.320 -10.642
   48    H    ASP   9           H        ASP   9  -1.300  -7.906  -6.202
   49    HA   ASP   9           HA       ASP   9  -3.343  -7.619  -5.369
   50    HB2  ASP   9           2HB      ASP   9  -4.314  -8.254  -7.551
   51    HB3  ASP   9           1HB      ASP   9  -4.285  -9.946  -7.063
   52    H    LEU  10           H        LEU  10  -2.046 -10.747  -5.374
   53    HA   LEU  10           HA       LEU  10  -3.305 -11.727  -3.015
   54    HB2  LEU  10           2HB      LEU  10  -2.117 -13.074  -4.785
   55    HB3  LEU  10           1HB      LEU  10  -0.628 -12.381  -4.212
   56    HG   LEU  10           HG       LEU  10  -2.342 -14.061  -2.368
   57   HD11  LEU  10          1HD1      LEU  10  -1.049 -16.004  -3.016
   58   HD12  LEU  10          2HD1      LEU  10  -0.209 -15.065  -4.247
   59   HD13  LEU  10          3HD1      LEU  10  -1.940 -15.372  -4.398
   60   HD21  LEU  10          3HD2      LEU  10  -0.173 -14.531  -1.301
   61   HD22  LEU  10          1HD2      LEU  10  -0.507 -12.798  -1.353
   62   HD23  LEU  10          2HD2      LEU  10   0.625 -13.510  -2.498
   63    H    SER  11           H        SER  11  -0.328  -9.971  -3.758
   64    HA   SER  11           HA       SER  11   0.430  -9.621  -1.026
   65    HB2  SER  11           2HB      SER  11   2.089  -8.041  -2.112
   66    HB3  SER  11           1HB      SER  11   2.135  -9.696  -2.720
   67    HG   SER  11           HG       SER  11   1.789  -8.886  -4.615
   68    H    LYS  12           H        LYS  12  -1.780  -8.330  -3.133
   69    HA   LYS  12           HA       LYS  12  -2.960  -6.497  -3.439
   70    HB2  LYS  12           2HB      LYS  12  -4.035  -7.596  -1.595
   71    HB3  LYS  12           1HB      LYS  12  -3.089  -6.645  -0.450
   72    HG2  LYS  12           2HG      LYS  12  -5.215  -5.711  -0.571
   73    HG3  LYS  12           1HG      LYS  12  -4.133  -4.592  -1.387
   74    HD2  LYS  12           2HD      LYS  12  -6.085  -4.671  -2.753
   75    HD3  LYS  12           1HD      LYS  12  -4.919  -5.706  -3.569
   76    HE2  LYS  12           2HE      LYS  12  -5.984  -7.678  -2.692
   77    HE3  LYS  12           1HE      LYS  12  -7.084  -6.703  -1.716
   78    HZ1  LYS  12           3HZ      LYS  12  -7.926  -5.758  -3.874
   79    HZ2  LYS  12           1HZ      LYS  12  -8.243  -7.404  -3.669
   80    HZ3  LYS  12           2HZ      LYS  12  -6.999  -6.929  -4.678
   81    H    GLN  13           H        GLN  13  -0.934  -5.724  -4.020
   82    HA   GLN  13           HA       GLN  13  -0.095  -3.329  -2.567
   83    HB2  GLN  13           2HB      GLN  13   1.208  -4.726  -4.903
   84    HB3  GLN  13           1HB      GLN  13   1.810  -3.257  -4.154
   85    HG2  GLN  13           2HG      GLN  13   2.123  -4.456  -2.054
   86    HG3  GLN  13           1HG      GLN  13   1.520  -5.931  -2.812
   87   HE21  GLN  13          1HE2      GLN  13   2.776  -6.960  -4.325
   88   HE22  GLN  13          2HE2      GLN  13   4.458  -6.635  -4.518
   89    H    MET  14           H        MET  14   0.060  -1.340  -3.705
   90    HA   MET  14           HA       MET  14  -1.064  -1.024  -6.306
   91    HB2  MET  14           2HB      MET  14  -3.090  -1.375  -4.868
   92    HB3  MET  14           1HB      MET  14  -2.563  -0.050  -3.850
   93    HG2  MET  14           2HG      MET  14  -2.893   1.506  -5.699
   94    HG3  MET  14           1HG      MET  14  -3.354   0.166  -6.746
   95    HE1  MET  14           3HE      MET  14  -4.338   2.292  -3.582
   96    HE2  MET  14           1HE      MET  14  -4.346   0.654  -2.930
   97    HE3  MET  14           2HE      MET  14  -5.859   1.538  -3.106
   98    H    GLU  15           H        GLU  15  -0.903   1.337  -6.828
   99    HA   GLU  15           HA       GLU  15   1.155   2.619  -5.362
  100    HB2  GLU  15           2HB      GLU  15   0.746   4.553  -6.918
  101    HB3  GLU  15           1HB      GLU  15   1.086   3.046  -7.738
  102    HG2  GLU  15           2HG      GLU  15  -1.407   2.781  -8.036
  103    HG3  GLU  15           1HG      GLU  15  -1.562   4.440  -7.463
  104    H    GLU  16           H        GLU  16   0.535   2.740  -3.375
  105    HA   GLU  16           HA       GLU  16  -2.041   3.299  -2.480
  106    HB2  GLU  16           2HB      GLU  16  -1.061   3.206  -0.219
  107    HB3  GLU  16           1HB      GLU  16  -0.640   1.834  -1.234
  108    HG2  GLU  16           2HG      GLU  16   1.549   2.916  -1.669
  109    HG3  GLU  16           1HG      GLU  16   1.069   4.187  -0.542
  110    H    GLU  17           H        GLU  17  -2.454   4.852  -0.635
  111    HA   GLU  17           HA       GLU  17  -2.235   7.398  -1.766
  112    HB2  GLU  17           2HB      GLU  17  -3.581   6.441   0.744
  113    HB3  GLU  17           1HB      GLU  17  -3.851   7.960  -0.082
  114    HG2  GLU  17           2HG      GLU  17  -4.852   6.875  -1.956
  115    HG3  GLU  17           1HG      GLU  17  -4.410   5.286  -1.341
  116    H    ALA  18           H        ALA  18  -1.875   8.927  -0.440
  117    HA   ALA  18           HA       ALA  18  -0.491  10.482   0.624
  118    HB1  ALA  18           1HB      ALA  18  -0.200   8.337   2.723
  119    HB2  ALA  18           2HB      ALA  18  -1.547   9.470   2.606
  120    HB3  ALA  18           3HB      ALA  18   0.081  10.063   2.938
  121    H    VAL  19           H        VAL  19   0.895   7.816  -0.730
  122    HA   VAL  19           HA       VAL  19   3.521   8.922  -0.196
  123    HB   VAL  19           HB       VAL  19   3.310   6.471   0.178
  124   HG11  VAL  19          1HG1      VAL  19   2.805   6.298  -2.766
  125   HG12  VAL  19          2HG1      VAL  19   1.647   5.964  -1.485
  126   HG13  VAL  19          3HG1      VAL  19   3.074   4.931  -1.679
  127   HG21  VAL  19          3HG2      VAL  19   5.454   7.385  -0.383
  128   HG22  VAL  19          1HG2      VAL  19   5.083   7.228  -2.101
  129   HG23  VAL  19          2HG2      VAL  19   5.265   5.777  -1.105
  130    H    ARG  20           H        ARG  20   1.258   8.054  -2.688
  131    HA   ARG  20           HA       ARG  20   2.497   9.057  -4.981
  132    HB2  ARG  20           2HB      ARG  20  -0.323   8.760  -4.072
  133    HB3  ARG  20           1HB      ARG  20   0.003   9.477  -5.632
  134    HG2  ARG  20           2HG      ARG  20   1.059   6.766  -4.877
  135    HG3  ARG  20           1HG      ARG  20  -0.575   6.977  -5.501
  136    HD2  ARG  20           2HD      ARG  20   0.848   6.424  -7.366
  137    HD3  ARG  20           1HD      ARG  20   0.391   8.109  -7.473
  138    HE   ARG  20           HE       ARG  20   2.935   7.553  -6.226
  139   HH11  ARG  20          1HH1      ARG  20   1.171   8.522  -9.143
  140   HH12  ARG  20          2HH1      ARG  20   2.550   9.126  -9.943
  141   HH21  ARG  20          1HH2      ARG  20   4.855   8.362  -7.356
  142   HH22  ARG  20          2HH2      ARG  20   4.703   8.989  -8.924
  143    H    CYS  21           H        CYS  21   1.206  10.640  -2.270
  144    HA   CYS  21           HA       CYS  21   1.100  13.247  -3.617
  145    HB2  CYS  21           2HB      CYS  21  -0.966  12.632  -2.465
  146    HB3  CYS  21           1HB      CYS  21  -0.097  12.386  -0.954
  147    H    PHE  22           H        PHE  22   3.254  11.400  -1.923
  148    HA   PHE  22           HA       PHE  22   3.945  13.046   0.274
  149    HB2  PHE  22           2HB      PHE  22   4.452  10.583  -0.063
  150    HB3  PHE  22           1HB      PHE  22   5.773  11.115  -1.102
  151    HD1  PHE  22           2HD      PHE  22   7.712  12.274  -0.135
  152    HD2  PHE  22           1HD      PHE  22   4.557  10.755   2.269
  153    HE1  PHE  22           2HE      PHE  22   9.145  12.474   1.850
  154    HE2  PHE  22           1HE      PHE  22   5.973  10.949   4.269
  155    HZ   PHE  22           HZ       PHE  22   8.273  11.807   4.065
  156    H    ILE  23           H        ILE  23   5.685  12.465  -2.755
  157    HA   ILE  23           HA       ILE  23   7.534  14.594  -2.231
  158    HB   ILE  23           HB       ILE  23   7.123  13.173  -4.891
  159   HG12  ILE  23          2HG1      ILE  23   9.280  11.921  -4.088
  160   HG13  ILE  23          1HG1      ILE  23   8.703  12.360  -2.485
  161   HG21  ILE  23          1HG2      ILE  23   9.526  14.614  -3.782
  162   HG22  ILE  23          2HG2      ILE  23   8.430  15.234  -5.011
  163   HG23  ILE  23          3HG2      ILE  23   9.435  13.823  -5.358
  164   HD11  ILE  23          3HD1      ILE  23   6.645  11.123  -2.887
  165   HD12  ILE  23          1HD1      ILE  23   8.069  10.107  -3.091
  166   HD13  ILE  23          2HD1      ILE  23   7.204  10.713  -4.507
  167    H    GLU  24           H        GLU  24   4.594  14.182  -3.802
  168    HA   GLU  24           HA       GLU  24   4.566  16.425  -5.522
  169    HB2  GLU  24           2HB      GLU  24   2.212  15.129  -4.179
  170    HB3  GLU  24           1HB      GLU  24   2.246  16.053  -5.679
  171    HG2  GLU  24           2HG      GLU  24   3.579  13.448  -5.204
  172    HG3  GLU  24           1HG      GLU  24   2.047  13.658  -6.029
  173    H    CYS  25           H        CYS  25   3.558  15.859  -2.228
  174    HA   CYS  25           HA       CYS  25   2.642  18.545  -1.862
  175    HB2  CYS  25           2HB      CYS  25   1.794  16.553  -0.552
  176    HB3  CYS  25           1HB      CYS  25   3.319  16.552   0.317
  177    H    LEU  26           H        LEU  26   5.711  16.992  -1.756
  178    HA   LEU  26           HA       LEU  26   7.004  19.089  -0.269
  179    HB2  LEU  26           2HB      LEU  26   8.154  16.961  -2.081
  180    HB3  LEU  26           1HB      LEU  26   9.110  18.043  -1.090
  181    HG   LEU  26           HG       LEU  26   7.196  15.941  -0.075
  182   HD11  LEU  26          1HD1      LEU  26  10.203  16.068  -0.019
  183   HD12  LEU  26          2HD1      LEU  26   9.236  14.999  -1.032
  184   HD13  LEU  26          3HD1      LEU  26   9.206  14.818   0.722
  185   HD21  LEU  26          3HD2      LEU  26   8.153  16.497   2.131
  186   HD22  LEU  26          1HD2      LEU  26   7.249  17.839   1.429
  187   HD23  LEU  26          2HD2      LEU  26   9.009  17.846   1.390
  188    H    LYS  27           H        LYS  27   5.684  18.881  -3.254
  189    HA   LYS  27           HA       LYS  27   7.334  20.993  -4.457
  190    HB2  LYS  27           2HB      LYS  27   5.041  19.373  -5.622
  191    HB3  LYS  27           1HB      LYS  27   6.017  20.534  -6.504
  192    HG2  LYS  27           2HG      LYS  27   7.939  19.128  -6.382
  193    HG3  LYS  27           1HG      LYS  27   7.142  18.046  -5.237
  194    HD2  LYS  27           2HD      LYS  27   5.481  17.472  -6.995
  195    HD3  LYS  27           1HD      LYS  27   6.363  18.500  -8.119
  196    HE2  LYS  27           2HE      LYS  27   8.294  17.092  -8.016
  197    HE3  LYS  27           1HE      LYS  27   7.608  16.163  -6.684
  198    HZ1  LYS  27           3HZ      LYS  27   6.440  16.254  -9.418
  199    HZ2  LYS  27           1HZ      LYS  27   5.952  15.285  -8.122
  200    HZ3  LYS  27           2HZ      LYS  27   7.449  15.029  -8.845
  201    H    GLY  28           H        GLY  28   3.935  20.113  -3.904
  202    HA2  GLY  28           2HA      GLY  28   2.560  21.648  -2.552
  203    HA3  GLY  28           1HA      GLY  28   3.253  22.972  -3.463
  204    H    ILE  29           H        ILE  29   1.187  20.140  -3.701
  205    HA   ILE  29           HA       ILE  29  -0.199  21.492  -5.728
  206    HB   ILE  29           HB       ILE  29  -0.509  19.399  -7.053
  207   HG12  ILE  29          2HG1      ILE  29   1.421  17.697  -6.929
  208   HG13  ILE  29          1HG1      ILE  29   1.722  18.333  -5.318
  209   HG21  ILE  29          1HG2      ILE  29   0.904  21.081  -7.916
  210   HG22  ILE  29          2HG2      ILE  29   1.616  19.498  -8.266
  211   HG23  ILE  29          3HG2      ILE  29   2.259  20.490  -6.953
  212   HD11  ILE  29          3HD1      ILE  29  -0.500  17.688  -4.637
  213   HD12  ILE  29          1HD1      ILE  29   0.357  16.272  -5.235
  214   HD13  ILE  29          2HD1      ILE  29  -0.854  17.095  -6.239
  215    H    GLY  30           H        GLY  30  -1.930  21.585  -5.149
  216    HA2  GLY  30           2HA      GLY  30  -3.224  19.598  -3.376
  217    HA3  GLY  30           1HA      GLY  30  -3.829  21.236  -3.575
  218    H    HIS  31           H        HIS  31  -5.137  18.531  -3.911
  219    HA   HIS  31           HA       HIS  31  -6.857  17.724  -4.975
  220    HB2  HIS  31           2HB      HIS  31  -6.689  20.378  -6.212
  221    HB3  HIS  31           1HB      HIS  31  -7.957  19.251  -6.752
  222    HD1  HIS  31           1HD      HIS  31 -10.025  19.164  -5.228
  223    HD2  HIS  31           2HD      HIS  31  -6.841  21.201  -3.501
  224    HE1  HIS  31           1HE      HIS  31 -10.923  20.199  -3.139
  225    H    LYS  32           H        LYS  32  -4.043  17.542  -6.186
  226    HA   LYS  32           HA       LYS  32  -4.642  16.915  -8.936
  227    HB2  LYS  32           2HB      LYS  32  -2.191  16.232  -7.334
  228    HB3  LYS  32           1HB      LYS  32  -2.368  15.992  -9.057
  229    HG2  LYS  32           2HG      LYS  32  -2.461  18.666  -7.673
  230    HG3  LYS  32           1HG      LYS  32  -1.075  18.008  -8.548
  231    HD2  LYS  32           2HD      LYS  32  -2.438  17.962 -10.611
  232    HD3  LYS  32           1HD      LYS  32  -3.785  18.665  -9.711
  233    HE2  LYS  32           2HE      LYS  32  -2.433  20.630  -9.212
  234    HE3  LYS  32           1HE      LYS  32  -1.084  19.942 -10.108
  235    HZ1  LYS  32           3HZ      LYS  32  -2.440  20.055 -12.137
  236    HZ2  LYS  32           1HZ      LYS  32  -2.303  21.565 -11.403
  237    HZ3  LYS  32           2HZ      LYS  32  -3.725  20.693 -11.263
  238    H    TYR  33           H        TYR  33  -4.291  15.048  -5.992
  239    HA   TYR  33           HA       TYR  33  -5.186  12.711  -7.540
  240    HB2  TYR  33           2HB      TYR  33  -3.637  12.695  -4.913
  241    HB3  TYR  33           1HB      TYR  33  -4.118  11.292  -5.836
  242    HD1  TYR  33           1HD      TYR  33  -1.936  14.299  -5.960
  243    HD2  TYR  33           2HD      TYR  33  -2.711  10.417  -7.528
  244    HE1  TYR  33           1HE      TYR  33   0.159  14.385  -7.130
  245    HE2  TYR  33           2HE      TYR  33  -0.570  10.487  -8.720
  246    HH   TYR  33           HH       TYR  33   1.805  12.876  -8.089
  247    HA   PRO  34           HA       PRO  34  -9.019  12.683  -5.258
  248    HB2  PRO  34           2HB      PRO  34  -8.980  10.029  -4.330
  249    HB3  PRO  34           1HB      PRO  34  -9.631  10.579  -5.871
  250    HG2  PRO  34           2HG      PRO  34  -6.964   9.387  -5.274
  251    HG3  PRO  34           1HG      PRO  34  -8.015   9.152  -6.677
  252    HD2  PRO  34           2HD      PRO  34  -5.869  10.682  -6.856
  253    HD3  PRO  34           1HD      PRO  34  -7.385  11.175  -7.638
  254    H    PHE  35           H        PHE  35  -6.148  11.661  -3.728
  255    HA   PHE  35           HA       PHE  35  -7.240  12.189  -1.042
  256    HB2  PHE  35           2HB      PHE  35  -5.498  10.591  -0.241
  257    HB3  PHE  35           1HB      PHE  35  -6.758   9.867  -1.247
  258    HD1  PHE  35           1HD      PHE  35  -3.234  10.796  -1.058
  259    HD2  PHE  35           2HD      PHE  35  -6.278   9.051  -3.416
  260    HE1  PHE  35           1HE      PHE  35  -1.542   9.912  -2.563
  261    HE2  PHE  35           2HE      PHE  35  -4.653   8.157  -4.941
  262    HZ   PHE  35           HZ       PHE  35  -2.245   8.559  -4.563
  263    H    CYS  36           H        CYS  36  -5.622  13.775  -3.212
  264    HA   CYS  36           HA       CYS  36  -3.514  14.517  -1.335
  265    HB2  CYS  36           2HB      CYS  36  -2.521  13.316  -3.214
  266    HB3  CYS  36           1HB      CYS  36  -3.203  14.529  -4.294
  267    H    HIS  37           H        HIS  37  -4.303  16.202  -0.533
  268    HA   HIS  37           HA       HIS  37  -4.615  18.494  -2.326
  269    HB2  HIS  37           2HB      HIS  37  -5.996  18.290   0.358
  270    HB3  HIS  37           1HB      HIS  37  -6.407  19.324  -1.002
  271    HD1  HIS  37           1HD      HIS  37  -7.351  16.189   0.612
  272    HD2  HIS  37           2HD      HIS  37  -7.610  17.805  -3.187
  273    HE1  HIS  37           1HE      HIS  37  -9.011  14.757  -0.625
  274    H    CYS  38           H        CYS  38  -2.193  18.498  -1.936
  275    HA   CYS  38           HA       CYS  38  -0.954  18.581   0.522
  276    HB2  CYS  38           2HB      CYS  38   0.260  18.698  -1.634
  277    HB3  CYS  38           1HB      CYS  38  -0.187  20.394  -1.770
  278    H    ARG  39           H        ARG  39  -0.789  19.754   2.184
  279    HA   ARG  39           HA       ARG  39  -2.934  21.251   2.575
  280    HB2  ARG  39           2HB      ARG  39  -1.998  21.864   4.845
  281    HB3  ARG  39           1HB      ARG  39  -1.992  20.157   4.448
  282    HG2  ARG  39           2HG      ARG  39   0.371  20.225   3.978
  283    HG3  ARG  39           1HG      ARG  39   0.397  21.971   4.211
  284    HD2  ARG  39           2HD      ARG  39  -0.358  19.969   6.336
  285    HD3  ARG  39           1HD      ARG  39   1.244  20.683   6.164
  286    HE   ARG  39           HE       ARG  39  -0.538  22.785   6.298
  287   HH11  ARG  39          1HH1      ARG  39   0.443  20.127   8.448
  288   HH12  ARG  39          2HH1      ARG  39   0.190  20.992   9.874
  289   HH21  ARG  39          1HH2      ARG  39  -0.878  23.986   8.294
  290   HH22  ARG  39          2HH2      ARG  39  -0.577  23.255   9.787
  Start of MODEL    9
    1    H1   HIS   1           H        HIS   1  24.062  11.473  -6.973
    2    HA   HIS   1           HA       HIS   1  23.792  14.021  -7.467
    3    HB2  HIS   1           2HB      HIS   1  21.485  14.457  -8.327
    4    HB3  HIS   1           1HB      HIS   1  22.520  13.704  -9.525
    5    HD1  HIS   1           1HD      HIS   1  19.210  13.435  -8.091
    6    HD2  HIS   1           2HD      HIS   1  21.977  10.792  -9.689
    7    HE1  HIS   1           1HE      HIS   1  17.918  11.364  -8.696
    8    H    GLY   2           H        GLY   2  23.820  14.407  -5.387
    9    HA2  GLY   2           2HA      GLY   2  22.808  14.836  -3.335
   10    HA3  GLY   2           1HA      GLY   2  21.437  13.857  -3.835
   11    H    GLU   3           H        GLU   3  22.327  13.506  -1.338
   12    HA   GLU   3           HA       GLU   3  24.036  11.149  -1.462
   13    HB2  GLU   3           2HB      GLU   3  24.159  11.304   0.990
   14    HB3  GLU   3           1HB      GLU   3  24.692  12.780   0.203
   15    HG2  GLU   3           2HG      GLU   3  22.592  13.851   0.728
   16    HG3  GLU   3           1HG      GLU   3  21.986  12.352   1.437
   17    H    GLY   4           H        GLY   4  20.806  12.081  -1.171
   18    HA2  GLY   4           2HA      GLY   4  19.856   9.710   0.124
   19    HA3  GLY   4           1HA      GLY   4  18.884  10.937  -0.691
   20    H    THR   5           H        THR   5  19.835   7.814  -0.848
   21    HA   THR   5           HA       THR   5  19.991   7.733  -3.741
   22    HB   THR   5           HB       THR   5  20.273   5.488  -1.739
   23    HG1  THR   5           1HG      THR   5  21.971   7.509  -2.549
   24   HG21  THR   5          3HG2      THR   5  19.752   4.754  -4.039
   25   HG22  THR   5          1HG2      THR   5  21.408   4.335  -3.593
   26   HG23  THR   5          2HG2      THR   5  21.100   5.717  -4.645
   27    H    PHE   6           H        PHE   6  18.040   7.786  -4.663
   28    HA   PHE   6           HA       PHE   6  16.001   5.967  -3.645
   29    HB2  PHE   6           2HB      PHE   6  15.254   8.320  -3.655
   30    HB3  PHE   6           1HB      PHE   6  15.692   8.457  -5.348
   31    HD1  PHE   6           1HD      PHE   6  13.481   6.545  -3.051
   32    HD2  PHE   6           2HD      PHE   6  14.106   8.021  -6.992
   33    HE1  PHE   6           1HE      PHE   6  11.226   5.808  -3.679
   34    HE2  PHE   6           2HE      PHE   6  11.839   7.285  -7.622
   35    HZ   PHE   6           HZ       PHE   6  10.404   6.180  -5.968
   36    H    THR   7           H        THR   7  15.793   4.220  -4.793
   37    HA   THR   7           HA       THR   7  16.278   4.360  -7.655
   38    HB   THR   7           HB       THR   7  17.183   2.077  -5.860
   39    HG1  THR   7           1HG      THR   7  18.229   4.470  -6.335
   40   HG21  THR   7          3HG2      THR   7  18.443   1.368  -7.858
   41   HG22  THR   7          1HG2      THR   7  17.812   2.750  -8.743
   42   HG23  THR   7          2HG2      THR   7  16.720   1.467  -8.223
   43    H    SER   8           H        SER   8  14.839   3.085  -8.815
   44    HA   SER   8           HA       SER   8  12.303   2.670  -7.782
   45    HB2  SER   8           2HB      SER   8  13.547   1.306 -10.173
   46    HB3  SER   8           1HB      SER   8  11.829   1.625  -9.911
   47    HG   SER   8           HG       SER   8  13.906   3.342 -10.622
   48    H    ASP   9           H        ASP   9  11.555   1.144  -6.444
   49    HA   ASP   9           HA       ASP   9  11.024  -0.879  -5.535
   50    HB2  ASP   9           2HB      ASP   9  11.226  -1.828  -7.814
   51    HB3  ASP   9           1HB      ASP   9  12.941  -2.078  -7.548
   52    H    LEU  10           H        LEU  10  13.796   0.640  -5.211
   53    HA   LEU  10           HA       LEU  10  15.523  -1.181  -3.856
   54    HB2  LEU  10           2HB      LEU  10  16.526   0.763  -4.587
   55    HB3  LEU  10           1HB      LEU  10  15.299   1.806  -3.890
   56    HG   LEU  10           HG       LEU  10  16.174   1.142  -1.633
   57   HD11  LEU  10          1HD1      LEU  10  18.394  -0.088  -3.219
   58   HD12  LEU  10          2HD1      LEU  10  17.255  -0.883  -2.116
   59   HD13  LEU  10          3HD1      LEU  10  18.441   0.255  -1.484
   60   HD21  LEU  10          3HD2      LEU  10  18.042   2.580  -3.508
   61   HD22  LEU  10          1HD2      LEU  10  18.132   2.619  -1.738
   62   HD23  LEU  10          2HD2      LEU  10  16.711   3.256  -2.556
   63    H    SER  11           H        SER  11  13.076   1.060  -2.710
   64    HA   SER  11           HA       SER  11  13.631   0.328   0.000
   65    HB2  SER  11           2HB      SER  11  13.115   2.655  -0.641
   66    HB3  SER  11           1HB      SER  11  11.539   2.155  -1.227
   67    HG   SER  11           HG       SER  11  12.359   1.800   1.467
   68    H    LYS  12           H        LYS  12  11.752  -0.600  -2.631
   69    HA   LYS  12           HA       LYS  12   9.914  -1.754  -3.054
   70    HB2  LYS  12           2HB      LYS  12  11.650  -3.404  -2.604
   71    HB3  LYS  12           1HB      LYS  12  11.028  -3.576  -0.961
   72    HG2  LYS  12           2HG      LYS  12   8.846  -4.267  -1.895
   73    HG3  LYS  12           1HG      LYS  12   9.541  -4.199  -3.516
   74    HD2  LYS  12           2HD      LYS  12  11.199  -5.838  -2.825
   75    HD3  LYS  12           1HD      LYS  12  10.408  -5.945  -1.245
   76    HE2  LYS  12           2HE      LYS  12   9.157  -6.606  -3.917
   77    HE3  LYS  12           1HE      LYS  12   9.700  -7.789  -2.731
   78    HZ1  LYS  12           3HZ      LYS  12   7.327  -7.493  -2.592
   79    HZ2  LYS  12           1HZ      LYS  12   7.464  -5.836  -2.353
   80    HZ3  LYS  12           2HZ      LYS  12   8.008  -6.916  -1.191
   81    H    GLN  13           H        GLN  13   8.918  -0.008  -2.015
   82    HA   GLN  13           HA       GLN  13   7.138  -0.934   0.123
   83    HB2  GLN  13           2HB      GLN  13   8.012   1.868  -0.566
   84    HB3  GLN  13           1HB      GLN  13   6.590   1.556   0.409
   85    HG2  GLN  13           2HG      GLN  13   8.066   0.323   2.018
   86    HG3  GLN  13           1HG      GLN  13   9.449   0.857   1.065
   87   HE21  GLN  13          1HE2      GLN  13  10.131   2.966   1.244
   88   HE22  GLN  13          2HE2      GLN  13   9.452   4.095   2.370
   89    H    MET  14           H        MET  14   4.926  -0.483  -0.092
   90    HA   MET  14           HA       MET  14   3.889  -0.951  -2.654
   91    HB2  MET  14           2HB      MET  14   2.456   0.174  -0.228
   92    HB3  MET  14           1HB      MET  14   1.675  -0.449  -1.660
   93    HG2  MET  14           2HG      MET  14   1.500  -2.089   0.042
   94    HG3  MET  14           1HG      MET  14   2.648  -2.683  -1.146
   95    HE1  MET  14           3HE      MET  14   3.184   0.002   1.728
   96    HE2  MET  14           1HE      MET  14   3.785  -1.033   3.021
   97    HE3  MET  14           2HE      MET  14   2.130  -1.215   2.446
   98    H    GLU  15           H        GLU  15   3.285   0.438  -4.226
   99    HA   GLU  15           HA       GLU  15   3.769   3.252  -3.868
  100    HB2  GLU  15           2HB      GLU  15   3.612   1.494  -6.056
  101    HB3  GLU  15           1HB      GLU  15   2.218   2.548  -6.232
  102    HG2  GLU  15           2HG      GLU  15   5.077   3.441  -5.971
  103    HG3  GLU  15           1HG      GLU  15   4.148   3.387  -7.464
  104    H    GLU  16           H        GLU  16   2.433   3.638  -2.200
  105    HA   GLU  16           HA       GLU  16  -0.351   2.834  -2.312
  106    HB2  GLU  16           2HB      GLU  16   1.172   2.047  -0.526
  107    HB3  GLU  16           1HB      GLU  16   1.400   3.699  -0.014
  108    HG2  GLU  16           2HG      GLU  16  -0.923   3.827   0.663
  109    HG3  GLU  16           1HG      GLU  16  -1.205   2.192   0.058
  110    H    GLU  17           H        GLU  17  -1.929   4.259  -1.261
  111    HA   GLU  17           HA       GLU  17  -2.151   6.747  -2.258
  112    HB2  GLU  17           2HB      GLU  17  -4.035   6.846  -0.642
  113    HB3  GLU  17           1HB      GLU  17  -4.047   5.399  -1.642
  114    HG2  GLU  17           2HG      GLU  17  -3.063   4.118   0.208
  115    HG3  GLU  17           1HG      GLU  17  -3.076   5.573   1.201
  116    H    ALA  18           H        ALA  18  -2.154   8.396  -1.287
  117    HA   ALA  18           HA       ALA  18  -1.333  10.334  -0.282
  118    HB1  ALA  18           1HB      ALA  18  -0.942  10.369   2.132
  119    HB2  ALA  18           2HB      ALA  18  -0.921   8.612   2.170
  120    HB3  ALA  18           3HB      ALA  18  -2.413   9.465   1.756
  121    H    VAL  19           H        VAL  19   0.666   7.816  -1.016
  122    HA   VAL  19           HA       VAL  19   3.102   9.241  -0.288
  123    HB   VAL  19           HB       VAL  19   2.767   6.828  -2.122
  124   HG11  VAL  19          1HG1      VAL  19   5.141   6.423  -1.653
  125   HG12  VAL  19          2HG1      VAL  19   5.185   7.895  -0.678
  126   HG13  VAL  19          3HG1      VAL  19   4.871   7.994  -2.411
  127   HG21  VAL  19          3HG2      VAL  19   3.380   6.871   0.829
  128   HG22  VAL  19          1HG2      VAL  19   3.433   5.440  -0.205
  129   HG23  VAL  19          2HG2      VAL  19   1.904   6.275   0.069
  130    H    ARG  20           H        ARG  20   1.121   8.327  -2.932
  131    HA   ARG  20           HA       ARG  20   2.258   9.866  -4.985
  132    HB2  ARG  20           2HB      ARG  20  -0.310   8.499  -4.500
  133    HB3  ARG  20           1HB      ARG  20  -0.273   9.646  -5.814
  134    HG2  ARG  20           2HG      ARG  20   1.669   7.358  -5.516
  135    HG3  ARG  20           1HG      ARG  20   0.148   7.223  -6.391
  136    HD2  ARG  20           2HD      ARG  20   2.049   7.634  -7.907
  137    HD3  ARG  20           1HD      ARG  20   0.865   8.928  -7.970
  138    HE   ARG  20           HE       ARG  20   2.405  10.379  -7.105
  139   HH11  ARG  20          1HH1      ARG  20   3.718   7.095  -6.801
  140   HH12  ARG  20          2HH1      ARG  20   5.325   7.606  -6.657
  141   HH21  ARG  20          1HH2      ARG  20   4.694  11.081  -6.908
  142   HH22  ARG  20          2HH2      ARG  20   5.889   9.888  -6.730
  143    H    CYS  21           H        CYS  21   0.755  10.866  -2.246
  144    HA   CYS  21           HA       CYS  21   0.066  13.437  -3.480
  145    HB2  CYS  21           2HB      CYS  21  -1.800  12.646  -2.174
  146    HB3  CYS  21           1HB      CYS  21  -0.758  12.299  -0.797
  147    H    PHE  22           H        PHE  22   1.898  11.926  -0.895
  148    HA   PHE  22           HA       PHE  22   2.754  14.038   0.574
  149    HB2  PHE  22           2HB      PHE  22   2.920  11.540   0.908
  150    HB3  PHE  22           1HB      PHE  22   4.386  11.617  -0.046
  151    HD1  PHE  22           2HD      PHE  22   6.346  12.904   0.846
  152    HD2  PHE  22           1HD      PHE  22   2.829  12.162   3.099
  153    HE1  PHE  22           2HE      PHE  22   7.567  13.432   2.879
  154    HE2  PHE  22           1HE      PHE  22   3.989  12.670   5.147
  155    HZ   PHE  22           HZ       PHE  22   6.397  13.324   5.087
  156    H    ILE  23           H        ILE  23   4.862  12.405  -1.821
  157    HA   ILE  23           HA       ILE  23   6.873  14.402  -1.610
  158    HB   ILE  23           HB       ILE  23   6.577  12.285  -3.786
  159   HG12  ILE  23          2HG1      ILE  23   8.498  11.179  -2.552
  160   HG13  ILE  23          1HG1      ILE  23   8.188  12.322  -1.244
  161   HG21  ILE  23          1HG2      ILE  23   7.997  14.117  -4.537
  162   HG22  ILE  23          2HG2      ILE  23   8.966  12.664  -4.239
  163   HG23  ILE  23          3HG2      ILE  23   8.954  13.976  -3.060
  164   HD11  ILE  23          3HD1      ILE  23   7.262  10.096  -0.828
  165   HD12  ILE  23          1HD1      ILE  23   6.238  10.268  -2.258
  166   HD13  ILE  23          2HD1      ILE  23   6.042  11.365  -0.881
  167    H    GLU  24           H        GLU  24   4.327  13.829  -3.762
  168    HA   GLU  24           HA       GLU  24   4.797  15.635  -5.869
  169    HB2  GLU  24           2HB      GLU  24   2.115  15.075  -4.613
  170    HB3  GLU  24           1HB      GLU  24   2.431  15.579  -6.261
  171    HG2  GLU  24           2HG      GLU  24   3.235  12.951  -5.077
  172    HG3  GLU  24           1HG      GLU  24   1.782  13.231  -6.000
  173    H    CYS  25           H        CYS  25   2.971  16.012  -2.885
  174    HA   CYS  25           HA       CYS  25   2.234  18.698  -3.235
  175    HB2  CYS  25           2HB      CYS  25   0.984  17.307  -1.820
  176    HB3  CYS  25           1HB      CYS  25   2.367  16.962  -0.785
  177    H    LEU  26           H        LEU  26   5.055  17.210  -1.876
  178    HA   LEU  26           HA       LEU  26   6.024  19.341  -0.370
  179    HB2  LEU  26           2HB      LEU  26   7.471  17.181  -1.844
  180    HB3  LEU  26           1HB      LEU  26   8.291  18.298  -0.759
  181    HG   LEU  26           HG       LEU  26   6.178  16.258  -0.028
  182   HD11  LEU  26          1HD1      LEU  26   7.971  15.176   1.204
  183   HD12  LEU  26          2HD1      LEU  26   9.103  16.411   0.658
  184   HD13  LEU  26          3HD1      LEU  26   8.377  15.307  -0.509
  185   HD21  LEU  26          3HD2      LEU  26   5.938  18.229   1.381
  186   HD22  LEU  26          1HD2      LEU  26   7.667  18.206   1.735
  187   HD23  LEU  26          2HD2      LEU  26   6.633  16.898   2.303
  188    H    LYS  27           H        LYS  27   5.883  19.044  -3.817
  189    HA   LYS  27           HA       LYS  27   7.872  21.186  -4.098
  190    HB2  LYS  27           2HB      LYS  27   7.734  20.887  -6.495
  191    HB3  LYS  27           1HB      LYS  27   8.035  19.344  -5.687
  192    HG2  LYS  27           2HG      LYS  27   5.692  18.765  -6.001
  193    HG3  LYS  27           1HG      LYS  27   5.428  20.313  -6.810
  194    HD2  LYS  27           2HD      LYS  27   7.034  19.705  -8.520
  195    HD3  LYS  27           1HD      LYS  27   7.332  18.165  -7.703
  196    HE2  LYS  27           2HE      LYS  27   5.005  17.533  -8.043
  197    HE3  LYS  27           1HE      LYS  27   4.693  19.076  -8.831
  198    HZ1  LYS  27           3HZ      LYS  27   5.042  17.288 -10.415
  199    HZ2  LYS  27           1HZ      LYS  27   6.574  17.004  -9.806
  200    HZ3  LYS  27           2HZ      LYS  27   6.240  18.465 -10.580
  201    H    GLY  28           H        GLY  28   4.671  20.907  -3.621
  202    HA2  GLY  28           2HA      GLY  28   3.386  22.879  -3.227
  203    HA3  GLY  28           1HA      GLY  28   4.250  23.674  -4.525
  204    H    ILE  29           H        ILE  29   2.376  20.618  -4.307
  205    HA   ILE  29           HA       ILE  29   0.672  21.822  -6.207
  206    HB   ILE  29           HB       ILE  29   0.272  19.762  -7.413
  207   HG12  ILE  29          2HG1      ILE  29   1.989  17.794  -7.058
  208   HG13  ILE  29          1HG1      ILE  29   2.103  18.441  -5.429
  209   HG21  ILE  29          1HG2      ILE  29   3.201  20.317  -7.309
  210   HG22  ILE  29          2HG2      ILE  29   1.982  21.090  -8.323
  211   HG23  ILE  29          3HG2      ILE  29   2.384  19.389  -8.569
  212   HD11  ILE  29          3HD1      ILE  29  -0.384  17.427  -6.792
  213   HD12  ILE  29          1HD1      ILE  29  -0.347  18.127  -5.182
  214   HD13  ILE  29          2HD1      ILE  29   0.502  16.612  -5.501
  215    H    GLY  30           H        GLY  30  -0.968  21.958  -5.486
  216    HA2  GLY  30           2HA      GLY  30  -2.007  20.929  -3.039
  217    HA3  GLY  30           1HA      GLY  30  -2.962  21.813  -4.215
  218    H    HIS  31           H        HIS  31  -4.717  20.691  -4.558
  219    HA   HIS  31           HA       HIS  31  -4.819  17.833  -4.222
  220    HB2  HIS  31           2HB      HIS  31  -7.035  19.637  -5.223
  221    HB3  HIS  31           1HB      HIS  31  -7.201  17.972  -4.707
  222    HD1  HIS  31           1HD      HIS  31  -6.619  17.628  -1.978
  223    HD2  HIS  31           2HD      HIS  31  -7.562  21.432  -3.360
  224    HE1  HIS  31           1HE      HIS  31  -7.391  18.935   0.041
  225    H    LYS  32           H        LYS  32  -3.371  17.237  -5.891
  226    HA   LYS  32           HA       LYS  32  -4.492  17.391  -8.604
  227    HB2  LYS  32           2HB      LYS  32  -2.090  17.982  -8.267
  228    HB3  LYS  32           1HB      LYS  32  -1.810  16.338  -7.705
  229    HG2  LYS  32           2HG      LYS  32  -2.378  15.464  -9.878
  230    HG3  LYS  32           1HG      LYS  32  -2.753  17.087 -10.462
  231    HD2  LYS  32           2HD      LYS  32  -0.423  17.746 -10.120
  232    HD3  LYS  32           1HD      LYS  32  -0.062  16.143  -9.484
  233    HE2  LYS  32           2HE      LYS  32  -1.105  16.668 -12.262
  234    HE3  LYS  32           1HE      LYS  32   0.599  16.479 -11.875
  235    HZ1  LYS  32           3HZ      LYS  32   0.159  14.235 -11.118
  236    HZ2  LYS  32           1HZ      LYS  32  -0.388  14.425 -12.689
  237    HZ3  LYS  32           2HZ      LYS  32  -1.490  14.400 -11.423
  238    H    TYR  33           H        TYR  33  -4.408  15.354  -5.981
  239    HA   TYR  33           HA       TYR  33  -5.192  13.030  -7.605
  240    HB2  TYR  33           2HB      TYR  33  -3.444  12.994  -5.123
  241    HB3  TYR  33           1HB      TYR  33  -4.069  11.564  -5.920
  242    HD1  TYR  33           1HD      TYR  33  -1.753  14.429  -6.265
  243    HD2  TYR  33           2HD      TYR  33  -2.938  10.652  -7.841
  244    HE1  TYR  33           1HE      TYR  33   0.231  14.407  -7.662
  245    HE2  TYR  33           2HE      TYR  33  -0.942  10.618  -9.250
  246    HH   TYR  33           HH       TYR  33   1.629  12.882  -8.823
  247    HA   PRO  34           HA       PRO  34  -8.958  13.040  -5.335
  248    HB2  PRO  34           2HB      PRO  34  -9.061  10.282  -4.716
  249    HB3  PRO  34           1HB      PRO  34  -9.731  11.048  -6.152
  250    HG2  PRO  34           2HG      PRO  34  -7.144   9.631  -5.806
  251    HG3  PRO  34           1HG      PRO  34  -8.223   9.682  -7.210
  252    HD2  PRO  34           2HD      PRO  34  -5.953  11.062  -7.174
  253    HD3  PRO  34           1HD      PRO  34  -7.421  11.752  -7.895
  254    H    PHE  35           H        PHE  35  -6.464  11.029  -3.932
  255    HA   PHE  35           HA       PHE  35  -7.460  11.309  -1.221
  256    HB2  PHE  35           2HB      PHE  35  -5.498   9.754  -0.752
  257    HB3  PHE  35           1HB      PHE  35  -6.789   9.130  -1.778
  258    HD1  PHE  35           2HD      PHE  35  -3.334  10.377  -1.742
  259    HD2  PHE  35           1HD      PHE  35  -6.433   8.639  -4.056
  260    HE1  PHE  35           2HE      PHE  35  -1.727   9.904  -3.548
  261    HE2  PHE  35           1HE      PHE  35  -4.894   8.174  -5.841
  262    HZ   PHE  35           HZ       PHE  35  -2.502   8.791  -5.618
  263    H    CYS  36           H        CYS  36  -5.849  13.403  -2.973
  264    HA   CYS  36           HA       CYS  36  -3.680  13.741  -1.080
  265    HB2  CYS  36           2HB      CYS  36  -3.107  13.794  -3.453
  266    HB3  CYS  36           1HB      CYS  36  -4.084  15.245  -3.682
  267    H    HIS  37           H        HIS  37  -4.346  14.606   0.637
  268    HA   HIS  37           HA       HIS  37  -6.103  16.928   0.614
  269    HB2  HIS  37           2HB      HIS  37  -6.046  16.525   3.148
  270    HB3  HIS  37           1HB      HIS  37  -6.844  15.307   2.162
  271    HD1  HIS  37           1HD      HIS  37  -6.000  12.944   2.405
  272    HD2  HIS  37           2HD      HIS  37  -3.393  15.723   4.050
  273    HE1  HIS  37           1HE      HIS  37  -4.195  11.601   3.552
  274    H    CYS  38           H        CYS  38  -2.897  16.422   0.394
  275    HA   CYS  38           HA       CYS  38  -1.953  18.319   2.332
  276    HB2  CYS  38           2HB      CYS  38  -0.570  16.389   1.606
  277    HB3  CYS  38           1HB      CYS  38  -0.536  17.040  -0.024
  278    H    ARG  39           H        ARG  39  -1.121  20.388   1.857
  279    HA   ARG  39           HA       ARG  39  -2.199  21.585  -0.601
  280    HB2  ARG  39           2HB      ARG  39  -2.080  22.692   2.204
  281    HB3  ARG  39           1HB      ARG  39  -2.525  23.634   0.784
  282    HG2  ARG  39           2HG      ARG  39  -4.473  22.340   0.430
  283    HG3  ARG  39           1HG      ARG  39  -3.984  21.144   1.628
  284    HD2  ARG  39           2HD      ARG  39  -4.598  24.030   2.230
  285    HD3  ARG  39           1HD      ARG  39  -5.756  22.712   2.399
  286    HE   ARG  39           HE       ARG  39  -3.412  22.068   3.773
  287   HH11  ARG  39          1HH1      ARG  39  -6.193  24.238   4.078
  288   HH12  ARG  39          2HH1      ARG  39  -6.105  24.314   5.772
  289   HH21  ARG  39          1HH2      ARG  39  -3.353  22.116   6.074
  290   HH22  ARG  39          2HH2      ARG  39  -4.475  23.072   6.938
  Start of MODEL   10
    1    H1   HIS   1           H        HIS   1   7.031   1.941  26.132
    2    HA   HIS   1           HA       HIS   1   7.929   2.777  23.843
    3    HB2  HIS   1           2HB      HIS   1   8.120  -0.239  23.657
    4    HB3  HIS   1           1HB      HIS   1   8.163   0.836  22.274
    5    HD1  HIS   1           1HD      HIS   1  10.370   2.357  22.054
    6    HD2  HIS   1           2HD      HIS   1  10.438  -0.594  24.978
    7    HE1  HIS   1           1HE      HIS   1  12.776   2.117  22.732
    8    H    GLY   2           H        GLY   2   5.906   0.302  25.172
    9    HA2  GLY   2           2HA      GLY   2   3.583   0.102  25.061
   10    HA3  GLY   2           1HA      GLY   2   3.554   1.422  23.893
   11    H    GLU   3           H        GLU   3   2.065  -0.971  23.552
   12    HA   GLU   3           HA       GLU   3   3.622  -2.445  21.592
   13    HB2  GLU   3           2HB      GLU   3   0.824  -2.918  22.571
   14    HB3  GLU   3           1HB      GLU   3   1.673  -3.921  21.407
   15    HG2  GLU   3           2HG      GLU   3   3.398  -4.340  23.157
   16    HG3  GLU   3           1HG      GLU   3   2.337  -3.512  24.300
   17    H    GLY   4           H        GLY   4   3.753  -1.644  19.683
   18    HA2  GLY   4           2HA      GLY   4   2.320  -1.504  17.629
   19    HA3  GLY   4           1HA      GLY   4   1.383  -0.326  18.549
   20    H    THR   5           H        THR   5   2.811  -0.012  16.077
   21    HA   THR   5           HA       THR   5   4.285   2.314  16.928
   22    HB   THR   5           HB       THR   5   5.360   0.306  14.918
   23    HG1  THR   5           1HG      THR   5   5.520   0.528  17.584
   24   HG21  THR   5          3HG2      THR   5   6.599   2.843  16.035
   25   HG22  THR   5          1HG2      THR   5   5.968   2.658  14.398
   26   HG23  THR   5          2HG2      THR   5   7.371   1.724  14.915
   27    H    PHE   6           H        PHE   6   3.496   3.961  15.907
   28    HA   PHE   6           HA       PHE   6   1.685   3.761  13.724
   29    HB2  PHE   6           2HB      PHE   6   1.584   5.612  15.358
   30    HB3  PHE   6           1HB      PHE   6   3.175   6.153  14.850
   31    HD1  PHE   6           1HD      PHE   6  -0.368   5.914  13.904
   32    HD2  PHE   6           2HD      PHE   6   3.461   7.453  12.858
   33    HE1  PHE   6           1HE      PHE   6  -1.417   7.395  12.257
   34    HE2  PHE   6           2HE      PHE   6   2.410   8.932  11.203
   35    HZ   PHE   6           HZ       PHE   6  -0.022   8.910  10.905
   36    H    THR   7           H        THR   7   2.259   3.475  11.662
   37    HA   THR   7           HA       THR   7   5.062   3.983  10.991
   38    HB   THR   7           HB       THR   7   3.297   1.829   9.813
   39    HG1  THR   7           1HG      THR   7   3.845   1.817  12.203
   40   HG21  THR   7          3HG2      THR   7   5.316   2.508   8.521
   41   HG22  THR   7          1HG2      THR   7   5.436   0.857   9.133
   42   HG23  THR   7          2HG2      THR   7   6.302   2.160   9.940
   43    H    SER   8           H        SER   8   4.994   5.841   9.830
   44    HA   SER   8           HA       SER   8   3.638   5.698   7.279
   45    HB2  SER   8           2HB      SER   8   3.488   8.086   9.148
   46    HB3  SER   8           1HB      SER   8   2.892   8.052   7.484
   47    HG   SER   8           HG       SER   8   2.002   5.954   8.909
   48    H    ASP   9           H        ASP   9   4.979   6.267   5.704
   49    HA   ASP   9           HA       ASP   9   6.789   6.893   4.554
   50    HB2  ASP   9           2HB      ASP   9   6.652   9.156   5.381
   51    HB3  ASP   9           1HB      ASP   9   7.383   8.691   6.916
   52    H    LEU  10           H        LEU  10   7.266   5.909   7.768
   53    HA   LEU  10           HA       LEU  10   9.919   5.150   7.868
   54    HB2  LEU  10           2HB      LEU  10   8.199   5.182   9.699
   55    HB3  LEU  10           1HB      LEU  10   7.551   3.705   9.051
   56    HG   LEU  10           HG       LEU  10  10.360   3.928  10.175
   57   HD11  LEU  10          1HD1      LEU  10   8.733   4.492  11.887
   58   HD12  LEU  10          2HD1      LEU  10   9.438   2.907  12.194
   59   HD13  LEU  10          3HD1      LEU  10   7.815   3.032  11.519
   60   HD21  LEU  10          3HD2      LEU  10  10.209   1.500  10.377
   61   HD22  LEU  10          1HD2      LEU  10   9.966   1.985   8.698
   62   HD23  LEU  10          2HD2      LEU  10   8.583   1.522   9.692
   63    H    SER  11           H        SER  11   7.135   3.210   6.685
   64    HA   SER  11           HA       SER  11   9.138   1.532   5.357
   65    HB2  SER  11           2HB      SER  11   7.279  -0.146   5.187
   66    HB3  SER  11           1HB      SER  11   7.736   0.248   6.844
   67    HG   SER  11           HG       SER  11   5.444   0.203   6.345
   68    H    LYS  12           H        LYS  12   6.696   3.865   4.917
   69    HA   LYS  12           HA       LYS  12   5.670   4.871   3.195
   70    HB2  LYS  12           2HB      LYS  12   8.067   5.208   2.636
   71    HB3  LYS  12           1HB      LYS  12   8.017   3.766   1.642
   72    HG2  LYS  12           2HG      LYS  12   6.423   4.840   0.155
   73    HG3  LYS  12           1HG      LYS  12   6.445   6.284   1.174
   74    HD2  LYS  12           2HD      LYS  12   8.815   6.509   0.799
   75    HD3  LYS  12           1HD      LYS  12   8.783   5.064  -0.218
   76    HE2  LYS  12           2HE      LYS  12   7.307   6.152  -1.803
   77    HE3  LYS  12           1HE      LYS  12   7.188   7.573  -0.767
   78    HZ1  LYS  12           3HZ      LYS  12   9.525   8.008  -1.165
   79    HZ2  LYS  12           1HZ      LYS  12   8.677   7.926  -2.613
   80    HZ3  LYS  12           2HZ      LYS  12   9.666   6.642  -2.127
   81    H    GLN  13           H        GLN  13   5.226   1.977   3.699
   82    HA   GLN  13           HA       GLN  13   4.607   0.806   1.138
   83    HB2  GLN  13           2HB      GLN  13   4.277  -0.203   3.902
   84    HB3  GLN  13           1HB      GLN  13   3.774  -1.128   2.493
   85    HG2  GLN  13           2HG      GLN  13   6.575  -0.207   3.124
   86    HG3  GLN  13           1HG      GLN  13   5.962  -1.856   3.264
   87   HE21  GLN  13          1HE2      GLN  13   7.013   0.631   1.117
   88   HE22  GLN  13          2HE2      GLN  13   7.100  -0.334  -0.310
   89    H    MET  14           H        MET  14   2.865   2.691   3.280
   90    HA   MET  14           HA       MET  14   0.277   1.723   2.867
   91    HB2  MET  14           2HB      MET  14  -0.581   4.056   3.212
   92    HB3  MET  14           1HB      MET  14   0.543   3.525   4.450
   93    HG2  MET  14           2HG      MET  14   2.303   4.832   3.430
   94    HG3  MET  14           1HG      MET  14   1.211   5.322   2.139
   95    HE1  MET  14           3HE      MET  14   0.119   4.965   5.926
   96    HE2  MET  14           1HE      MET  14   0.565   6.551   6.547
   97    HE3  MET  14           2HE      MET  14   1.819   5.423   6.026
   98    H    GLU  15           H        GLU  15   2.099   3.991   0.887
   99    HA   GLU  15           HA       GLU  15   2.215   4.413  -1.273
  100    HB2  GLU  15           2HB      GLU  15   2.371   1.965  -1.348
  101    HB3  GLU  15           1HB      GLU  15   0.647   1.878  -1.631
  102    HG2  GLU  15           2HG      GLU  15   0.884   2.923  -3.762
  103    HG3  GLU  15           1HG      GLU  15   2.590   3.263  -3.451
  104    H    GLU  16           H        GLU  16  -1.061   3.372  -0.581
  105    HA   GLU  16           HA       GLU  16  -2.571   4.335  -2.590
  106    HB2  GLU  16           2HB      GLU  16  -4.429   4.540  -0.911
  107    HB3  GLU  16           1HB      GLU  16  -3.566   3.014  -0.887
  108    HG2  GLU  16           2HG      GLU  16  -2.280   3.810   1.068
  109    HG3  GLU  16           1HG      GLU  16  -3.218   5.299   1.041
  110    H    GLU  17           H        GLU  17  -1.706   6.394   0.284
  111    HA   GLU  17           HA       GLU  17  -2.003   8.669  -1.337
  112    HB2  GLU  17           2HB      GLU  17  -4.117   8.859  -0.432
  113    HB3  GLU  17           1HB      GLU  17  -3.748   7.797   0.887
  114    HG2  GLU  17           2HG      GLU  17  -4.287   9.942   1.801
  115    HG3  GLU  17           1HG      GLU  17  -2.563   9.641   1.984
  116    H    ALA  18           H        ALA  18  -1.088  10.306  -0.256
  117    HA   ALA  18           HA       ALA  18   0.571  11.458   0.514
  118    HB1  ALA  18           1HB      ALA  18  -0.416  10.926   2.674
  119    HB2  ALA  18           2HB      ALA  18   1.328  11.146   2.817
  120    HB3  ALA  18           3HB      ALA  18   0.640   9.520   2.825
  121    H    VAL  19           H        VAL  19   1.080   8.575  -0.635
  122    HA   VAL  19           HA       VAL  19   3.998   8.823  -0.626
  123    HB   VAL  19           HB       VAL  19   2.224   6.484  -1.412
  124   HG11  VAL  19          1HG1      VAL  19   4.309   5.229  -1.790
  125   HG12  VAL  19          2HG1      VAL  19   5.235   6.701  -1.485
  126   HG13  VAL  19          3HG1      VAL  19   4.174   6.603  -2.891
  127   HG21  VAL  19          3HG2      VAL  19   4.212   6.843   0.824
  128   HG22  VAL  19          1HG2      VAL  19   3.343   5.350   0.465
  129   HG23  VAL  19          2HG2      VAL  19   2.458   6.789   0.981
  130    H    ARG  20           H        ARG  20   1.229   8.156  -2.683
  131    HA   ARG  20           HA       ARG  20   2.358   8.743  -5.186
  132    HB2  ARG  20           2HB      ARG  20  -0.461   9.034  -4.193
  133    HB3  ARG  20           1HB      ARG  20  -0.039   9.109  -5.878
  134    HG2  ARG  20           2HG      ARG  20   0.192   6.745  -4.029
  135    HG3  ARG  20           1HG      ARG  20  -0.966   6.978  -5.338
  136    HD2  ARG  20           2HD      ARG  20   0.888   6.946  -6.956
  137    HD3  ARG  20           1HD      ARG  20   2.019   6.664  -5.629
  138    HE   ARG  20           HE       ARG  20  -0.052   4.786  -5.567
  139   HH11  ARG  20          1HH1      ARG  20   2.867   5.501  -7.446
  140   HH12  ARG  20          2HH1      ARG  20   3.136   3.872  -7.864
  141   HH21  ARG  20          1HH2      ARG  20   0.301   2.608  -6.213
  142   HH22  ARG  20          2HH2      ARG  20   1.658   2.203  -7.161
  143    H    CYS  21           H        CYS  21   1.146  10.733  -2.647
  144    HA   CYS  21           HA       CYS  21   1.240  13.083  -4.370
  145    HB2  CYS  21           2HB      CYS  21  -0.943  12.636  -3.243
  146    HB3  CYS  21           1HB      CYS  21  -0.148  12.823  -1.686
  147    H    PHE  22           H        PHE  22   3.273  11.484  -2.421
  148    HA   PHE  22           HA       PHE  22   3.832  13.238  -0.311
  149    HB2  PHE  22           2HB      PHE  22   4.555  10.881  -0.332
  150    HB3  PHE  22           1HB      PHE  22   5.790  11.281  -1.524
  151    HD1  PHE  22           2HD      PHE  22   4.631  11.822   1.872
  152    HD2  PHE  22           1HD      PHE  22   7.821  12.395  -0.858
  153    HE1  PHE  22           2HE      PHE  22   6.074  12.542   3.729
  154    HE2  PHE  22           1HE      PHE  22   9.284  13.130   0.976
  155    HZ   PHE  22           HZ       PHE  22   8.404  13.211   3.284
  156    H    ILE  23           H        ILE  23   5.797  12.786  -3.248
  157    HA   ILE  23           HA       ILE  23   7.507  14.957  -2.549
  158    HB   ILE  23           HB       ILE  23   7.231  13.510  -5.223
  159   HG12  ILE  23          2HG1      ILE  23   9.517  12.599  -4.563
  160   HG13  ILE  23          1HG1      ILE  23   9.178  13.234  -2.954
  161   HG21  ILE  23          1HG2      ILE  23   8.131  15.737  -5.586
  162   HG22  ILE  23          2HG2      ILE  23   9.377  14.513  -5.846
  163   HG23  ILE  23          3HG2      ILE  23   9.359  15.451  -4.352
  164   HD11  ILE  23          3HD1      ILE  23   7.223  11.757  -2.828
  165   HD12  ILE  23          1HD1      ILE  23   8.732  10.870  -3.036
  166   HD13  ILE  23          2HD1      ILE  23   7.645  11.096  -4.406
  167    H    GLU  24           H        GLU  24   4.789  14.493  -4.489
  168    HA   GLU  24           HA       GLU  24   4.594  16.831  -5.990
  169    HB2  GLU  24           2HB      GLU  24   2.150  15.728  -4.657
  170    HB3  GLU  24           1HB      GLU  24   2.359  16.329  -6.294
  171    HG2  GLU  24           2HG      GLU  24   3.316  13.700  -5.228
  172    HG3  GLU  24           1HG      GLU  24   1.924  13.986  -6.244
  173    H    CYS  25           H        CYS  25   3.192  16.092  -2.821
  174    HA   CYS  25           HA       CYS  25   2.280  18.696  -2.169
  175    HB2  CYS  25           2HB      CYS  25   1.258  16.727  -1.239
  176    HB3  CYS  25           1HB      CYS  25   2.746  16.222  -0.479
  177    H    LEU  26           H        LEU  26   5.229  16.959  -1.650
  178    HA   LEU  26           HA       LEU  26   6.383  18.520   0.381
  179    HB2  LEU  26           2HB      LEU  26   7.090  16.241  -0.401
  180    HB3  LEU  26           1HB      LEU  26   7.740  16.997  -1.836
  181    HG   LEU  26           HG       LEU  26   9.349  18.235  -0.401
  182   HD11  LEU  26          1HD1      LEU  26   8.081  18.221   1.678
  183   HD12  LEU  26          2HD1      LEU  26   9.663  17.470   1.901
  184   HD13  LEU  26          3HD1      LEU  26   8.222  16.465   1.759
  185   HD21  LEU  26          3HD2      LEU  26  10.754  16.286   0.073
  186   HD22  LEU  26          1HD2      LEU  26   9.988  16.170  -1.513
  187   HD23  LEU  26          2HD2      LEU  26   9.359  15.233  -0.160
  188    H    LYS  27           H        LYS  27   6.019  18.929  -3.021
  189    HA   LYS  27           HA       LYS  27   7.827  21.239  -3.023
  190    HB2  LYS  27           2HB      LYS  27   6.297  20.110  -5.371
  191    HB3  LYS  27           1HB      LYS  27   7.614  21.266  -5.430
  192    HG2  LYS  27           2HG      LYS  27   7.778  18.329  -4.752
  193    HG3  LYS  27           1HG      LYS  27   8.442  19.140  -6.164
  194    HD2  LYS  27           2HD      LYS  27   9.336  19.567  -3.307
  195    HD3  LYS  27           1HD      LYS  27  10.159  18.555  -4.486
  196    HE2  LYS  27           2HE      LYS  27  10.561  20.535  -5.886
  197    HE3  LYS  27           1HE      LYS  27   9.731  21.536  -4.697
  198    HZ1  LYS  27           3HZ      LYS  27  12.233  19.996  -4.230
  199    HZ2  LYS  27           1HZ      LYS  27  11.416  20.885  -3.064
  200    HZ3  LYS  27           2HZ      LYS  27  12.111  21.670  -4.375
  201    H    GLY  28           H        GLY  28   4.561  20.405  -4.137
  202    HA2  GLY  28           2HA      GLY  28   2.882  21.993  -2.978
  203    HA3  GLY  28           1HA      GLY  28   3.710  23.210  -3.936
  204    H    ILE  29           H        ILE  29   1.208  21.091  -3.843
  205    HA   ILE  29           HA       ILE  29   0.762  21.560  -6.548
  206    HB   ILE  29           HB       ILE  29  -0.137  19.269  -6.908
  207   HG12  ILE  29          2HG1      ILE  29   1.055  17.458  -5.360
  208   HG13  ILE  29          1HG1      ILE  29   0.980  18.757  -4.182
  209   HG21  ILE  29          1HG2      ILE  29   1.986  19.819  -7.846
  210   HG22  ILE  29          2HG2      ILE  29   1.967  18.128  -7.345
  211   HG23  ILE  29          3HG2      ILE  29   2.796  19.336  -6.355
  212   HD11  ILE  29          3HD1      ILE  29  -1.450  18.831  -4.461
  213   HD12  ILE  29          1HD1      ILE  29  -0.885  17.242  -3.942
  214   HD13  ILE  29          2HD1      ILE  29  -1.344  17.514  -5.625
  215    H    GLY  30           H        GLY  30  -0.997  22.078  -6.731
  216    HA2  GLY  30           2HA      GLY  30  -2.981  22.596  -4.736
  217    HA3  GLY  30           1HA      GLY  30  -3.321  22.691  -6.460
  218    H    HIS  31           H        HIS  31  -5.112  21.490  -6.815
  219    HA   HIS  31           HA       HIS  31  -5.324  19.040  -5.249
  220    HB2  HIS  31           2HB      HIS  31  -7.281  20.679  -5.315
  221    HB3  HIS  31           1HB      HIS  31  -7.511  20.179  -6.984
  222    HD1  HIS  31           1HD      HIS  31  -9.919  19.314  -6.137
  223    HD2  HIS  31           2HD      HIS  31  -6.623  17.286  -4.617
  224    HE1  HIS  31           1HE      HIS  31 -10.813  17.218  -5.091
  225    H    LYS  32           H        LYS  32  -3.915  17.781  -6.296
  226    HA   LYS  32           HA       LYS  32  -4.481  17.221  -9.124
  227    HB2  LYS  32           2HB      LYS  32  -2.184  18.003  -8.650
  228    HB3  LYS  32           1HB      LYS  32  -1.948  16.633  -7.577
  229    HG2  LYS  32           2HG      LYS  32  -2.196  15.095  -9.456
  230    HG3  LYS  32           1HG      LYS  32  -2.482  16.454 -10.540
  231    HD2  LYS  32           2HD      LYS  32  -0.236  17.310 -10.041
  232    HD3  LYS  32           1HD      LYS  32   0.050  15.937  -8.973
  233    HE2  LYS  32           2HE      LYS  32  -0.510  15.775 -11.939
  234    HE3  LYS  32           1HE      LYS  32   1.076  15.627 -11.193
  235    HZ1  LYS  32           3HZ      LYS  32   0.077  13.497 -11.750
  236    HZ2  LYS  32           1HZ      LYS  32  -1.212  13.777 -10.721
  237    HZ3  LYS  32           2HZ      LYS  32   0.351  13.590 -10.098
  238    H    TYR  33           H        TYR  33  -4.311  15.740  -5.950
  239    HA   TYR  33           HA       TYR  33  -4.948  13.220  -7.266
  240    HB2  TYR  33           2HB      TYR  33  -3.485  13.565  -4.642
  241    HB3  TYR  33           1HB      TYR  33  -3.977  12.031  -5.321
  242    HD1  TYR  33           2HD      TYR  33  -1.745  14.928  -5.873
  243    HD2  TYR  33           1HD      TYR  33  -2.697  10.944  -6.988
  244    HE1  TYR  33           2HE      TYR  33   0.294  14.826  -7.181
  245    HE2  TYR  33           1HE      TYR  33  -0.643  10.814  -8.303
  246    HH   TYR  33           HH       TYR  33   1.827  13.236  -8.214
  247    HA   PRO  34           HA       PRO  34  -8.931  13.506  -5.492
  248    HB2  PRO  34           2HB      PRO  34  -9.560  10.837  -5.614
  249    HB3  PRO  34           1HB      PRO  34  -9.525  11.898  -7.030
  250    HG2  PRO  34           2HG      PRO  34  -7.448  10.009  -6.046
  251    HG3  PRO  34           1HG      PRO  34  -8.050  10.259  -7.692
  252    HD2  PRO  34           2HD      PRO  34  -5.743  11.340  -6.862
  253    HD3  PRO  34           1HD      PRO  34  -6.826  12.217  -7.971
  254    H    PHE  35           H        PHE  35  -6.479  11.649  -4.071
  255    HA   PHE  35           HA       PHE  35  -8.036  11.202  -1.618
  256    HB2  PHE  35           2HB      PHE  35  -6.179   9.535  -1.140
  257    HB3  PHE  35           1HB      PHE  35  -7.336   9.113  -2.398
  258    HD1  PHE  35           2HD      PHE  35  -3.805  10.301  -1.788
  259    HD2  PHE  35           1HD      PHE  35  -6.699   8.883  -4.607
  260    HE1  PHE  35           2HE      PHE  35  -2.101   9.993  -3.337
  261    HE2  PHE  35           1HE      PHE  35  -4.968   8.612  -6.252
  262    HZ   PHE  35           HZ       PHE  35  -2.593   9.142  -5.660
  263    H    CYS  36           H        CYS  36  -5.691  13.174  -2.890
  264    HA   CYS  36           HA       CYS  36  -3.896  12.987  -0.679
  265    HB2  CYS  36           2HB      CYS  36  -2.928  13.408  -2.799
  266    HB3  CYS  36           1HB      CYS  36  -3.893  14.876  -3.019
  267    H    HIS  37           H        HIS  37  -4.359  13.710   1.112
  268    HA   HIS  37           HA       HIS  37  -5.814  16.238   1.352
  269    HB2  HIS  37           2HB      HIS  37  -5.319  14.016   3.327
  270    HB3  HIS  37           1HB      HIS  37  -5.852  15.605   3.862
  271    HD1  HIS  37           1HD      HIS  37  -8.349  15.799   4.054
  272    HD2  HIS  37           2HD      HIS  37  -7.188  12.963   1.249
  273    HE1  HIS  37           1HE      HIS  37 -10.472  14.797   3.167
  274    H    CYS  38           H        CYS  38  -2.759  15.112   1.226
  275    HA   CYS  38           HA       CYS  38  -1.459  16.830   3.087
  276    HB2  CYS  38           2HB      CYS  38  -0.390  14.808   2.002
  277    HB3  CYS  38           1HB      CYS  38  -0.322  15.726   0.505
  278    H    ARG  39           H        ARG  39  -2.441  17.048  -0.043
  279    HA   ARG  39           HA       ARG  39  -2.868  18.736  -1.597
  280    HB2  ARG  39           2HB      ARG  39  -2.675  20.695   0.702
  281    HB3  ARG  39           1HB      ARG  39  -3.483  20.899  -0.848
  282    HG2  ARG  39           2HG      ARG  39  -4.318  18.950   1.284
  283    HG3  ARG  39           1HG      ARG  39  -5.039  20.533   1.012
  284    HD2  ARG  39           2HD      ARG  39  -5.782  19.848  -1.185
  285    HD3  ARG  39           1HD      ARG  39  -4.966  18.292  -1.008
  286    HE   ARG  39           HE       ARG  39  -6.592  18.475   1.157
  287   HH11  ARG  39          1HH1      ARG  39  -7.314  18.689  -2.314
  288   HH12  ARG  39          2HH1      ARG  39  -8.784  17.839  -2.170
  289   HH21  ARG  39          1HH2      ARG  39  -8.610  17.388   1.314
  290   HH22  ARG  39          2HH2      ARG  39  -9.549  17.125  -0.096
  Start of MODEL   11
    1    H1   HIS   1           H        HIS   1  13.174   7.889   8.342
    2    HA   HIS   1           HA       HIS   1  15.074   9.181   9.643
    3    HB2  HIS   1           2HB      HIS   1  16.226   6.546   8.702
    4    HB3  HIS   1           1HB      HIS   1  17.206   7.957   9.072
    5    HD1  HIS   1           1HD      HIS   1  18.100   7.952  11.408
    6    HD2  HIS   1           2HD      HIS   1  14.579   5.813  11.040
    7    HE1  HIS   1           1HE      HIS   1  17.685   6.941  13.671
    8    H    GLY   2           H        GLY   2  16.546  10.272   8.262
    9    HA2  GLY   2           2HA      GLY   2  17.430  10.937   6.239
   10    HA3  GLY   2           1HA      GLY   2  16.423   9.744   5.431
   11    H    GLU   3           H        GLU   3  16.808  12.382   4.610
   12    HA   GLU   3           HA       GLU   3  14.036  13.296   4.753
   13    HB2  GLU   3           2HB      GLU   3  14.772  15.615   4.564
   14    HB3  GLU   3           1HB      GLU   3  15.550  14.877   5.945
   15    HG2  GLU   3           2HG      GLU   3  16.815  15.416   3.265
   16    HG3  GLU   3           1HG      GLU   3  17.056  16.363   4.729
   17    H    GLY   4           H        GLY   4  16.978  13.013   2.865
   18    HA2  GLY   4           2HA      GLY   4  15.330  12.925   0.420
   19    HA3  GLY   4           1HA      GLY   4  17.030  13.422   0.457
   20    H    THR   5           H        THR   5  15.994  10.939   2.490
   21    HA   THR   5           HA       THR   5  16.976   8.852   0.707
   22    HB   THR   5           HB       THR   5  17.615   9.032   3.664
   23    HG1  THR   5           1HG      THR   5  18.862  10.161   1.479
   24   HG21  THR   5          3HG2      THR   5  17.566   6.756   2.720
   25   HG22  THR   5          1HG2      THR   5  19.207   7.228   3.163
   26   HG23  THR   5          2HG2      THR   5  18.709   7.252   1.474
   27    H    PHE   6           H        PHE   6  15.232   7.615   0.479
   28    HA   PHE   6           HA       PHE   6  13.130   7.560   2.422
   29    HB2  PHE   6           2HB      PHE   6  12.678   7.426   0.007
   30    HB3  PHE   6           1HB      PHE   6  13.540   5.895  -0.070
   31    HD1  PHE   6           1HD      PHE   6  10.548   7.603   1.180
   32    HD2  PHE   6           2HD      PHE   6  12.484   3.867   0.594
   33    HE1  PHE   6           1HE      PHE   6   8.435   6.434   1.644
   34    HE2  PHE   6           2HE      PHE   6  10.383   2.701   1.062
   35    HZ   PHE   6           HZ       PHE   6   8.352   3.992   1.587
   36    H    THR   7           H        THR   7  13.228   6.378   4.193
   37    HA   THR   7           HA       THR   7  14.827   3.947   4.187
   38    HB   THR   7           HB       THR   7  13.578   5.351   6.583
   39    HG1  THR   7           1HG      THR   7  15.073   6.829   6.048
   40   HG21  THR   7          3HG2      THR   7  15.240   4.081   7.851
   41   HG22  THR   7          1HG2      THR   7  15.897   3.413   6.356
   42   HG23  THR   7          2HG2      THR   7  14.277   2.971   6.871
   43    H    SER   8           H        SER   8  13.759   2.173   3.711
   44    HA   SER   8           HA       SER   8  10.930   2.022   3.555
   45    HB2  SER   8           2HB      SER   8  12.942  -0.185   3.217
   46    HB3  SER   8           1HB      SER   8  11.377   0.011   2.419
   47    HG   SER   8           HG       SER   8  12.282   1.227   0.974
   48    H    ASP   9           H        ASP   9   9.561   0.952   4.922
   49    HA   ASP   9           HA       ASP   9   8.684  -0.289   6.646
   50    HB2  ASP   9           2HB      ASP   9  10.037  -2.126   5.635
   51    HB3  ASP   9           1HB      ASP   9  11.369  -1.716   6.701
   52    H    LEU  10           H        LEU  10  10.536   2.051   7.056
   53    HA   LEU  10           HA       LEU  10  11.607   1.683   9.701
   54    HB2  LEU  10           2HB      LEU  10  12.595   3.257   8.018
   55    HB3  LEU  10           1HB      LEU  10  11.185   4.267   8.173
   56    HG   LEU  10           HG       LEU  10  13.254   5.092   9.348
   57   HD11  LEU  10          1HD1      LEU  10  12.150   5.823  11.387
   58   HD12  LEU  10          2HD1      LEU  10  10.879   4.626  11.133
   59   HD13  LEU  10          3HD1      LEU  10  11.077   5.954   9.992
   60   HD21  LEU  10          3HD2      LEU  10  12.696   2.756  11.161
   61   HD22  LEU  10          1HD2      LEU  10  13.821   4.061  11.523
   62   HD23  LEU  10          2HD2      LEU  10  14.122   2.998  10.154
   63    H    SER  11           H        SER  11   8.837   3.366   8.323
   64    HA   SER  11           HA       SER  11   7.805   3.710  11.020
   65    HB2  SER  11           2HB      SER  11   7.628   5.587   9.323
   66    HB3  SER  11           1HB      SER  11   6.513   4.577   8.406
   67    HG   SER  11           HG       SER  11   5.173   5.723   9.647
   68    H    LYS  12           H        LYS  12   7.806   1.523   8.514
   69    HA   LYS  12           HA       LYS  12   6.763  -0.392   8.008
   70    HB2  LYS  12           2HB      LYS  12   7.443  -0.770  10.340
   71    HB3  LYS  12           1HB      LYS  12   5.856  -0.241  10.885
   72    HG2  LYS  12           2HG      LYS  12   4.844  -2.122   9.665
   73    HG3  LYS  12           1HG      LYS  12   6.461  -2.656   9.187
   74    HD2  LYS  12           2HD      LYS  12   7.086  -2.865  11.471
   75    HD3  LYS  12           1HD      LYS  12   5.489  -2.295  11.979
   76    HE2  LYS  12           2HE      LYS  12   4.447  -4.220  10.878
   77    HE3  LYS  12           1HE      LYS  12   6.028  -4.808  10.372
   78    HZ1  LYS  12           3HZ      LYS  12   5.189  -5.967  12.299
   79    HZ2  LYS  12           1HZ      LYS  12   5.094  -4.541  13.177
   80    HZ3  LYS  12           2HZ      LYS  12   6.595  -5.129  12.704
   81    H    GLN  13           H        GLN  13   5.526   1.898   7.461
   82    HA   GLN  13           HA       GLN  13   2.636   1.458   7.731
   83    HB2  GLN  13           2HB      GLN  13   2.396   3.691   6.753
   84    HB3  GLN  13           1HB      GLN  13   3.469   3.742   8.145
   85    HG2  GLN  13           2HG      GLN  13   5.408   3.777   6.658
   86    HG3  GLN  13           1HG      GLN  13   4.340   3.702   5.261
   87   HE21  GLN  13          1HE2      GLN  13   6.288   5.713   6.002
   88   HE22  GLN  13          2HE2      GLN  13   5.417   7.192   6.115
   89    H    MET  14           H        MET  14   1.392   1.705   5.671
   90    HA   MET  14           HA       MET  14   2.843   0.337   3.563
   91    HB2  MET  14           2HB      MET  14   0.700  -0.299   2.634
   92    HB3  MET  14           1HB      MET  14   0.731  -0.720   4.334
   93    HG2  MET  14           2HG      MET  14  -0.599   1.366   4.767
   94    HG3  MET  14           1HG      MET  14  -0.725   1.550   3.021
   95    HE1  MET  14           3HE      MET  14  -1.903  -0.324   1.434
   96    HE2  MET  14           1HE      MET  14  -2.647  -1.784   2.083
   97    HE3  MET  14           2HE      MET  14  -0.903  -1.575   2.179
   98    H    GLU  15           H        GLU  15   3.422   1.335   1.812
   99    HA   GLU  15           HA       GLU  15   2.739   4.114   1.412
  100    HB2  GLU  15           2HB      GLU  15   4.443   2.199  -0.203
  101    HB3  GLU  15           1HB      GLU  15   4.287   3.915  -0.524
  102    HG2  GLU  15           2HG      GLU  15   5.393   2.792   2.038
  103    HG3  GLU  15           1HG      GLU  15   6.379   3.220   0.642
  104    H    GLU  16           H        GLU  16   0.546   4.013   0.886
  105    HA   GLU  16           HA       GLU  16  -0.033   2.512  -1.548
  106    HB2  GLU  16           2HB      GLU  16  -1.143   1.500   0.306
  107    HB3  GLU  16           1HB      GLU  16  -1.800   3.037   0.825
  108    HG2  GLU  16           2HG      GLU  16  -3.166   3.148  -1.109
  109    HG3  GLU  16           1HG      GLU  16  -2.492   1.639  -1.742
  110    H    GLU  17           H        GLU  17  -2.045   5.031   0.081
  111    HA   GLU  17           HA       GLU  17  -1.684   6.599  -2.291
  112    HB2  GLU  17           2HB      GLU  17  -4.240   6.155  -0.726
  113    HB3  GLU  17           1HB      GLU  17  -4.029   7.323  -2.016
  114    HG2  GLU  17           2HG      GLU  17  -3.513   5.478  -3.563
  115    HG3  GLU  17           1HG      GLU  17  -3.870   4.325  -2.299
  116    H    ALA  18           H        ALA  18  -2.449   8.625  -1.776
  117    HA   ALA  18           HA       ALA  18  -1.852  10.742  -0.961
  118    HB1  ALA  18           1HB      ALA  18  -1.898   9.358   1.725
  119    HB2  ALA  18           2HB      ALA  18  -3.272  10.172   0.966
  120    HB3  ALA  18           3HB      ALA  18  -1.853  11.097   1.482
  121    H    VAL  19           H        VAL  19   0.147   8.211  -0.975
  122    HA   VAL  19           HA       VAL  19   2.496   9.763  -0.191
  123    HB   VAL  19           HB       VAL  19   3.774   7.664  -0.485
  124   HG11  VAL  19          1HG1      VAL  19   1.348   7.369   1.265
  125   HG12  VAL  19          2HG1      VAL  19   2.872   8.143   1.698
  126   HG13  VAL  19          3HG1      VAL  19   2.819   6.404   1.402
  127   HG21  VAL  19          3HG2      VAL  19   2.441   6.625  -2.242
  128   HG22  VAL  19          1HG2      VAL  19   1.101   6.408  -1.115
  129   HG23  VAL  19          2HG2      VAL  19   2.610   5.529  -0.869
  130    H    ARG  20           H        ARG  20   0.535   9.157  -2.596
  131    HA   ARG  20           HA       ARG  20   2.303   8.966  -4.868
  132    HB2  ARG  20           2HB      ARG  20  -0.663   9.477  -4.646
  133    HB3  ARG  20           1HB      ARG  20   0.164   9.095  -6.143
  134    HG2  ARG  20           2HG      ARG  20  -0.126   7.279  -3.746
  135    HG3  ARG  20           1HG      ARG  20  -1.075   7.188  -5.228
  136    HD2  ARG  20           2HD      ARG  20   0.940   6.661  -6.495
  137    HD3  ARG  20           1HD      ARG  20   1.913   6.822  -5.031
  138    HE   ARG  20           HE       ARG  20   0.007   4.936  -4.435
  139   HH11  ARG  20          1HH1      ARG  20   2.563   5.225  -6.847
  140   HH12  ARG  20          2HH1      ARG  20   2.837   3.553  -6.980
  141   HH21  ARG  20          1HH2      ARG  20   0.357   2.622  -4.605
  142   HH22  ARG  20          2HH2      ARG  20   1.549   2.037  -5.654
  143    H    CYS  21           H        CYS  21   0.586  11.385  -3.017
  144    HA   CYS  21           HA       CYS  21   1.364  13.476  -4.915
  145    HB2  CYS  21           2HB      CYS  21  -0.384  14.821  -4.040
  146    HB3  CYS  21           1HB      CYS  21  -1.058  13.192  -4.114
  147    H    PHE  22           H        PHE  22   2.501  12.024  -2.294
  148    HA   PHE  22           HA       PHE  22   2.770  13.938  -0.275
  149    HB2  PHE  22           2HB      PHE  22   3.023  11.525  -0.044
  150    HB3  PHE  22           1HB      PHE  22   4.605  11.594  -0.813
  151    HD1  PHE  22           2HD      PHE  22   2.614  12.177   2.134
  152    HD2  PHE  22           1HD      PHE  22   6.498  12.619   0.449
  153    HE1  PHE  22           2HE      PHE  22   3.505  12.549   4.354
  154    HE2  PHE  22           1HE      PHE  22   7.429  12.992   2.695
  155    HZ   PHE  22           HZ       PHE  22   5.946  12.968   4.657
  156    H    ILE  23           H        ILE  23   5.338  12.858  -2.491
  157    HA   ILE  23           HA       ILE  23   7.061  14.999  -1.680
  158    HB   ILE  23           HB       ILE  23   7.401  13.154  -4.093
  159   HG12  ILE  23          2HG1      ILE  23   9.219  12.127  -2.572
  160   HG13  ILE  23          1HG1      ILE  23   8.361  12.946  -1.266
  161   HG21  ILE  23          1HG2      ILE  23   8.714  15.198  -4.296
  162   HG22  ILE  23          2HG2      ILE  23   9.764  13.804  -4.019
  163   HG23  ILE  23          3HG2      ILE  23   9.406  14.917  -2.698
  164   HD11  ILE  23          3HD1      ILE  23   6.376  11.631  -1.753
  165   HD12  ILE  23          1HD1      ILE  23   7.762  10.604  -1.403
  166   HD13  ILE  23          2HD1      ILE  23   7.227  10.821  -3.070
  167    H    GLU  24           H        GLU  24   4.801  14.404  -4.099
  168    HA   GLU  24           HA       GLU  24   5.297  16.470  -5.953
  169    HB2  GLU  24           2HB      GLU  24   2.546  15.575  -5.073
  170    HB3  GLU  24           1HB      GLU  24   2.992  16.302  -6.610
  171    HG2  GLU  24           2HG      GLU  24   3.789  13.613  -5.605
  172    HG3  GLU  24           1HG      GLU  24   2.552  13.938  -6.797
  173    H    CYS  25           H        CYS  25   3.450  16.388  -3.001
  174    HA   CYS  25           HA       CYS  25   2.619  19.121  -3.009
  175    HB2  CYS  25           2HB      CYS  25   1.387  17.381  -1.815
  176    HB3  CYS  25           1HB      CYS  25   2.749  17.138  -0.731
  177    H    LEU  26           H        LEU  26   5.362  17.405  -1.679
  178    HA   LEU  26           HA       LEU  26   6.362  19.527  -0.108
  179    HB2  LEU  26           2HB      LEU  26   7.854  17.293  -1.481
  180    HB3  LEU  26           1HB      LEU  26   8.529  18.322  -0.232
  181    HG   LEU  26           HG       LEU  26   6.294  16.314   0.092
  182   HD11  LEU  26          1HD1      LEU  26   9.110  16.331   1.150
  183   HD12  LEU  26          2HD1      LEU  26   8.486  15.292  -0.126
  184   HD13  LEU  26          3HD1      LEU  26   7.875  15.130   1.521
  185   HD21  LEU  26          3HD2      LEU  26   5.902  18.228   1.551
  186   HD22  LEU  26          1HD2      LEU  26   7.559  18.130   2.149
  187   HD23  LEU  26          2HD2      LEU  26   6.420  16.831   2.491
  188    H    LYS  27           H        LYS  27   6.474  18.805  -3.465
  189    HA   LYS  27           HA       LYS  27   8.365  20.909  -4.073
  190    HB2  LYS  27           2HB      LYS  27   6.630  19.176  -5.838
  191    HB3  LYS  27           1HB      LYS  27   7.740  20.386  -6.464
  192    HG2  LYS  27           2HG      LYS  27   9.636  19.203  -5.556
  193    HG3  LYS  27           1HG      LYS  27   8.573  18.054  -4.747
  194    HD2  LYS  27           2HD      LYS  27   8.719  18.420  -7.741
  195    HD3  LYS  27           1HD      LYS  27   9.613  17.180  -6.852
  196    HE2  LYS  27           2HE      LYS  27   7.436  16.319  -6.002
  197    HE3  LYS  27           1HE      LYS  27   6.626  17.509  -7.020
  198    HZ1  LYS  27           3HZ      LYS  27   6.768  15.234  -7.924
  199    HZ2  LYS  27           1HZ      LYS  27   8.426  15.407  -8.064
  200    HZ3  LYS  27           2HZ      LYS  27   7.398  16.400  -8.974
  201    H    GLY  28           H        GLY  28   4.906  20.330  -4.666
  202    HA2  GLY  28           2HA      GLY  28   3.664  22.423  -3.745
  203    HA3  GLY  28           1HA      GLY  28   4.493  23.221  -5.063
  204    H    ILE  29           H        ILE  29   1.908  21.090  -4.175
  205    HA   ILE  29           HA       ILE  29   0.820  21.487  -6.727
  206    HB   ILE  29           HB       ILE  29   0.080  19.213  -7.071
  207   HG12  ILE  29          2HG1      ILE  29   1.427  17.318  -5.773
  208   HG13  ILE  29          1HG1      ILE  29   1.472  18.537  -4.509
  209   HG21  ILE  29          1HG2      ILE  29   2.034  19.776  -8.237
  210   HG22  ILE  29          2HG2      ILE  29   2.146  18.086  -7.740
  211   HG23  ILE  29          3HG2      ILE  29   3.050  19.325  -6.869
  212   HD11  ILE  29          3HD1      ILE  29  -0.378  17.063  -4.106
  213   HD12  ILE  29          1HD1      ILE  29  -0.976  17.306  -5.759
  214   HD13  ILE  29          2HD1      ILE  29  -0.988  18.644  -4.624
  215    H    GLY  30           H        GLY  30  -0.858  22.310  -6.334
  216    HA2  GLY  30           2HA      GLY  30  -2.291  21.986  -3.808
  217    HA3  GLY  30           1HA      GLY  30  -2.754  23.094  -5.096
  218    H    HIS  31           H        HIS  31  -2.902  19.854  -3.931
  219    HA   HIS  31           HA       HIS  31  -4.280  18.092  -4.240
  220    HB2  HIS  31           2HB      HIS  31  -6.005  19.676  -3.484
  221    HB3  HIS  31           1HB      HIS  31  -6.248  20.215  -5.139
  222    HD1  HIS  31           1HD      HIS  31  -7.971  18.926  -6.501
  223    HD2  HIS  31           2HD      HIS  31  -6.892  16.967  -2.999
  224    HE1  HIS  31           1HE      HIS  31  -9.546  16.982  -6.281
  225    H    LYS  32           H        LYS  32  -3.196  16.970  -5.783
  226    HA   LYS  32           HA       LYS  32  -4.143  17.307  -8.563
  227    HB2  LYS  32           2HB      LYS  32  -1.589  16.097  -7.529
  228    HB3  LYS  32           1HB      LYS  32  -2.095  16.018  -9.210
  229    HG2  LYS  32           2HG      LYS  32  -1.626  18.541  -7.666
  230    HG3  LYS  32           1HG      LYS  32  -0.433  17.800  -8.750
  231    HD2  LYS  32           2HD      LYS  32  -2.075  18.064 -10.593
  232    HD3  LYS  32           1HD      LYS  32  -3.157  18.885  -9.468
  233    HE2  LYS  32           2HE      LYS  32  -1.460  20.604  -9.093
  234    HE3  LYS  32           1HE      LYS  32  -0.384  19.788 -10.224
  235    HZ1  LYS  32           3HZ      LYS  32  -1.517  21.613 -11.288
  236    HZ2  LYS  32           1HZ      LYS  32  -3.022  20.980 -10.890
  237    HZ3  LYS  32           2HZ      LYS  32  -2.026  20.164 -11.971
  238    H    TYR  33           H        TYR  33  -4.505  15.379  -5.902
  239    HA   TYR  33           HA       TYR  33  -5.411  13.130  -7.520
  240    HB2  TYR  33           2HB      TYR  33  -3.736  12.900  -5.006
  241    HB3  TYR  33           1HB      TYR  33  -4.460  11.559  -5.842
  242    HD1  TYR  33           1HD      TYR  33  -1.809  14.140  -6.018
  243    HD2  TYR  33           2HD      TYR  33  -3.338  10.567  -7.761
  244    HE1  TYR  33           1HE      TYR  33   0.246  13.888  -7.257
  245    HE2  TYR  33           2HE      TYR  33  -1.260  10.293  -9.010
  246    HH   TYR  33           HH       TYR  33   1.525  11.780  -8.260
  247    HA   PRO  34           HA       PRO  34  -9.015  13.801  -4.990
  248    HB2  PRO  34           2HB      PRO  34  -9.909  11.166  -4.847
  249    HB3  PRO  34           1HB      PRO  34 -10.218  12.256  -6.197
  250    HG2  PRO  34           2HG      PRO  34  -8.156  10.129  -5.930
  251    HG3  PRO  34           1HG      PRO  34  -9.117  10.595  -7.342
  252    HD2  PRO  34           2HD      PRO  34  -6.542  11.311  -7.070
  253    HD3  PRO  34           1HD      PRO  34  -7.719  12.391  -7.842
  254    H    PHE  35           H        PHE  35  -6.946  11.146  -4.148
  255    HA   PHE  35           HA       PHE  35  -7.782  11.098  -1.353
  256    HB2  PHE  35           2HB      PHE  35  -6.169   9.123  -1.323
  257    HB3  PHE  35           1HB      PHE  35  -7.623   8.964  -2.315
  258    HD1  PHE  35           1HD      PHE  35  -4.010   9.585  -2.410
  259    HD2  PHE  35           2HD      PHE  35  -7.507   8.736  -4.626
  260    HE1  PHE  35           1HE      PHE  35  -2.634   9.154  -4.409
  261    HE2  PHE  35           2HE      PHE  35  -6.193   8.325  -6.617
  262    HZ   PHE  35           HZ       PHE  35  -3.724   8.524  -6.529
  263    H    CYS  36           H        CYS  36  -5.995  13.159  -2.788
  264    HA   CYS  36           HA       CYS  36  -3.639  12.911  -1.104
  265    HB2  CYS  36           2HB      CYS  36  -3.213  13.606  -3.341
  266    HB3  CYS  36           1HB      CYS  36  -4.316  14.982  -3.205
  267    H    HIS  37           H        HIS  37  -3.488  13.916   0.699
  268    HA   HIS  37           HA       HIS  37  -5.480  15.981   1.221
  269    HB2  HIS  37           2HB      HIS  37  -5.540  15.360   3.634
  270    HB3  HIS  37           1HB      HIS  37  -6.176  14.137   2.558
  271    HD1  HIS  37           1HD      HIS  37  -3.926  14.574   5.377
  272    HD2  HIS  37           2HD      HIS  37  -4.277  11.946   2.181
  273    HE1  HIS  37           1HE      HIS  37  -2.680  12.494   6.047
  274    H    CYS  38           H        CYS  38  -2.343  15.644   0.714
  275    HA   CYS  38           HA       CYS  38  -1.526  17.658   2.598
  276    HB2  CYS  38           2HB      CYS  38   0.099  16.014   1.648
  277    HB3  CYS  38           1HB      CYS  38  -0.116  16.772   0.066
  278    H    ARG  39           H        ARG  39  -2.922  19.169   2.334
  279    HA   ARG  39           HA       ARG  39  -2.962  20.658  -0.212
  280    HB2  ARG  39           2HB      ARG  39  -5.374  20.079   1.518
  281    HB3  ARG  39           1HB      ARG  39  -5.343  21.052   0.048
  282    HG2  ARG  39           2HG      ARG  39  -4.773  19.106  -1.274
  283    HG3  ARG  39           1HG      ARG  39  -4.683  18.117   0.178
  284    HD2  ARG  39           2HD      ARG  39  -7.155  19.474  -0.903
  285    HD3  ARG  39           1HD      ARG  39  -6.778  17.761  -1.023
  286    HE   ARG  39           HE       ARG  39  -7.273  19.157   1.525
  287   HH11  ARG  39          1HH1      ARG  39  -7.424  16.157  -0.369
  288   HH12  ARG  39          2HH1      ARG  39  -8.519  15.410   0.694
  289   HH21  ARG  39          1HH2      ARG  39  -8.739  18.063   2.969
  290   HH22  ARG  39          2HH2      ARG  39  -9.262  16.473   2.617
  Start of MODEL   12
    1    H1   HIS   1           H        HIS   1   0.293  10.331 -16.097
    2    HA   HIS   1           HA       HIS   1   1.411   8.464 -14.685
    3    HB2  HIS   1           2HB      HIS   1  -0.104   6.754 -15.670
    4    HB3  HIS   1           1HB      HIS   1   0.595   7.065 -17.249
    5    HD1  HIS   1           1HD      HIS   1   3.023   6.058 -17.684
    6    HD2  HIS   1           2HD      HIS   1   1.348   5.159 -13.980
    7    HE1  HIS   1           1HE      HIS   1   4.355   4.133 -16.765
    8    H    GLY   2           H        GLY   2   1.272   9.276 -18.112
    9    HA2  GLY   2           2HA      GLY   2   2.916  10.754 -19.058
   10    HA3  GLY   2           1HA      GLY   2   4.104  10.061 -17.959
   11    H    GLU   3           H        GLU   3   4.686  10.257 -20.575
   12    HA   GLU   3           HA       GLU   3   5.620   9.146 -22.270
   13    HB2  GLU   3           2HB      GLU   3   5.236   6.743 -20.472
   14    HB3  GLU   3           1HB      GLU   3   5.994   6.622 -22.047
   15    HG2  GLU   3           2HG      GLU   3   7.717   6.704 -20.399
   16    HG3  GLU   3           1HG      GLU   3   7.732   8.229 -21.268
   17    H    GLY   4           H        GLY   4   2.673   9.491 -22.035
   18    HA2  GLY   4           2HA      GLY   4   0.950   9.173 -23.555
   19    HA3  GLY   4           1HA      GLY   4   1.972   8.032 -24.429
   20    H    THR   5           H        THR   5   2.031   7.254 -21.249
   21    HA   THR   5           HA       THR   5   0.162   5.087 -21.650
   22    HB   THR   5           HB       THR   5   2.120   5.588 -19.394
   23    HG1  THR   5           1HG      THR   5   2.556   4.919 -21.966
   24   HG21  THR   5          3HG2      THR   5   1.925   3.154 -19.055
   25   HG22  THR   5          1HG2      THR   5   0.771   3.060 -20.387
   26   HG23  THR   5          2HG2      THR   5   0.350   3.937 -18.917
   27    H    PHE   6           H        PHE   6  -1.770   5.365 -20.823
   28    HA   PHE   6           HA       PHE   6  -2.116   7.264 -18.638
   29    HB2  PHE   6           2HB      PHE   6  -4.088   6.269 -20.705
   30    HB3  PHE   6           1HB      PHE   6  -4.544   7.231 -19.301
   31    HD1  PHE   6           1HD      PHE   6  -3.939   9.556 -19.134
   32    HD2  PHE   6           2HD      PHE   6  -2.865   7.265 -22.553
   33    HE1  PHE   6           1HE      PHE   6  -3.413  11.625 -20.352
   34    HE2  PHE   6           2HE      PHE   6  -2.340   9.330 -23.774
   35    HZ   PHE   6           HZ       PHE   6  -2.616  11.510 -22.673
   36    H    THR   7           H        THR   7  -3.248   6.613 -16.826
   37    HA   THR   7           HA       THR   7  -3.632   3.747 -16.670
   38    HB   THR   7           HB       THR   7  -2.158   5.499 -14.703
   39    HG1  THR   7           1HG      THR   7  -1.444   4.219 -16.828
   40   HG21  THR   7          3HG2      THR   7  -2.827   2.550 -14.538
   41   HG22  THR   7          1HG2      THR   7  -3.511   3.814 -13.519
   42   HG23  THR   7          2HG2      THR   7  -1.791   3.432 -13.415
   43    H    SER   8           H        SER   8  -5.707   3.523 -16.491
   44    HA   SER   8           HA       SER   8  -7.006   4.626 -14.148
   45    HB2  SER   8           2HB      SER   8  -7.701   5.906 -16.232
   46    HB3  SER   8           1HB      SER   8  -8.310   4.367 -16.861
   47    HG   SER   8           HG       SER   8  -9.930   4.394 -15.455
   48    H    ASP   9           H        ASP   9  -6.814   2.782 -13.144
   49    HA   ASP   9           HA       ASP   9  -7.104   0.625 -12.464
   50    HB2  ASP   9           2HB      ASP   9  -9.296   0.756 -14.517
   51    HB3  ASP   9           1HB      ASP   9  -9.017  -0.691 -13.555
   52    H    LEU  10           H        LEU  10  -5.177   1.214 -14.522
   53    HA   LEU  10           HA       LEU  10  -5.252  -0.856 -16.526
   54    HB2  LEU  10           2HB      LEU  10  -4.041   1.347 -16.784
   55    HB3  LEU  10           1HB      LEU  10  -2.904   0.813 -15.577
   56    HG   LEU  10           HG       LEU  10  -3.208  -0.614 -18.235
   57   HD11  LEU  10          1HD1      LEU  10  -2.638   1.728 -18.644
   58   HD12  LEU  10          2HD1      LEU  10  -1.270   0.671 -18.988
   59   HD13  LEU  10          3HD1      LEU  10  -1.308   1.607 -17.494
   60   HD21  LEU  10          3HD2      LEU  10  -0.921  -0.491 -16.256
   61   HD22  LEU  10          1HD2      LEU  10  -0.940  -1.402 -17.766
   62   HD23  LEU  10          2HD2      LEU  10  -2.024  -1.852 -16.446
   63    H    SER  11           H        SER  11  -3.496  -0.368 -13.523
   64    HA   SER  11           HA       SER  11  -2.824  -3.222 -13.436
   65    HB2  SER  11           2HB      SER  11  -0.947  -1.544 -13.362
   66    HB3  SER  11           1HB      SER  11  -1.685  -0.850 -11.927
   67    HG   SER  11           HG       SER  11  -0.690  -3.482 -12.194
   68    H    LYS  12           H        LYS  12  -4.868  -0.863 -12.464
   69    HA   LYS  12           HA       LYS  12  -6.352  -0.394 -10.927
   70    HB2  LYS  12           2HB      LYS  12  -7.075  -2.689 -11.748
   71    HB3  LYS  12           1HB      LYS  12  -6.415  -3.294 -10.223
   72    HG2  LYS  12           2HG      LYS  12  -7.849  -1.689  -9.024
   73    HG3  LYS  12           1HG      LYS  12  -8.588  -1.266 -10.570
   74    HD2  LYS  12           2HD      LYS  12  -9.252  -3.525 -10.871
   75    HD3  LYS  12           1HD      LYS  12  -8.505  -3.954  -9.321
   76    HE2  LYS  12           2HE      LYS  12 -10.825  -2.046  -9.740
   77    HE3  LYS  12           1HE      LYS  12 -10.906  -3.621  -8.951
   78    HZ1  LYS  12           3HZ      LYS  12  -9.411  -2.746  -7.211
   79    HZ2  LYS  12           1HZ      LYS  12 -10.848  -1.869  -7.323
   80    HZ3  LYS  12           2HZ      LYS  12  -9.432  -1.228  -7.950
   81    H    GLN  13           H        GLN  13  -3.976   0.090 -10.147
   82    HA   GLN  13           HA       GLN  13  -4.160  -0.235  -7.249
   83    HB2  GLN  13           2HB      GLN  13  -1.582  -0.453  -8.803
   84    HB3  GLN  13           1HB      GLN  13  -1.706  -0.392  -7.058
   85    HG2  GLN  13           2HG      GLN  13  -3.002  -2.521  -7.166
   86    HG3  GLN  13           1HG      GLN  13  -2.629  -2.583  -8.889
   87   HE21  GLN  13          1HE2      GLN  13   0.041  -1.389  -8.423
   88   HE22  GLN  13          2HE2      GLN  13   1.000  -2.647  -7.764
   89    H    MET  14           H        MET  14  -3.426   1.529  -6.132
   90    HA   MET  14           HA       MET  14  -2.941   3.934  -7.741
   91    HB2  MET  14           2HB      MET  14  -3.716   3.720  -4.811
   92    HB3  MET  14           1HB      MET  14  -3.593   5.197  -5.742
   93    HG2  MET  14           2HG      MET  14  -5.886   4.759  -5.496
   94    HG3  MET  14           1HG      MET  14  -5.496   4.312  -7.154
   95    HE1  MET  14           3HE      MET  14  -7.812   2.997  -7.305
   96    HE2  MET  14           1HE      MET  14  -8.178   3.440  -5.639
   97    HE3  MET  14           2HE      MET  14  -8.313   1.760  -6.154
   98    H    GLU  15           H        GLU  15  -1.257   1.597  -6.663
   99    HA   GLU  15           HA       GLU  15   0.822   1.142  -5.990
  100    HB2  GLU  15           2HB      GLU  15   1.021   4.107  -6.136
  101    HB3  GLU  15           1HB      GLU  15   2.415   3.129  -5.644
  102    HG2  GLU  15           2HG      GLU  15   2.511   2.100  -7.786
  103    HG3  GLU  15           1HG      GLU  15   0.928   2.730  -8.231
  104    H    GLU  16           H        GLU  16  -0.109   4.018  -4.239
  105    HA   GLU  16           HA       GLU  16  -0.996   2.820  -1.979
  106    HB2  GLU  16           2HB      GLU  16   1.310   2.222  -1.468
  107    HB3  GLU  16           1HB      GLU  16   1.822   3.896  -1.700
  108    HG2  GLU  16           2HG      GLU  16   0.582   4.593   0.219
  109    HG3  GLU  16           1HG      GLU  16  -0.152   2.997   0.352
  110    H    GLU  17           H        GLU  17  -2.227   4.268  -1.086
  111    HA   GLU  17           HA       GLU  17  -2.229   6.791  -2.323
  112    HB2  GLU  17           2HB      GLU  17  -4.326   7.139  -1.093
  113    HB3  GLU  17           1HB      GLU  17  -4.352   5.692  -2.080
  114    HG2  GLU  17           2HG      GLU  17  -4.005   4.325  -0.099
  115    HG3  GLU  17           1HG      GLU  17  -3.930   5.781   0.896
  116    H    ALA  18           H        ALA  18  -2.078   8.386  -1.450
  117    HA   ALA  18           HA       ALA  18  -1.364  10.203  -0.278
  118    HB1  ALA  18           1HB      ALA  18  -1.314   8.475   2.183
  119    HB2  ALA  18           2HB      ALA  18  -2.719   9.365   1.587
  120    HB3  ALA  18           3HB      ALA  18  -1.280  10.238   2.134
  121    H    VAL  19           H        VAL  19   0.559   7.623  -0.929
  122    HA   VAL  19           HA       VAL  19   2.831   9.183  -0.019
  123    HB   VAL  19           HB       VAL  19   2.905   6.677   0.360
  124   HG11  VAL  19          1HG1      VAL  19   3.443   5.211  -1.490
  125   HG12  VAL  19          2HG1      VAL  19   3.229   6.550  -2.620
  126   HG13  VAL  19          3HG1      VAL  19   1.852   5.949  -1.698
  127   HG21  VAL  19          3HG2      VAL  19   5.038   7.866  -1.371
  128   HG22  VAL  19          1HG2      VAL  19   5.226   6.409  -0.388
  129   HG23  VAL  19          2HG2      VAL  19   4.913   7.969   0.388
  130    H    ARG  20           H        ARG  20   1.064   8.118  -2.744
  131    HA   ARG  20           HA       ARG  20   2.627   8.813  -4.900
  132    HB2  ARG  20           2HB      ARG  20  -0.272   8.679  -4.380
  133    HB3  ARG  20           1HB      ARG  20   0.190   9.305  -5.928
  134    HG2  ARG  20           2HG      ARG  20   0.751   6.576  -4.767
  135    HG3  ARG  20           1HG      ARG  20  -0.333   7.008  -6.097
  136    HD2  ARG  20           2HD      ARG  20   2.681   7.224  -6.128
  137    HD3  ARG  20           1HD      ARG  20   1.709   6.019  -6.955
  138    HE   ARG  20           HE       ARG  20   0.768   8.449  -7.806
  139   HH11  ARG  20          1HH1      ARG  20   3.610   6.415  -8.214
  140   HH12  ARG  20          2HH1      ARG  20   4.275   7.351  -9.480
  141   HH21  ARG  20          1HH2      ARG  20   1.620   9.678  -9.641
  142   HH22  ARG  20          2HH2      ARG  20   3.093   9.216 -10.332
  143    H    CYS  21           H        CYS  21   0.736  10.938  -2.824
  144    HA   CYS  21           HA       CYS  21   1.516  13.143  -4.550
  145    HB2  CYS  21           2HB      CYS  21  -0.909  12.903  -4.207
  146    HB3  CYS  21           1HB      CYS  21  -0.701  13.118  -2.480
  147    H    PHE  22           H        PHE  22   2.605  11.612  -1.949
  148    HA   PHE  22           HA       PHE  22   2.920  13.481   0.108
  149    HB2  PHE  22           2HB      PHE  22   3.326  11.031   0.204
  150    HB3  PHE  22           1HB      PHE  22   4.832  11.271  -0.669
  151    HD1  PHE  22           2HD      PHE  22   6.646  12.599   0.457
  152    HD2  PHE  22           1HD      PHE  22   3.142  11.304   2.449
  153    HE1  PHE  22           2HE      PHE  22   7.776  12.935   2.601
  154    HE2  PHE  22           1HE      PHE  22   4.233  11.617   4.615
  155    HZ   PHE  22           HZ       PHE  22   6.566  12.432   4.716
  156    H    ILE  23           H        ILE  23   5.269  12.551  -2.422
  157    HA   ILE  23           HA       ILE  23   7.031  14.677  -1.739
  158    HB   ILE  23           HB       ILE  23   6.983  12.967  -4.255
  159   HG12  ILE  23          2HG1      ILE  23   7.199  11.596  -2.217
  160   HG13  ILE  23          1HG1      ILE  23   8.681  11.574  -3.166
  161   HG21  ILE  23          1HG2      ILE  23   8.313  14.993  -4.554
  162   HG22  ILE  23          2HG2      ILE  23   9.360  13.570  -4.470
  163   HG23  ILE  23          3HG2      ILE  23   9.197  14.631  -3.069
  164   HD11  ILE  23          3HD1      ILE  23   8.205  13.221  -0.681
  165   HD12  ILE  23          1HD1      ILE  23   9.690  13.165  -1.623
  166   HD13  ILE  23          2HD1      ILE  23   9.132  11.723  -0.770
  167    H    GLU  24           H        GLU  24   4.347  14.282  -3.848
  168    HA   GLU  24           HA       GLU  24   4.769  16.433  -5.649
  169    HB2  GLU  24           2HB      GLU  24   2.113  15.382  -4.679
  170    HB3  GLU  24           1HB      GLU  24   2.459  16.237  -6.178
  171    HG2  GLU  24           2HG      GLU  24   3.547  13.586  -5.442
  172    HG3  GLU  24           1HG      GLU  24   2.122  13.824  -6.454
  173    H    CYS  25           H        CYS  25   3.152  16.120  -2.601
  174    HA   CYS  25           HA       CYS  25   2.231  18.808  -2.394
  175    HB2  CYS  25           2HB      CYS  25   1.284  16.915  -1.133
  176    HB3  CYS  25           1HB      CYS  25   2.760  16.807  -0.189
  177    H    LEU  26           H        LEU  26   5.101  17.107  -1.278
  178    HA   LEU  26           HA       LEU  26   6.364  19.174   0.130
  179    HB2  LEU  26           2HB      LEU  26   7.074  16.814   0.152
  180    HB3  LEU  26           1HB      LEU  26   7.533  16.931  -1.528
  181    HG   LEU  26           HG       LEU  26   9.312  18.544  -0.885
  182   HD11  LEU  26          1HD1      LEU  26   8.505  17.815   1.924
  183   HD12  LEU  26          2HD1      LEU  26   8.345  19.402   1.168
  184   HD13  LEU  26          3HD1      LEU  26   9.945  18.725   1.469
  185   HD21  LEU  26          3HD2      LEU  26   9.385  15.862   0.490
  186   HD22  LEU  26          1HD2      LEU  26  10.789  16.860   0.109
  187   HD23  LEU  26          2HD2      LEU  26   9.808  16.185  -1.191
  188    H    LYS  27           H        LYS  27   6.215  18.367  -3.239
  189    HA   LYS  27           HA       LYS  27   8.032  20.367  -4.194
  190    HB2  LYS  27           2HB      LYS  27   5.965  18.628  -5.543
  191    HB3  LYS  27           1HB      LYS  27   6.942  19.786  -6.434
  192    HG2  LYS  27           2HG      LYS  27   8.887  18.569  -6.153
  193    HG3  LYS  27           1HG      LYS  27   8.299  17.773  -4.697
  194    HD2  LYS  27           2HD      LYS  27   8.462  16.233  -6.634
  195    HD3  LYS  27           1HD      LYS  27   6.832  16.362  -6.003
  196    HE2  LYS  27           2HE      LYS  27   6.266  17.904  -7.825
  197    HE3  LYS  27           1HE      LYS  27   7.911  17.761  -8.445
  198    HZ1  LYS  27           3HZ      LYS  27   6.263  16.302  -9.571
  199    HZ2  LYS  27           1HZ      LYS  27   6.051  15.458  -8.130
  200    HZ3  LYS  27           2HZ      LYS  27   7.548  15.443  -8.900
  201    H    GLY  28           H        GLY  28   4.494  20.044  -4.383
  202    HA2  GLY  28           2HA      GLY  28   3.256  22.060  -3.570
  203    HA3  GLY  28           1HA      GLY  28   4.262  22.983  -4.669
  204    H    ILE  29           H        ILE  29   1.507  20.958  -4.348
  205    HA   ILE  29           HA       ILE  29   0.809  21.654  -6.959
  206    HB   ILE  29           HB       ILE  29  -0.110  19.430  -7.506
  207   HG12  ILE  29          2HG1      ILE  29   0.923  17.397  -6.230
  208   HG13  ILE  29          1HG1      ILE  29   1.078  18.530  -4.889
  209   HG21  ILE  29          1HG2      ILE  29   2.835  19.299  -7.026
  210   HG22  ILE  29          2HG2      ILE  29   2.004  19.925  -8.448
  211   HG23  ILE  29          3HG2      ILE  29   1.920  18.205  -8.063
  212   HD11  ILE  29          3HD1      ILE  29  -1.460  17.718  -6.296
  213   HD12  ILE  29          1HD1      ILE  29  -1.351  18.886  -4.980
  214   HD13  ILE  29          2HD1      ILE  29  -0.931  17.196  -4.695
  215    H    GLY  30           H        GLY  30  -0.902  22.454  -6.784
  216    HA2  GLY  30           2HA      GLY  30  -2.559  22.464  -4.412
  217    HA3  GLY  30           1HA      GLY  30  -2.974  23.271  -5.913
  218    H    HIS  31           H        HIS  31  -3.111  20.325  -4.133
  219    HA   HIS  31           HA       HIS  31  -4.265  18.384  -4.253
  220    HB2  HIS  31           2HB      HIS  31  -5.878  19.961  -3.262
  221    HB3  HIS  31           1HB      HIS  31  -6.517  20.311  -4.863
  222    HD1  HIS  31           1HD      HIS  31  -8.322  18.721  -5.753
  223    HD2  HIS  31           2HD      HIS  31  -6.454  17.336  -2.304
  224    HE1  HIS  31           1HE      HIS  31  -9.615  16.682  -5.028
  225    H    LYS  32           H        LYS  32  -3.383  17.273  -5.970
  226    HA   LYS  32           HA       LYS  32  -5.060  17.254  -8.399
  227    HB2  LYS  32           2HB      LYS  32  -2.058  17.039  -8.240
  228    HB3  LYS  32           1HB      LYS  32  -2.985  16.724  -9.703
  229    HG2  LYS  32           2HG      LYS  32  -2.831  19.342  -8.213
  230    HG3  LYS  32           1HG      LYS  32  -2.002  18.942  -9.720
  231    HD2  LYS  32           2HD      LYS  32  -4.172  18.672 -10.844
  232    HD3  LYS  32           1HD      LYS  32  -5.008  19.015  -9.333
  233    HE2  LYS  32           2HE      LYS  32  -5.021  20.983 -10.723
  234    HE3  LYS  32           1HE      LYS  32  -4.001  21.261  -9.314
  235    HZ1  LYS  32           3HZ      LYS  32  -3.058  22.064 -11.416
  236    HZ2  LYS  32           1HZ      LYS  32  -3.011  20.490 -11.990
  237    HZ3  LYS  32           2HZ      LYS  32  -2.053  20.940 -10.669
  238    H    TYR  33           H        TYR  33  -4.822  15.560  -5.888
  239    HA   TYR  33           HA       TYR  33  -5.035  12.996  -7.227
  240    HB2  TYR  33           2HB      TYR  33  -3.192  13.443  -4.866
  241    HB3  TYR  33           1HB      TYR  33  -3.603  11.867  -5.508
  242    HD1  TYR  33           1HD      TYR  33  -1.775  15.031  -6.238
  243    HD2  TYR  33           2HD      TYR  33  -2.348  10.956  -7.336
  244    HE1  TYR  33           1HE      TYR  33   0.150  15.177  -7.673
  245    HE2  TYR  33           2HE      TYR  33  -0.402  11.073  -8.790
  246    HH   TYR  33           HH       TYR  33   1.856  13.664  -8.755
  247    HA   PRO  34           HA       PRO  34  -8.623  12.939  -4.642
  248    HB2  PRO  34           2HB      PRO  34  -8.794  10.192  -4.227
  249    HB3  PRO  34           1HB      PRO  34  -9.389  11.033  -5.657
  250    HG2  PRO  34           2HG      PRO  34  -6.827   9.564  -5.261
  251    HG3  PRO  34           1HG      PRO  34  -7.897   9.597  -6.673
  252    HD2  PRO  34           2HD      PRO  34  -5.620  11.015  -6.606
  253    HD3  PRO  34           1HD      PRO  34  -7.084  11.664  -7.384
  254    H    PHE  35           H        PHE  35  -6.025  10.876  -3.576
  255    HA   PHE  35           HA       PHE  35  -6.853  10.916  -0.791
  256    HB2  PHE  35           2HB      PHE  35  -4.758   9.409  -0.636
  257    HB3  PHE  35           1HB      PHE  35  -6.195   8.813  -1.472
  258    HD1  PHE  35           1HD      PHE  35  -2.941  10.515  -2.129
  259    HD2  PHE  35           2HD      PHE  35  -6.053   8.039  -3.625
  260    HE1  PHE  35           1HE      PHE  35  -1.666  10.158  -4.194
  261    HE2  PHE  35           2HE      PHE  35  -4.816   7.676  -5.665
  262    HZ   PHE  35           HZ       PHE  35  -2.598   8.721  -5.982
  263    H    CYS  36           H        CYS  36  -5.467  13.175  -2.443
  264    HA   CYS  36           HA       CYS  36  -3.112  13.476  -0.776
  265    HB2  CYS  36           2HB      CYS  36  -2.731  13.707  -3.110
  266    HB3  CYS  36           1HB      CYS  36  -3.927  15.001  -3.260
  267    H    HIS  37           H        HIS  37  -3.830  14.088   1.074
  268    HA   HIS  37           HA       HIS  37  -5.678  16.264   1.400
  269    HB2  HIS  37           2HB      HIS  37  -5.232  15.851   3.887
  270    HB3  HIS  37           1HB      HIS  37  -5.948  14.515   3.011
  271    HD1  HIS  37           1HD      HIS  37  -3.202  15.283   5.310
  272    HD2  HIS  37           2HD      HIS  37  -3.948  12.442   2.353
  273    HE1  HIS  37           1HE      HIS  37  -1.639  13.389   5.771
  274    H    CYS  38           H        CYS  38  -3.789  17.262  -0.001
  275    HA   CYS  38           HA       CYS  38  -1.842  18.602   1.723
  276    HB2  CYS  38           2HB      CYS  38  -1.050  17.449  -0.354
  277    HB3  CYS  38           1HB      CYS  38  -2.053  18.524  -1.307
  278    H    ARG  39           H        ARG  39  -1.530  21.008   1.122
  279    HA   ARG  39           HA       ARG  39  -4.161  22.246   0.680
  280    HB2  ARG  39           2HB      ARG  39  -3.585  22.159   3.030
  281    HB3  ARG  39           1HB      ARG  39  -2.053  22.946   2.680
  282    HG2  ARG  39           2HG      ARG  39  -3.235  24.959   1.986
  283    HG3  ARG  39           1HG      ARG  39  -4.779  24.164   2.320
  284    HD2  ARG  39           2HD      ARG  39  -4.104  25.611   4.181
  285    HD3  ARG  39           1HD      ARG  39  -4.157  23.915   4.663
  286    HE   ARG  39           HE       ARG  39  -1.612  25.126   3.856
  287   HH11  ARG  39          1HH1      ARG  39  -3.588  23.692   6.422
  288   HH12  ARG  39          2HH1      ARG  39  -2.306  23.554   7.515
  289   HH21  ARG  39          1HH2      ARG  39   0.166  24.900   5.361
  290   HH22  ARG  39          2HH2      ARG  39  -0.126  24.234   6.900
  Start of MODEL   13
    1    H1   HIS   1           H        HIS   1  23.132   6.046  -2.023
    2    HA   HIS   1           HA       HIS   1  20.770   4.491  -2.154
    3    HB2  HIS   1           2HB      HIS   1  21.434   4.175   0.245
    4    HB3  HIS   1           1HB      HIS   1  21.490   5.919   0.444
    5    HD1  HIS   1           1HD      HIS   1  19.354   6.985   1.246
    6    HD2  HIS   1           2HD      HIS   1  18.741   3.207  -0.368
    7    HE1  HIS   1           1HE      HIS   1  16.910   6.477   1.584
    8    H    GLY   2           H        GLY   2  18.875   6.144  -1.778
    9    HA2  GLY   2           2HA      GLY   2  18.539   8.628  -1.729
   10    HA3  GLY   2           1HA      GLY   2  19.648   8.622  -3.103
   11    H    GLU   3           H        GLU   3  17.633   9.675  -3.961
   12    HA   GLU   3           HA       GLU   3  15.967   9.713  -5.397
   13    HB2  GLU   3           2HB      GLU   3  16.913   6.923  -6.051
   14    HB3  GLU   3           1HB      GLU   3  15.619   7.715  -6.928
   15    HG2  GLU   3           2HG      GLU   3  17.646   7.907  -8.176
   16    HG3  GLU   3           1HG      GLU   3  17.205   9.501  -7.580
   17    H    GLY   4           H        GLY   4  14.482  10.018  -3.830
   18    HA2  GLY   4           2HA      GLY   4  13.020   7.741  -2.786
   19    HA3  GLY   4           1HA      GLY   4  12.778   9.427  -2.349
   20    H    THR   5           H        THR   5  12.785   7.774  -5.423
   21    HA   THR   5           HA       THR   5  10.125   8.821  -5.967
   22    HB   THR   5           HB       THR   5  12.159   7.566  -7.855
   23    HG1  THR   5           1HG      THR   5  11.389  10.274  -7.641
   24   HG21  THR   5          3HG2      THR   5  10.734   8.509  -9.630
   25   HG22  THR   5          1HG2      THR   5   9.616   9.125  -8.412
   26   HG23  THR   5          2HG2      THR   5   9.816   7.385  -8.629
   27    H    PHE   6           H        PHE   6   8.633   7.419  -5.366
   28    HA   PHE   6           HA       PHE   6   9.309   4.587  -5.221
   29    HB2  PHE   6           2HB      PHE   6   6.915   6.064  -4.105
   30    HB3  PHE   6           1HB      PHE   6   7.355   4.391  -3.779
   31    HD1  PHE   6           1HD      PHE   6   9.467   3.916  -2.502
   32    HD2  PHE   6           2HD      PHE   6   7.851   7.835  -2.875
   33    HE1  PHE   6           1HE      PHE   6  10.820   4.659  -0.583
   34    HE2  PHE   6           2HE      PHE   6   9.196   8.580  -0.962
   35    HZ   PHE   6           HZ       PHE   6  10.683   6.996   0.186
   36    H    THR   7           H        THR   7   8.030   3.030  -6.287
   37    HA   THR   7           HA       THR   7   6.768   4.064  -8.639
   38    HB   THR   7           HB       THR   7   7.265   1.227  -7.717
   39    HG1  THR   7           1HG      THR   7   8.958   3.163  -8.856
   40   HG21  THR   7          3HG2      THR   7   6.857   2.421 -10.462
   41   HG22  THR   7          1HG2      THR   7   5.675   1.461  -9.572
   42   HG23  THR   7          2HG2      THR   7   7.177   0.719 -10.121
   43    H    SER   8           H        SER   8   4.691   4.674  -8.235
   44    HA   SER   8           HA       SER   8   2.947   2.739  -6.899
   45    HB2  SER   8           2HB      SER   8   2.805   5.752  -6.667
   46    HB3  SER   8           1HB      SER   8   1.735   4.593  -5.869
   47    HG   SER   8           HG       SER   8   4.504   4.975  -5.484
   48    H    ASP   9           H        ASP   9   1.036   2.406  -7.975
   49    HA   ASP   9           HA       ASP   9  -0.570   2.431  -9.525
   50    HB2  ASP   9           2HB      ASP   9   0.682   5.003 -10.370
   51    HB3  ASP   9           1HB      ASP   9  -0.726   4.326 -11.201
   52    H    LEU  10           H        LEU  10   2.542   3.338 -10.587
   53    HA   LEU  10           HA       LEU  10   2.577   2.599 -13.247
   54    HB2  LEU  10           2HB      LEU  10   4.211   3.953 -11.889
   55    HB3  LEU  10           1HB      LEU  10   4.843   2.477 -11.259
   56    HG   LEU  10           HG       LEU  10   4.915   3.134 -14.227
   57   HD11  LEU  10          1HD1      LEU  10   7.232   3.824 -13.889
   58   HD12  LEU  10          2HD1      LEU  10   7.048   3.621 -12.149
   59   HD13  LEU  10          3HD1      LEU  10   6.118   4.855 -12.997
   60   HD21  LEU  10          3HD2      LEU  10   6.703   1.470 -14.314
   61   HD22  LEU  10          1HD2      LEU  10   5.235   0.752 -13.655
   62   HD23  LEU  10          2HD2      LEU  10   6.560   1.196 -12.579
   63    H    SER  11           H        SER  11   3.365   0.618 -10.380
   64    HA   SER  11           HA       SER  11   3.425  -1.714 -12.179
   65    HB2  SER  11           2HB      SER  11   5.499  -1.235 -10.897
   66    HB3  SER  11           1HB      SER  11   4.602  -1.383  -9.402
   67    HG   SER  11           HG       SER  11   5.429  -3.321 -11.214
   68    H    LYS  12           H        LYS  12   1.772  -0.145  -9.670
   69    HA   LYS  12           HA       LYS  12  -0.016  -0.485  -8.361
   70    HB2  LYS  12           2HB      LYS  12  -0.859  -0.499 -10.713
   71    HB3  LYS  12           1HB      LYS  12  -0.944  -2.249 -10.610
   72    HG2  LYS  12           2HG      LYS  12  -2.579  -2.101  -8.845
   73    HG3  LYS  12           1HG      LYS  12  -2.424  -0.344  -8.816
   74    HD2  LYS  12           2HD      LYS  12  -3.105  -0.334 -11.185
   75    HD3  LYS  12           1HD      LYS  12  -3.435  -2.066 -11.024
   76    HE2  LYS  12           2HE      LYS  12  -5.510  -0.785 -10.725
   77    HE3  LYS  12           1HE      LYS  12  -5.052  -1.585  -9.222
   78    HZ1  LYS  12           3HZ      LYS  12  -5.785   0.696  -8.879
   79    HZ2  LYS  12           1HZ      LYS  12  -4.597   1.266  -9.900
   80    HZ3  LYS  12           2HZ      LYS  12  -4.163   0.583  -8.425
   81    H    GLN  13           H        GLN  13   2.059  -2.754  -8.226
   82    HA   GLN  13           HA       GLN  13   0.589  -5.092  -7.479
   83    HB2  GLN  13           2HB      GLN  13   3.488  -4.437  -6.957
   84    HB3  GLN  13           1HB      GLN  13   2.748  -5.988  -6.588
   85    HG2  GLN  13           2HG      GLN  13   2.201  -6.265  -8.960
   86    HG3  GLN  13           1HG      GLN  13   2.997  -4.732  -9.306
   87   HE21  GLN  13          1HE2      GLN  13   4.462  -5.675 -10.643
   88   HE22  GLN  13          2HE2      GLN  13   5.773  -6.654 -10.092
   89    H    MET  14           H        MET  14   2.500  -2.910  -5.412
   90    HA   MET  14           HA       MET  14   0.852  -3.818  -3.169
   91    HB2  MET  14           2HB      MET  14   3.299  -3.622  -2.794
   92    HB3  MET  14           1HB      MET  14   3.216  -1.915  -3.192
   93    HG2  MET  14           2HG      MET  14   1.826  -1.514  -1.239
   94    HG3  MET  14           1HG      MET  14   1.853  -3.235  -0.856
   95    HE1  MET  14           3HE      MET  14   4.099  -1.623   1.939
   96    HE2  MET  14           1HE      MET  14   2.691  -2.638   1.613
   97    HE3  MET  14           2HE      MET  14   2.661  -0.929   1.185
   98    H    GLU  15           H        GLU  15   2.036  -0.737  -4.362
   99    HA   GLU  15           HA       GLU  15   1.133   1.218  -4.806
  100    HB2  GLU  15           2HB      GLU  15  -0.259  -0.079  -6.312
  101    HB3  GLU  15           1HB      GLU  15  -1.434  -0.327  -5.036
  102    HG2  GLU  15           2HG      GLU  15  -2.048   1.957  -5.042
  103    HG3  GLU  15           1HG      GLU  15  -0.686   2.383  -6.084
  104    H    GLU  16           H        GLU  16   1.413   2.463  -3.194
  105    HA   GLU  16           HA       GLU  16  -0.509   2.475  -0.998
  106    HB2  GLU  16           2HB      GLU  16   1.882   2.173  -0.411
  107    HB3  GLU  16           1HB      GLU  16   2.261   3.681  -1.223
  108    HG2  GLU  16           2HG      GLU  16   0.914   4.898   0.415
  109    HG3  GLU  16           1HG      GLU  16   0.533   3.381   1.225
  110    H    GLU  17           H        GLU  17  -1.497   4.499  -0.438
  111    HA   GLU  17           HA       GLU  17  -1.397   6.533  -2.475
  112    HB2  GLU  17           2HB      GLU  17  -3.484   5.789  -0.394
  113    HB3  GLU  17           1HB      GLU  17  -3.564   7.202  -1.429
  114    HG2  GLU  17           2HG      GLU  17  -3.797   5.860  -3.381
  115    HG3  GLU  17           1HG      GLU  17  -3.465   4.389  -2.472
  116    H    ALA  18           H        ALA  18  -1.960   8.454  -1.315
  117    HA   ALA  18           HA       ALA  18  -1.056  10.344  -0.312
  118    HB1  ALA  18           1HB      ALA  18  -0.700   8.502   2.056
  119    HB2  ALA  18           2HB      ALA  18  -2.121   9.506   1.723
  120    HB3  ALA  18           3HB      ALA  18  -0.572  10.252   2.106
  121    H    VAL  19           H        VAL  19   0.896   7.838  -1.130
  122    HA   VAL  19           HA       VAL  19   3.290   9.351  -0.518
  123    HB   VAL  19           HB       VAL  19   3.476   6.877  -0.343
  124   HG11  VAL  19          1HG1      VAL  19   1.837   6.237  -1.958
  125   HG12  VAL  19          2HG1      VAL  19   3.397   5.484  -2.350
  126   HG13  VAL  19          3HG1      VAL  19   2.831   6.896  -3.256
  127   HG21  VAL  19          3HG2      VAL  19   5.460   6.550  -1.748
  128   HG22  VAL  19          1HG2      VAL  19   5.467   8.115  -0.927
  129   HG23  VAL  19          2HG2      VAL  19   5.042   8.018  -2.635
  130    H    ARG  20           H        ARG  20   1.121   8.486  -3.008
  131    HA   ARG  20           HA       ARG  20   2.371   9.729  -5.195
  132    HB2  ARG  20           2HB      ARG  20  -0.414   8.913  -4.555
  133    HB3  ARG  20           1HB      ARG  20  -0.151   9.834  -6.005
  134    HG2  ARG  20           2HG      ARG  20   0.965   7.131  -5.297
  135    HG3  ARG  20           1HG      ARG  20  -0.271   7.481  -6.497
  136    HD2  ARG  20           2HD      ARG  20   2.685   8.075  -6.608
  137    HD3  ARG  20           1HD      ARG  20   1.713   7.122  -7.716
  138    HE   ARG  20           HE       ARG  20   1.930  10.016  -7.590
  139   HH11  ARG  20          1HH1      ARG  20   0.270   7.277  -9.130
  140   HH12  ARG  20          2HH1      ARG  20   0.055   8.060 -10.619
  141   HH21  ARG  20          1HH2      ARG  20   1.590  11.112  -9.652
  142   HH22  ARG  20          2HH2      ARG  20   0.803  10.310 -10.919
  143    H    CYS  21           H        CYS  21   0.779  10.962  -2.460
  144    HA   CYS  21           HA       CYS  21   0.589  13.615  -3.706
  145    HB2  CYS  21           2HB      CYS  21  -1.460  12.892  -2.646
  146    HB3  CYS  21           1HB      CYS  21  -0.634  12.571  -1.134
  147    H    PHE  22           H        PHE  22   2.515  11.712  -1.700
  148    HA   PHE  22           HA       PHE  22   3.202  13.460   0.378
  149    HB2  PHE  22           2HB      PHE  22   3.449  11.013   0.357
  150    HB3  PHE  22           1HB      PHE  22   4.835  11.167  -0.729
  151    HD1  PHE  22           2HD      PHE  22   3.515  11.505   2.586
  152    HD2  PHE  22           1HD      PHE  22   6.919  12.061   0.152
  153    HE1  PHE  22           2HE      PHE  22   4.879  11.740   4.609
  154    HE2  PHE  22           1HE      PHE  22   8.340  12.308   2.151
  155    HZ   PHE  22           HZ       PHE  22   7.322  12.145   4.402
  156    H    ILE  23           H        ILE  23   5.192  12.481  -2.404
  157    HA   ILE  23           HA       ILE  23   7.145  14.496  -1.904
  158    HB   ILE  23           HB       ILE  23   6.673  12.873  -4.418
  159   HG12  ILE  23          2HG1      ILE  23   7.056  11.421  -2.472
  160   HG13  ILE  23          1HG1      ILE  23   8.410  11.344  -3.590
  161   HG21  ILE  23          1HG2      ILE  23   9.035  13.336  -4.948
  162   HG22  ILE  23          2HG2      ILE  23   9.141  14.351  -3.511
  163   HG23  ILE  23          3HG2      ILE  23   8.085  14.823  -4.843
  164   HD11  ILE  23          3HD1      ILE  23   8.334  12.929  -1.024
  165   HD12  ILE  23          1HD1      ILE  23   9.692  12.825  -2.138
  166   HD13  ILE  23          2HD1      ILE  23   9.154  11.387  -1.268
  167    H    GLU  24           H        GLU  24   4.278  14.283  -3.780
  168    HA   GLU  24           HA       GLU  24   4.718  16.450  -5.545
  169    HB2  GLU  24           2HB      GLU  24   2.060  15.429  -4.567
  170    HB3  GLU  24           1HB      GLU  24   2.422  16.232  -6.092
  171    HG2  GLU  24           2HG      GLU  24   3.425  13.565  -5.246
  172    HG3  GLU  24           1HG      GLU  24   2.070  13.823  -6.340
  173    H    CYS  25           H        CYS  25   3.065  16.124  -2.450
  174    HA   CYS  25           HA       CYS  25   2.344  18.862  -2.206
  175    HB2  CYS  25           2HB      CYS  25   1.213  17.198  -0.901
  176    HB3  CYS  25           1HB      CYS  25   2.697  16.749  -0.068
  177    H    LEU  26           H        LEU  26   5.170  17.007  -1.372
  178    HA   LEU  26           HA       LEU  26   6.497  18.906   0.188
  179    HB2  LEU  26           2HB      LEU  26   7.188  16.532  -0.078
  180    HB3  LEU  26           1HB      LEU  26   7.657  16.869  -1.727
  181    HG   LEU  26           HG       LEU  26   9.422  18.394  -0.882
  182   HD11  LEU  26          1HD1      LEU  26   8.575  17.362   1.821
  183   HD12  LEU  26          2HD1      LEU  26   8.425  19.024   1.245
  184   HD13  LEU  26          3HD1      LEU  26  10.019  18.316   1.493
  185   HD21  LEU  26          3HD2      LEU  26   9.495  15.574   0.195
  186   HD22  LEU  26          1HD2      LEU  26  10.897  16.618  -0.043
  187   HD23  LEU  26          2HD2      LEU  26   9.949  16.083  -1.430
  188    H    LYS  27           H        LYS  27   6.084  18.519  -3.247
  189    HA   LYS  27           HA       LYS  27   7.854  20.684  -4.009
  190    HB2  LYS  27           2HB      LYS  27   5.635  19.338  -5.583
  191    HB3  LYS  27           1HB      LYS  27   6.854  20.407  -6.248
  192    HG2  LYS  27           2HG      LYS  27   7.410  17.732  -4.983
  193    HG3  LYS  27           1HG      LYS  27   7.258  18.010  -6.714
  194    HD2  LYS  27           2HD      LYS  27   9.163  19.584  -6.585
  195    HD3  LYS  27           1HD      LYS  27   9.324  19.213  -4.868
  196    HE2  LYS  27           2HE      LYS  27  10.924  17.921  -6.153
  197    HE3  LYS  27           1HE      LYS  27   9.724  16.856  -5.431
  198    HZ1  LYS  27           3HZ      LYS  27   8.602  16.726  -7.601
  199    HZ2  LYS  27           1HZ      LYS  27  10.224  16.273  -7.726
  200    HZ3  LYS  27           2HZ      LYS  27   9.731  17.779  -8.262
  201    H    GLY  28           H        GLY  28   4.355  20.154  -4.097
  202    HA2  GLY  28           2HA      GLY  28   3.009  21.847  -2.866
  203    HA3  GLY  28           1HA      GLY  28   3.887  23.065  -3.769
  204    H    ILE  29           H        ILE  29   1.396  20.652  -3.863
  205    HA   ILE  29           HA       ILE  29   0.492  21.880  -6.189
  206    HB   ILE  29           HB       ILE  29  -0.277  19.711  -7.150
  207   HG12  ILE  29          2HG1      ILE  29   1.161  17.661  -6.567
  208   HG13  ILE  29          1HG1      ILE  29   1.498  18.471  -5.042
  209   HG21  ILE  29          1HG2      ILE  29   1.583  20.800  -8.139
  210   HG22  ILE  29          2HG2      ILE  29   1.818  19.051  -8.190
  211   HG23  ILE  29          3HG2      ILE  29   2.683  20.027  -6.997
  212   HD11  ILE  29          3HD1      ILE  29  -0.902  18.478  -4.572
  213   HD12  ILE  29          1HD1      ILE  29  -0.283  16.837  -4.797
  214   HD13  ILE  29          2HD1      ILE  29  -1.196  17.639  -6.087
  215    H    GLY  30           H        GLY  30  -1.245  22.359  -5.898
  216    HA2  GLY  30           2HA      GLY  30  -2.883  21.552  -3.611
  217    HA3  GLY  30           1HA      GLY  30  -3.274  22.862  -4.720
  218    H    HIS  31           H        HIS  31  -4.042  19.796  -3.753
  219    HA   HIS  31           HA       HIS  31  -5.305  18.114  -4.432
  220    HB2  HIS  31           2HB      HIS  31  -6.822  20.494  -5.361
  221    HB3  HIS  31           1HB      HIS  31  -7.533  18.873  -5.405
  222    HD1  HIS  31           1HD      HIS  31  -7.610  21.795  -3.401
  223    HD2  HIS  31           2HD      HIS  31  -7.209  17.742  -2.559
  224    HE1  HIS  31           1HE      HIS  31  -8.333  21.514  -1.012
  225    H    LYS  32           H        LYS  32  -4.020  16.997  -5.813
  226    HA   LYS  32           HA       LYS  32  -4.856  17.149  -8.635
  227    HB2  LYS  32           2HB      LYS  32  -2.059  16.669  -7.597
  228    HB3  LYS  32           1HB      LYS  32  -2.538  16.420  -9.265
  229    HG2  LYS  32           2HG      LYS  32  -2.828  19.059  -7.857
  230    HG3  LYS  32           1HG      LYS  32  -1.396  18.599  -8.785
  231    HD2  LYS  32           2HD      LYS  32  -2.658  18.429 -10.803
  232    HD3  LYS  32           1HD      LYS  32  -4.185  18.563  -9.940
  233    HE2  LYS  32           2HE      LYS  32  -2.119  20.743  -9.979
  234    HE3  LYS  32           1HE      LYS  32  -3.410  20.627 -11.173
  235    HZ1  LYS  32           3HZ      LYS  32  -3.979  22.114  -9.368
  236    HZ2  LYS  32           1HZ      LYS  32  -3.827  20.893  -8.224
  237    HZ3  LYS  32           2HZ      LYS  32  -5.020  20.796  -9.393
  238    H    TYR  33           H        TYR  33  -4.991  15.328  -5.934
  239    HA   TYR  33           HA       TYR  33  -5.430  12.901  -7.418
  240    HB2  TYR  33           2HB      TYR  33  -3.675  12.936  -4.928
  241    HB3  TYR  33           1HB      TYR  33  -4.117  11.524  -5.860
  242    HD1  TYR  33           1HD      TYR  33  -1.945  14.515  -5.747
  243    HD2  TYR  33           2HD      TYR  33  -2.940  10.977  -7.906
  244    HE1  TYR  33           1HE      TYR  33   0.084  14.762  -7.069
  245    HE2  TYR  33           2HE      TYR  33  -0.901  11.227  -9.234
  246    HH   TYR  33           HH       TYR  33   1.604  13.399  -8.437
  247    HA   PRO  34           HA       PRO  34  -9.113  12.940  -4.899
  248    HB2  PRO  34           2HB      PRO  34  -9.000  10.200  -4.149
  249    HB3  PRO  34           1HB      PRO  34  -9.874  10.879  -5.518
  250    HG2  PRO  34           2HG      PRO  34  -7.204   9.589  -5.445
  251    HG3  PRO  34           1HG      PRO  34  -8.430   9.580  -6.723
  252    HD2  PRO  34           2HD      PRO  34  -6.233  11.037  -6.960
  253    HD3  PRO  34           1HD      PRO  34  -7.800  11.679  -7.501
  254    H    PHE  35           H        PHE  35  -6.568  10.946  -3.569
  255    HA   PHE  35           HA       PHE  35  -7.341  11.394  -0.810
  256    HB2  PHE  35           2HB      PHE  35  -5.438   9.797  -0.405
  257    HB3  PHE  35           1HB      PHE  35  -6.760   9.186  -1.404
  258    HD1  PHE  35           1HD      PHE  35  -3.284  10.330  -1.418
  259    HD2  PHE  35           2HD      PHE  35  -6.442   8.691  -3.714
  260    HE1  PHE  35           1HE      PHE  35  -1.707   9.821  -3.222
  261    HE2  PHE  35           2HE      PHE  35  -4.935   8.178  -5.508
  262    HZ   PHE  35           HZ       PHE  35  -2.524   8.728  -5.307
  263    H    CYS  36           H        CYS  36  -6.044  13.486  -2.621
  264    HA   CYS  36           HA       CYS  36  -3.661  13.992  -0.989
  265    HB2  CYS  36           2HB      CYS  36  -3.123  13.532  -3.280
  266    HB3  CYS  36           1HB      CYS  36  -4.201  14.813  -3.836
  267    H    HIS  37           H        HIS  37  -4.393  15.274   0.538
  268    HA   HIS  37           HA       HIS  37  -5.787  17.691  -0.353
  269    HB2  HIS  37           2HB      HIS  37  -5.830  16.379   2.377
  270    HB3  HIS  37           1HB      HIS  37  -6.688  17.852   1.933
  271    HD1  HIS  37           1HD      HIS  37  -7.522  14.541   2.558
  272    HD2  HIS  37           2HD      HIS  37  -8.251  17.061  -0.655
  273    HE1  HIS  37           1HE      HIS  37  -9.528  13.590   1.371
  274    H    CYS  38           H        CYS  38  -2.889  16.546   0.470
  275    HA   CYS  38           HA       CYS  38  -1.962  18.698   2.127
  276    HB2  CYS  38           2HB      CYS  38  -1.016  16.368   2.173
  277    HB3  CYS  38           1HB      CYS  38  -0.358  16.651   0.565
  278    H    ARG  39           H        ARG  39  -1.987  20.566   1.209
  279    HA   ARG  39           HA       ARG  39  -1.564  20.849  -1.674
  280    HB2  ARG  39           2HB      ARG  39  -2.582  22.802   0.377
  281    HB3  ARG  39           1HB      ARG  39  -2.452  23.114  -1.349
  282    HG2  ARG  39           2HG      ARG  39  -4.104  21.444  -1.841
  283    HG3  ARG  39           1HG      ARG  39  -4.136  20.925  -0.156
  284    HD2  ARG  39           2HD      ARG  39  -6.045  22.335  -0.677
  285    HD3  ARG  39           1HD      ARG  39  -4.991  23.097   0.510
  286    HE   ARG  39           HE       ARG  39  -5.003  23.798  -2.348
  287   HH11  ARG  39          1HH1      ARG  39  -4.849  24.789   1.043
  288   HH12  ARG  39          2HH1      ARG  39  -4.778  26.461   0.680
  289   HH21  ARG  39          1HH2      ARG  39  -4.939  26.103  -2.809
  290   HH22  ARG  39          2HH2      ARG  39  -4.831  27.210  -1.513
  Start of MODEL   14
    1    H1   HIS   1           H        HIS   1  17.272   2.673  16.176
    2    HA   HIS   1           HA       HIS   1  19.978   3.318  15.821
    3    HB2  HIS   1           2HB      HIS   1  18.409   4.796  17.953
    4    HB3  HIS   1           1HB      HIS   1  20.154   4.602  18.002
    5    HD1  HIS   1           1HD      HIS   1  17.958   7.208  17.322
    6    HD2  HIS   1           2HD      HIS   1  21.061   5.506  15.136
    7    HE1  HIS   1           1HE      HIS   1  18.758   8.989  15.738
    8    H    GLY   2           H        GLY   2  21.202   2.504  17.792
    9    HA2  GLY   2           2HA      GLY   2  21.212   1.142  19.733
   10    HA3  GLY   2           1HA      GLY   2  19.642   0.508  19.255
   11    H    GLU   3           H        GLU   3  20.650  -1.560  19.623
   12    HA   GLU   3           HA       GLU   3  22.113  -2.460  17.249
   13    HB2  GLU   3           2HB      GLU   3  22.648  -3.237  20.112
   14    HB3  GLU   3           1HB      GLU   3  23.380  -3.998  18.711
   15    HG2  GLU   3           2HG      GLU   3  24.492  -1.924  18.136
   16    HG3  GLU   3           1HG      GLU   3  23.696  -1.107  19.479
   17    H    GLY   4           H        GLY   4  20.875  -3.890  16.264
   18    HA2  GLY   4           2HA      GLY   4  19.994  -6.048  16.085
   19    HA3  GLY   4           1HA      GLY   4  19.822  -6.089  17.831
   20    H    THR   5           H        THR   5  18.611  -3.475  15.845
   21    HA   THR   5           HA       THR   5  15.942  -4.459  16.454
   22    HB   THR   5           HB       THR   5  16.256  -2.356  17.588
   23    HG1  THR   5           1HG      THR   5  14.623  -1.108  16.605
   24   HG21  THR   5          3HG2      THR   5  18.120  -1.419  16.320
   25   HG22  THR   5          1HG2      THR   5  16.802  -0.250  16.394
   26   HG23  THR   5          2HG2      THR   5  17.077  -1.181  14.919
   27    H    PHE   6           H        PHE   6  14.956  -5.326  14.788
   28    HA   PHE   6           HA       PHE   6  15.631  -4.324  12.119
   29    HB2  PHE   6           2HB      PHE   6  14.791  -7.145  12.853
   30    HB3  PHE   6           1HB      PHE   6  15.299  -6.579  11.265
   31    HD1  PHE   6           1HD      PHE   6  17.694  -5.647  11.079
   32    HD2  PHE   6           2HD      PHE   6  16.353  -8.045  14.322
   33    HE1  PHE   6           1HE      PHE   6  20.028  -6.185  11.641
   34    HE2  PHE   6           2HE      PHE   6  18.681  -8.589  14.891
   35    HZ   PHE   6           HZ       PHE   6  20.526  -7.653  13.549
   36    H    THR   7           H        THR   7  13.936  -3.635  10.921
   37    HA   THR   7           HA       THR   7  11.266  -4.382  11.829
   38    HB   THR   7           HB       THR   7  12.103  -1.596  10.951
   39    HG1  THR   7           1HG      THR   7  11.828  -2.808  13.499
   40   HG21  THR   7          3HG2      THR   7   9.517  -2.609  12.160
   41   HG22  THR   7          1HG2      THR   7   9.752  -2.169  10.467
   42   HG23  THR   7          2HG2      THR   7   9.873  -0.939  11.724
   43    H    SER   8           H        SER   8  10.600  -5.630  10.182
   44    HA   SER   8           HA       SER   8  10.448  -4.482   7.565
   45    HB2  SER   8           2HB      SER   8  11.459  -6.606   6.574
   46    HB3  SER   8           1HB      SER   8  12.592  -5.498   7.349
   47    HG   SER   8           HG       SER   8  11.850  -7.048   9.268
   48    H    ASP   9           H        ASP   9   8.383  -4.708   7.156
   49    HA   ASP   9           HA       ASP   9   6.231  -5.532   6.942
   50    HB2  ASP   9           2HB      ASP   9   7.531  -7.503   5.875
   51    HB3  ASP   9           1HB      ASP   9   7.358  -8.305   7.429
   52    H    LEU  10           H        LEU  10   7.695  -5.060   9.481
   53    HA   LEU  10           HA       LEU  10   6.228  -6.518  11.485
   54    HB2  LEU  10           2HB      LEU  10   8.557  -5.815  11.845
   55    HB3  LEU  10           1HB      LEU  10   8.102  -4.147  11.625
   56    HG   LEU  10           HG       LEU  10   7.028  -5.762  13.949
   57   HD11  LEU  10          1HD1      LEU  10   9.478  -5.898  13.982
   58   HD12  LEU  10          2HD1      LEU  10   8.878  -4.858  15.273
   59   HD13  LEU  10          3HD1      LEU  10   9.576  -4.144  13.820
   60   HD21  LEU  10          3HD2      LEU  10   7.535  -2.799  13.573
   61   HD22  LEU  10          1HD2      LEU  10   6.803  -3.558  14.986
   62   HD23  LEU  10          2HD2      LEU  10   5.968  -3.565  13.426
   63    H    SER  11           H        SER  11   6.309  -3.256  10.153
   64    HA   SER  11           HA       SER  11   3.891  -2.582  11.594
   65    HB2  SER  11           2HB      SER  11   5.461  -0.977   9.565
   66    HB3  SER  11           1HB      SER  11   4.235  -0.357  10.686
   67    HG   SER  11           HG       SER  11   6.812  -0.567  11.060
   68    H    LYS  12           H        LYS  12   4.932  -3.904   8.674
   69    HA   LYS  12           HA       LYS  12   3.965  -4.736   6.812
   70    HB2  LYS  12           2HB      LYS  12   2.541  -5.700   8.627
   71    HB3  LYS  12           1HB      LYS  12   1.403  -4.397   8.343
   72    HG2  LYS  12           2HG      LYS  12   1.034  -5.205   6.079
   73    HG3  LYS  12           1HG      LYS  12   2.195  -6.511   6.371
   74    HD2  LYS  12           2HD      LYS  12   0.898  -7.293   8.186
   75    HD3  LYS  12           1HD      LYS  12  -0.280  -5.995   7.944
   76    HE2  LYS  12           2HE      LYS  12  -1.118  -8.079   6.940
   77    HE3  LYS  12           1HE      LYS  12  -0.767  -6.884   5.693
   78    HZ1  LYS  12           3HZ      LYS  12   0.957  -9.159   6.474
   79    HZ2  LYS  12           1HZ      LYS  12   1.364  -8.022   5.297
   80    HZ3  LYS  12           2HZ      LYS  12   0.063  -9.061   5.060
   81    H    GLN  13           H        GLN  13   4.278  -1.963   7.088
   82    HA   GLN  13           HA       GLN  13   2.015  -0.673   5.828
   83    HB2  GLN  13           2HB      GLN  13   3.335   1.397   6.008
   84    HB3  GLN  13           1HB      GLN  13   3.155   0.575   7.551
   85    HG2  GLN  13           2HG      GLN  13   5.411  -0.291   7.380
   86    HG3  GLN  13           1HG      GLN  13   5.591   0.448   5.790
   87   HE21  GLN  13          1HE2      GLN  13   5.729   2.668   5.640
   88   HE22  GLN  13          2HE2      GLN  13   6.202   3.632   6.993
   89    H    MET  14           H        MET  14   1.950   0.134   3.820
   90    HA   MET  14           HA       MET  14   4.204  -0.087   2.049
   91    HB2  MET  14           2HB      MET  14   3.039  -2.289   1.827
   92    HB3  MET  14           1HB      MET  14   1.550  -1.439   1.459
   93    HG2  MET  14           2HG      MET  14   2.597  -2.310  -0.561
   94    HG3  MET  14           1HG      MET  14   2.522  -0.551  -0.581
   95    HE1  MET  14           3HE      MET  14   5.086  -2.746   1.482
   96    HE2  MET  14           1HE      MET  14   6.392  -2.922   0.312
   97    HE3  MET  14           2HE      MET  14   4.828  -3.682   0.010
   98    H    GLU  15           H        GLU  15   4.115   2.108   2.145
   99    HA   GLU  15           HA       GLU  15   1.780   3.607   1.794
  100    HB2  GLU  15           2HB      GLU  15   4.613   4.520   1.279
  101    HB3  GLU  15           1HB      GLU  15   3.217   5.548   1.543
  102    HG2  GLU  15           2HG      GLU  15   4.185   5.633   3.600
  103    HG3  GLU  15           1HG      GLU  15   3.103   4.264   3.828
  104    H    GLU  16           H        GLU  16   0.676   3.149   0.087
  105    HA   GLU  16           HA       GLU  16   1.952   3.501  -2.530
  106    HB2  GLU  16           2HB      GLU  16   0.125   2.117  -3.446
  107    HB3  GLU  16           1HB      GLU  16   1.128   1.265  -2.285
  108    HG2  GLU  16           2HG      GLU  16  -0.555   1.538  -0.572
  109    HG3  GLU  16           1HG      GLU  16  -1.549   2.486  -1.677
  110    H    GLU  17           H        GLU  17  -0.778   4.457  -0.467
  111    HA   GLU  17           HA       GLU  17  -1.420   6.363  -2.463
  112    HB2  GLU  17           2HB      GLU  17  -3.767   6.179  -1.662
  113    HB3  GLU  17           1HB      GLU  17  -3.135   4.740  -2.447
  114    HG2  GLU  17           2HG      GLU  17  -4.457   3.964  -0.666
  115    HG3  GLU  17           1HG      GLU  17  -2.793   3.764  -0.147
  116    H    ALA  18           H        ALA  18  -2.449   8.025  -1.520
  117    HA   ALA  18           HA       ALA  18  -2.149  10.125  -0.487
  118    HB1  ALA  18           1HB      ALA  18  -1.871   8.447   2.012
  119    HB2  ALA  18           2HB      ALA  18  -3.398   9.049   1.346
  120    HB3  ALA  18           3HB      ALA  18  -2.177  10.175   1.957
  121    H    VAL  19           H        VAL  19   0.320   8.127  -0.850
  122    HA   VAL  19           HA       VAL  19   2.258  10.061   0.137
  123    HB   VAL  19           HB       VAL  19   2.585   7.674   0.765
  124   HG11  VAL  19          1HG1      VAL  19   1.632   6.614  -1.177
  125   HG12  VAL  19          2HG1      VAL  19   3.272   6.036  -0.896
  126   HG13  VAL  19          3HG1      VAL  19   2.956   7.211  -2.177
  127   HG21  VAL  19          3HG2      VAL  19   4.519   9.127   0.649
  128   HG22  VAL  19          1HG2      VAL  19   4.705   8.767  -1.070
  129   HG23  VAL  19          2HG2      VAL  19   4.949   7.493   0.132
  130    H    ARG  20           H        ARG  20   0.664   8.805  -2.576
  131    HA   ARG  20           HA       ARG  20   2.480   9.399  -4.623
  132    HB2  ARG  20           2HB      ARG  20  -0.451   8.879  -4.544
  133    HB3  ARG  20           1HB      ARG  20   0.263   9.382  -6.055
  134    HG2  ARG  20           2HG      ARG  20   0.971   6.941  -4.438
  135    HG3  ARG  20           1HG      ARG  20   0.061   6.979  -5.949
  136    HD2  ARG  20           2HD      ARG  20   2.952   7.798  -5.591
  137    HD3  ARG  20           1HD      ARG  20   2.390   6.319  -6.342
  138    HE   ARG  20           HE       ARG  20   1.255   7.873  -7.981
  139   HH11  ARG  20          1HH1      ARG  20   4.327   8.652  -6.397
  140   HH12  ARG  20          2HH1      ARG  20   4.892   9.618  -7.673
  141   HH21  ARG  20          1HH2      ARG  20   2.048   9.221  -9.711
  142   HH22  ARG  20          2HH2      ARG  20   3.575   9.957  -9.598
  143    H    CYS  21           H        CYS  21   0.181  11.427  -2.959
  144    HA   CYS  21           HA       CYS  21   0.944  13.581  -4.775
  145    HB2  CYS  21           2HB      CYS  21  -1.490  13.173  -4.432
  146    HB3  CYS  21           1HB      CYS  21  -1.302  13.556  -2.737
  147    H    PHE  22           H        PHE  22   1.793  12.202  -1.935
  148    HA   PHE  22           HA       PHE  22   1.929  14.394  -0.132
  149    HB2  PHE  22           2HB      PHE  22   1.881  11.992   0.478
  150    HB3  PHE  22           1HB      PHE  22   3.518  11.837  -0.155
  151    HD1  PHE  22           2HD      PHE  22   5.392  12.853   1.071
  152    HD2  PHE  22           1HD      PHE  22   1.422  12.926   2.562
  153    HE1  PHE  22           2HE      PHE  22   6.262  13.401   3.284
  154    HE2  PHE  22           1HE      PHE  22   2.246  13.459   4.787
  155    HZ   PHE  22           HZ       PHE  22   4.695  13.712   5.180
  156    H    ILE  23           H        ILE  23   4.389  12.681  -2.008
  157    HA   ILE  23           HA       ILE  23   6.500  14.447  -1.331
  158    HB   ILE  23           HB       ILE  23   6.308  12.579  -3.722
  159   HG12  ILE  23          2HG1      ILE  23   5.879  11.368  -1.603
  160   HG13  ILE  23          1HG1      ILE  23   7.392  10.876  -2.345
  161   HG21  ILE  23          1HG2      ILE  23   8.755  12.540  -3.596
  162   HG22  ILE  23          2HG2      ILE  23   8.691  13.706  -2.273
  163   HG23  ILE  23          3HG2      ILE  23   8.139  14.172  -3.886
  164   HD11  ILE  23          3HD1      ILE  23   8.630  12.224  -0.744
  165   HD12  ILE  23          1HD1      ILE  23   7.578  11.079   0.082
  166   HD13  ILE  23          2HD1      ILE  23   7.127  12.784  -0.021
  167    H    GLU  24           H        GLU  24   4.100  14.350  -3.784
  168    HA   GLU  24           HA       GLU  24   5.294  16.239  -5.573
  169    HB2  GLU  24           2HB      GLU  24   2.420  15.410  -5.371
  170    HB3  GLU  24           1HB      GLU  24   3.228  16.083  -6.785
  171    HG2  GLU  24           2HG      GLU  24   3.608  13.431  -5.496
  172    HG3  GLU  24           1HG      GLU  24   2.910  13.740  -7.078
  173    H    CYS  25           H        CYS  25   2.868  16.307  -3.090
  174    HA   CYS  25           HA       CYS  25   2.079  19.006  -3.243
  175    HB2  CYS  25           2HB      CYS  25   0.728  17.499  -1.994
  176    HB3  CYS  25           1HB      CYS  25   2.084  16.999  -0.997
  177    H    LEU  26           H        LEU  26   4.772  17.406  -1.829
  178    HA   LEU  26           HA       LEU  26   5.648  19.571  -0.220
  179    HB2  LEU  26           2HB      LEU  26   6.138  17.169   0.197
  180    HB3  LEU  26           1HB      LEU  26   7.135  17.166  -1.241
  181    HG   LEU  26           HG       LEU  26   8.704  18.701  -0.187
  182   HD11  LEU  26          1HD1      LEU  26   8.473  19.266   2.187
  183   HD12  LEU  26          2HD1      LEU  26   6.873  18.519   2.201
  184   HD13  LEU  26          3HD1      LEU  26   7.173  19.951   1.217
  185   HD21  LEU  26          3HD2      LEU  26   9.038  16.309   0.090
  186   HD22  LEU  26          1HD2      LEU  26   8.019  16.321   1.530
  187   HD23  LEU  26          2HD2      LEU  26   9.557  17.183   1.533
  188    H    LYS  27           H        LYS  27   5.588  19.136  -3.549
  189    HA   LYS  27           HA       LYS  27   7.249  21.358  -3.800
  190    HB2  LYS  27           2HB      LYS  27   8.608  20.316  -5.768
  191    HB3  LYS  27           1HB      LYS  27   9.107  20.128  -4.099
  192    HG2  LYS  27           2HG      LYS  27   9.435  18.037  -5.226
  193    HG3  LYS  27           1HG      LYS  27   8.076  17.855  -4.122
  194    HD2  LYS  27           2HD      LYS  27   6.527  18.109  -5.996
  195    HD3  LYS  27           1HD      LYS  27   7.887  18.326  -7.096
  196    HE2  LYS  27           2HE      LYS  27   7.347  15.852  -5.452
  197    HE3  LYS  27           1HE      LYS  27   6.974  16.033  -7.164
  198    HZ1  LYS  27           3HZ      LYS  27   9.016  14.858  -6.875
  199    HZ2  LYS  27           1HZ      LYS  27   9.672  16.087  -5.930
  200    HZ3  LYS  27           2HZ      LYS  27   9.349  16.350  -7.560
  201    H    GLY  28           H        GLY  28   5.143  22.162  -4.214
  202    HA2  GLY  28           2HA      GLY  28   4.569  23.706  -5.969
  203    HA3  GLY  28           1HA      GLY  28   5.040  22.499  -7.127
  204    H    ILE  29           H        ILE  29   3.099  20.470  -5.555
  205    HA   ILE  29           HA       ILE  29   0.926  21.681  -6.899
  206    HB   ILE  29           HB       ILE  29   0.120  19.590  -7.848
  207   HG12  ILE  29          2HG1      ILE  29   1.878  17.649  -7.966
  208   HG13  ILE  29          1HG1      ILE  29   2.462  18.338  -6.455
  209   HG21  ILE  29          1HG2      ILE  29   1.837  19.223  -9.557
  210   HG22  ILE  29          2HG2      ILE  29   2.958  20.177  -8.578
  211   HG23  ILE  29          3HG2      ILE  29   1.503  20.925  -9.231
  212   HD11  ILE  29          3HD1      ILE  29   0.901  16.518  -6.019
  213   HD12  ILE  29          1HD1      ILE  29  -0.326  17.337  -6.988
  214   HD13  ILE  29          2HD1      ILE  29   0.225  18.065  -5.494
  215    H    GLY  30           H        GLY  30  -0.359  22.068  -5.839
  216    HA2  GLY  30           2HA      GLY  30  -1.169  20.727  -3.331
  217    HA3  GLY  30           1HA      GLY  30  -1.771  22.299  -3.849
  218    H    HIS  31           H        HIS  31  -2.309  18.962  -3.795
  219    HA   HIS  31           HA       HIS  31  -4.060  17.632  -4.234
  220    HB2  HIS  31           2HB      HIS  31  -5.475  19.453  -3.236
  221    HB3  HIS  31           1HB      HIS  31  -5.643  20.134  -4.842
  222    HD1  HIS  31           1HD      HIS  31  -7.731  19.444  -6.030
  223    HD2  HIS  31           2HD      HIS  31  -6.603  16.727  -3.096
  224    HE1  HIS  31           1HE      HIS  31  -9.534  17.670  -5.982
  225    H    LYS  32           H        LYS  32  -3.038  16.693  -5.947
  226    HA   LYS  32           HA       LYS  32  -4.206  17.369  -8.579
  227    HB2  LYS  32           2HB      LYS  32  -1.740  17.617  -8.462
  228    HB3  LYS  32           1HB      LYS  32  -1.603  15.942  -7.942
  229    HG2  LYS  32           2HG      LYS  32  -2.579  15.266 -10.130
  230    HG3  LYS  32           1HG      LYS  32  -2.506  16.956 -10.629
  231    HD2  LYS  32           2HD      LYS  32  -0.086  16.955 -10.304
  232    HD3  LYS  32           1HD      LYS  32  -0.159  15.281  -9.755
  233    HE2  LYS  32           2HE      LYS  32  -1.059  14.612 -11.935
  234    HE3  LYS  32           1HE      LYS  32  -0.938  16.277 -12.492
  235    HZ1  LYS  32           3HZ      LYS  32   1.461  16.157 -12.177
  236    HZ2  LYS  32           1HZ      LYS  32   0.936  14.937 -13.224
  237    HZ3  LYS  32           2HZ      LYS  32   1.320  14.576 -11.620
  238    H    TYR  33           H        TYR  33  -4.518  15.385  -6.041
  239    HA   TYR  33           HA       TYR  33  -5.363  13.058  -7.605
  240    HB2  TYR  33           2HB      TYR  33  -3.691  12.988  -5.082
  241    HB3  TYR  33           1HB      TYR  33  -4.399  11.585  -5.831
  242    HD1  TYR  33           1HD      TYR  33  -1.902  14.288  -6.307
  243    HD2  TYR  33           2HD      TYR  33  -3.197  10.444  -7.562
  244    HE1  TYR  33           1HE      TYR  33   0.166  14.027  -7.527
  245    HE2  TYR  33           2HE      TYR  33  -1.111  10.153  -8.808
  246    HH   TYR  33           HH       TYR  33   1.572  12.164  -8.357
  247    HA   PRO  34           HA       PRO  34  -9.068  13.499  -5.156
  248    HB2  PRO  34           2HB      PRO  34  -9.636  10.808  -4.750
  249    HB3  PRO  34           1HB      PRO  34 -10.038  11.717  -6.205
  250    HG2  PRO  34           2HG      PRO  34  -7.703   9.934  -5.704
  251    HG3  PRO  34           1HG      PRO  34  -8.731  10.064  -7.142
  252    HD2  PRO  34           2HD      PRO  34  -6.333  11.174  -7.093
  253    HD3  PRO  34           1HD      PRO  34  -7.702  12.029  -7.838
  254    H    PHE  35           H        PHE  35  -6.683  11.226  -3.984
  255    HA   PHE  35           HA       PHE  35  -7.602  11.425  -1.218
  256    HB2  PHE  35           2HB      PHE  35  -5.813   9.619  -0.895
  257    HB3  PHE  35           1HB      PHE  35  -7.219   9.207  -1.879
  258    HD1  PHE  35           2HD      PHE  35  -3.653  10.087  -2.001
  259    HD2  PHE  35           1HD      PHE  35  -7.029   8.709  -4.153
  260    HE1  PHE  35           2HE      PHE  35  -2.202   9.520  -3.900
  261    HE2  PHE  35           1HE      PHE  35  -5.650   8.158  -6.046
  262    HZ   PHE  35           HZ       PHE  35  -3.194   8.538  -5.955
  263    H    CYS  36           H        CYS  36  -6.078  13.486  -2.814
  264    HA   CYS  36           HA       CYS  36  -3.629  13.664  -1.274
  265    HB2  CYS  36           2HB      CYS  36  -3.395  14.088  -3.582
  266    HB3  CYS  36           1HB      CYS  36  -4.657  15.302  -3.605
  267    H    HIS  37           H        HIS  37  -4.136  14.180   0.683
  268    HA   HIS  37           HA       HIS  37  -6.025  16.319   1.206
  269    HB2  HIS  37           2HB      HIS  37  -4.606  14.471   3.134
  270    HB3  HIS  37           1HB      HIS  37  -5.926  15.565   3.526
  271    HD1  HIS  37           1HD      HIS  37  -5.454  12.120   3.034
  272    HD2  HIS  37           2HD      HIS  37  -8.205  14.861   1.566
  273    HE1  HIS  37           1HE      HIS  37  -7.433  10.772   2.304
  274    H    CYS  38           H        CYS  38  -2.705  15.767   0.988
  275    HA   CYS  38           HA       CYS  38  -1.637  17.576   2.832
  276    HB2  CYS  38           2HB      CYS  38  -0.261  15.943   1.648
  277    HB3  CYS  38           1HB      CYS  38  -0.583  16.769   0.124
  278    H    ARG  39           H        ARG  39  -2.370  19.556   2.965
  279    HA   ARG  39           HA       ARG  39  -2.017  21.372   0.730
  280    HB2  ARG  39           2HB      ARG  39  -4.268  22.294   0.894
  281    HB3  ARG  39           1HB      ARG  39  -4.328  20.599   0.467
  282    HG2  ARG  39           2HG      ARG  39  -4.805  20.083   2.867
  283    HG3  ARG  39           1HG      ARG  39  -4.948  21.820   3.145
  284    HD2  ARG  39           2HD      ARG  39  -7.147  20.909   2.777
  285    HD3  ARG  39           1HD      ARG  39  -6.690  21.907   1.395
  286    HE   ARG  39           HE       ARG  39  -6.372  18.993   1.351
  287   HH11  ARG  39          1HH1      ARG  39  -7.719  21.933  -0.106
  288   HH12  ARG  39          2HH1      ARG  39  -8.320  21.143  -1.493
  289   HH21  ARG  39          1HH2      ARG  39  -7.227  17.908  -0.622
  290   HH22  ARG  39          2HH2      ARG  39  -8.052  18.861  -1.773
  Start of MODEL   15
    1    H1   HIS   1           H        HIS   1   4.872  -6.645 -23.574
    2    HA   HIS   1           HA       HIS   1   6.018  -9.113 -23.345
    3    HB2  HIS   1           2HB      HIS   1   6.945  -7.252 -21.150
    4    HB3  HIS   1           1HB      HIS   1   7.073  -9.007 -21.095
    5    HD1  HIS   1           1HD      HIS   1   8.881  -6.041 -22.204
    6    HD2  HIS   1           2HD      HIS   1   8.748 -10.064 -23.196
    7    HE1  HIS   1           1HE      HIS   1  10.991  -6.508 -23.505
    8    H    GLY   2           H        GLY   2   4.556  -6.570 -21.353
    9    HA2  GLY   2           2HA      GLY   2   2.481  -6.555 -20.365
   10    HA3  GLY   2           1HA      GLY   2   2.174  -8.136 -21.080
   11    H    GLU   3           H        GLU   3   1.318  -8.976 -19.203
   12    HA   GLU   3           HA       GLU   3   1.293 -10.206 -17.339
   13    HB2  GLU   3           2HB      GLU   3   3.378 -11.288 -18.081
   14    HB3  GLU   3           1HB      GLU   3   4.316  -9.970 -17.403
   15    HG2  GLU   3           2HG      GLU   3   4.425 -11.963 -16.011
   16    HG3  GLU   3           1HG      GLU   3   3.646 -10.628 -15.166
   17    H    GLY   4           H        GLY   4   1.035  -9.908 -15.196
   18    HA2  GLY   4           2HA      GLY   4   1.255  -7.143 -14.341
   19    HA3  GLY   4           1HA      GLY   4   0.389  -8.433 -13.505
   20    H    THR   5           H        THR   5   3.604  -7.386 -14.370
   21    HA   THR   5           HA       THR   5   4.725  -8.864 -12.133
   22    HB   THR   5           HB       THR   5   6.156  -7.242 -14.252
   23    HG1  THR   5           1HG      THR   5   5.198  -9.869 -14.126
   24   HG21  THR   5          3HG2      THR   5   8.097  -8.618 -13.600
   25   HG22  THR   5          1HG2      THR   5   7.116  -9.425 -12.378
   26   HG23  THR   5          2HG2      THR   5   7.482  -7.708 -12.220
   27    H    PHE   6           H        PHE   6   4.663  -7.814 -10.253
   28    HA   PHE   6           HA       PHE   6   5.115  -4.932 -10.248
   29    HB2  PHE   6           2HB      PHE   6   3.078  -5.865  -9.070
   30    HB3  PHE   6           1HB      PHE   6   4.169  -6.702  -7.973
   31    HD1  PHE   6           1HD      PHE   6   2.944  -3.413  -9.065
   32    HD2  PHE   6           2HD      PHE   6   5.276  -5.522  -6.193
   33    HE1  PHE   6           1HE      PHE   6   3.023  -1.405  -7.660
   34    HE2  PHE   6           2HE      PHE   6   5.359  -3.520  -4.787
   35    HZ   PHE   6           HZ       PHE   6   4.229  -1.451  -5.515
   36    H    THR   7           H        THR   7   7.022  -4.225  -9.479
   37    HA   THR   7           HA       THR   7   8.954  -6.263  -8.759
   38    HB   THR   7           HB       THR   7   9.412  -3.298  -9.144
   39    HG1  THR   7           1HG      THR   7   8.455  -4.569 -10.978
   40   HG21  THR   7          3HG2      THR   7  11.724  -3.995  -9.611
   41   HG22  THR   7          1HG2      THR   7  11.272  -5.679  -9.342
   42   HG23  THR   7          2HG2      THR   7  11.224  -4.529  -8.006
   43    H    SER   8           H        SER   8   9.349  -6.704  -6.711
   44    HA   SER   8           HA       SER   8   8.221  -5.332  -4.552
   45    HB2  SER   8           2HB      SER   8  10.551  -7.252  -4.567
   46    HB3  SER   8           1HB      SER   8   9.529  -6.852  -3.189
   47    HG   SER   8           HG       SER   8   8.974  -8.417  -5.446
   48    H    ASP   9           H        ASP   9   9.040  -3.830  -3.204
   49    HA   ASP   9           HA       ASP   9  10.381  -2.265  -2.238
   50    HB2  ASP   9           2HB      ASP   9  11.861  -4.188  -1.881
   51    HB3  ASP   9           1HB      ASP   9  12.615  -3.946  -3.437
   52    H    LEU  10           H        LEU  10   9.387  -2.077  -4.924
   53    HA   LEU  10           HA       LEU  10  11.217  -0.599  -6.608
   54    HB2  LEU  10           2HB      LEU  10   9.170  -1.935  -7.344
   55    HB3  LEU  10           1HB      LEU  10   8.189  -0.655  -6.697
   56    HG   LEU  10           HG       LEU  10  10.076  -0.375  -9.061
   57   HD11  LEU  10          1HD1      LEU  10   8.245  -1.832  -9.627
   58   HD12  LEU  10          2HD1      LEU  10   7.961  -0.251 -10.359
   59   HD13  LEU  10          3HD1      LEU  10   7.097  -0.714  -8.903
   60   HD21  LEU  10          3HD2      LEU  10   8.907   1.740  -9.491
   61   HD22  LEU  10          1HD2      LEU  10   9.692   1.773  -7.912
   62   HD23  LEU  10          2HD2      LEU  10   7.953   1.515  -8.023
   63    H    SER  11           H        SER  11   8.467   0.221  -4.519
   64    HA   SER  11           HA       SER  11   9.352   3.008  -4.514
   65    HB2  SER  11           2HB      SER  11   7.046   3.385  -3.547
   66    HB3  SER  11           1HB      SER  11   7.065   2.775  -5.203
   67    HG   SER  11           HG       SER  11   5.626   1.742  -3.580
   68    H    LYS  12           H        LYS  12   9.217   0.140  -2.805
   69    HA   LYS  12           HA       LYS  12  10.081  -0.602  -0.877
   70    HB2  LYS  12           2HB      LYS  12  11.746   1.221  -1.555
   71    HB3  LYS  12           1HB      LYS  12  11.021   2.178  -0.274
   72    HG2  LYS  12           2HG      LYS  12  11.644   0.446   1.335
   73    HG3  LYS  12           1HG      LYS  12  12.388  -0.477   0.024
   74    HD2  LYS  12           2HD      LYS  12  13.705   1.583  -0.485
   75    HD3  LYS  12           1HD      LYS  12  13.164   2.209   1.075
   76    HE2  LYS  12           2HE      LYS  12  15.321   1.175   1.409
   77    HE3  LYS  12           1HE      LYS  12  14.095   0.142   2.144
   78    HZ1  LYS  12           3HZ      LYS  12  15.622  -1.205   0.906
   79    HZ2  LYS  12           1HZ      LYS  12  15.421  -0.274  -0.478
   80    HZ3  LYS  12           2HZ      LYS  12  14.154  -1.226   0.067
   81    H    GLN  13           H        GLN  13   7.500   1.050  -1.134
   82    HA   GLN  13           HA       GLN  13   6.758   0.856   1.677
   83    HB2  GLN  13           2HB      GLN  13   6.204   3.272  -0.060
   84    HB3  GLN  13           1HB      GLN  13   5.466   2.986   1.504
   85    HG2  GLN  13           2HG      GLN  13   7.697   3.120   2.552
   86    HG3  GLN  13           1HG      GLN  13   8.397   3.447   0.970
   87   HE21  GLN  13          1HE2      GLN  13   6.171   5.151   0.115
   88   HE22  GLN  13          2HE2      GLN  13   6.336   6.610   1.017
   89    H    MET  14           H        MET  14   4.751   0.032   1.915
   90    HA   MET  14           HA       MET  14   3.324  -0.938  -0.374
   91    HB2  MET  14           2HB      MET  14   3.304  -2.163   1.761
   92    HB3  MET  14           1HB      MET  14   2.535  -0.799   2.548
   93    HG2  MET  14           2HG      MET  14   0.536  -1.116   1.212
   94    HG3  MET  14           1HG      MET  14   1.303  -2.443   0.345
   95    HE1  MET  14           3HE      MET  14  -1.540  -2.715   1.720
   96    HE2  MET  14           1HE      MET  14  -1.387  -4.292   2.494
   97    HE3  MET  14           2HE      MET  14  -0.734  -4.035   0.876
   98    H    GLU  15           H        GLU  15   3.332   1.842   1.510
   99    HA   GLU  15           HA       GLU  15   0.789   2.947   1.118
  100    HB2  GLU  15           2HB      GLU  15   3.466   4.303   1.397
  101    HB3  GLU  15           1HB      GLU  15   1.900   5.058   1.625
  102    HG2  GLU  15           2HG      GLU  15   2.933   2.780   3.281
  103    HG3  GLU  15           1HG      GLU  15   3.087   4.483   3.715
  104    H    GLU  16           H        GLU  16  -0.048   3.523  -0.804
  105    HA   GLU  16           HA       GLU  16   1.752   4.884  -2.662
  106    HB2  GLU  16           2HB      GLU  16   0.345   4.189  -4.559
  107    HB3  GLU  16           1HB      GLU  16   1.039   2.813  -3.729
  108    HG2  GLU  16           2HG      GLU  16  -1.091   2.392  -2.645
  109    HG3  GLU  16           1HG      GLU  16  -1.785   3.800  -3.457
  110    H    GLU  17           H        GLU  17  -1.456   4.763  -1.215
  111    HA   GLU  17           HA       GLU  17  -2.042   7.276  -2.279
  112    HB2  GLU  17           2HB      GLU  17  -4.115   7.041  -0.887
  113    HB3  GLU  17           1HB      GLU  17  -3.898   5.767  -2.073
  114    HG2  GLU  17           2HG      GLU  17  -3.055   4.299  -0.298
  115    HG3  GLU  17           1HG      GLU  17  -3.373   5.571   0.884
  116    H    ALA  18           H        ALA  18  -1.926   8.850  -1.347
  117    HA   ALA  18           HA       ALA  18  -1.284  10.664  -0.083
  118    HB1  ALA  18           1HB      ALA  18  -1.101  10.525   2.347
  119    HB2  ALA  18           2HB      ALA  18  -1.153   8.761   2.253
  120    HB3  ALA  18           3HB      ALA  18  -2.558   9.713   1.761
  121    H    VAL  19           H        VAL  19   0.738   8.251  -0.964
  122    HA   VAL  19           HA       VAL  19   2.946   9.940  -0.119
  123    HB   VAL  19           HB       VAL  19   3.337   7.532   0.390
  124   HG11  VAL  19          1HG1      VAL  19   2.041   6.599  -1.435
  125   HG12  VAL  19          2HG1      VAL  19   3.666   5.927  -1.361
  126   HG13  VAL  19          3HG1      VAL  19   3.264   7.144  -2.582
  127   HG21  VAL  19          3HG2      VAL  19   5.210   8.995  -0.065
  128   HG22  VAL  19          1HG2      VAL  19   5.096   8.599  -1.778
  129   HG23  VAL  19          2HG2      VAL  19   5.541   7.342  -0.611
  130    H    ARG  20           H        ARG  20   1.266   8.576  -2.848
  131    HA   ARG  20           HA       ARG  20   2.709   9.758  -4.916
  132    HB2  ARG  20           2HB      ARG  20  -0.063   8.783  -4.539
  133    HB3  ARG  20           1HB      ARG  20   0.231   9.695  -5.992
  134    HG2  ARG  20           2HG      ARG  20   1.686   7.191  -5.128
  135    HG3  ARG  20           1HG      ARG  20   0.387   7.255  -6.315
  136    HD2  ARG  20           2HD      ARG  20   1.797   8.747  -7.717
  137    HD3  ARG  20           1HD      ARG  20   3.100   8.579  -6.544
  138    HE   ARG  20           HE       ARG  20   2.345   6.030  -7.270
  139   HH11  ARG  20          1HH1      ARG  20   3.772   8.835  -8.908
  140   HH12  ARG  20          2HH1      ARG  20   4.639   7.879 -10.032
  141   HH21  ARG  20          1HH2      ARG  20   3.527   4.757  -8.842
  142   HH22  ARG  20          2HH2      ARG  20   4.505   5.527  -9.985
  143    H    CYS  21           H        CYS  21   0.693  11.084  -2.598
  144    HA   CYS  21           HA       CYS  21   0.308  13.624  -4.011
  145    HB2  CYS  21           2HB      CYS  21  -1.685  12.894  -2.877
  146    HB3  CYS  21           1HB      CYS  21  -0.793  12.522  -1.415
  147    H    PHE  22           H        PHE  22   1.885  12.116  -1.312
  148    HA   PHE  22           HA       PHE  22   2.777  14.225   0.208
  149    HB2  PHE  22           2HB      PHE  22   2.734  11.770   0.680
  150    HB3  PHE  22           1HB      PHE  22   4.166  11.617  -0.324
  151    HD1  PHE  22           2HD      PHE  22   6.275  12.755   0.459
  152    HD2  PHE  22           1HD      PHE  22   2.810  12.338   2.846
  153    HE1  PHE  22           2HE      PHE  22   7.644  13.114   2.460
  154    HE2  PHE  22           1HE      PHE  22   4.121  12.679   4.868
  155    HZ   PHE  22           HZ       PHE  22   6.568  13.078   4.702
  156    H    ILE  23           H        ILE  23   4.602  12.336  -2.207
  157    HA   ILE  23           HA       ILE  23   6.944  13.887  -2.053
  158    HB   ILE  23           HB       ILE  23   6.055  12.174  -4.400
  159   HG12  ILE  23          2HG1      ILE  23   5.996  10.888  -2.285
  160   HG13  ILE  23          1HG1      ILE  23   7.267  10.321  -3.357
  161   HG21  ILE  23          1HG2      ILE  23   8.809  12.993  -3.485
  162   HG22  ILE  23          2HG2      ILE  23   7.964  13.637  -4.888
  163   HG23  ILE  23          3HG2      ILE  23   8.457  11.939  -4.857
  164   HD11  ILE  23          3HD1      ILE  23   7.644  12.097  -0.949
  165   HD12  ILE  23          1HD1      ILE  23   8.922  11.527  -2.021
  166   HD13  ILE  23          2HD1      ILE  23   8.012  10.374  -1.047
  167    H    GLU  24           H        GLU  24   4.114  14.147  -4.075
  168    HA   GLU  24           HA       GLU  24   5.261  16.072  -5.871
  169    HB2  GLU  24           2HB      GLU  24   2.338  15.524  -5.432
  170    HB3  GLU  24           1HB      GLU  24   3.103  16.206  -6.861
  171    HG2  GLU  24           2HG      GLU  24   3.286  13.433  -5.814
  172    HG3  GLU  24           1HG      GLU  24   2.418  13.952  -7.249
  173    H    CYS  25           H        CYS  25   3.101  16.134  -3.098
  174    HA   CYS  25           HA       CYS  25   2.607  18.946  -3.164
  175    HB2  CYS  25           2HB      CYS  25   1.099  17.414  -1.966
  176    HB3  CYS  25           1HB      CYS  25   2.379  17.051  -0.814
  177    H    LEU  26           H        LEU  26   5.073  16.964  -1.767
  178    HA   LEU  26           HA       LEU  26   6.369  18.759  -0.106
  179    HB2  LEU  26           2HB      LEU  26   6.888  16.355  -0.356
  180    HB3  LEU  26           1HB      LEU  26   7.534  16.669  -1.948
  181    HG   LEU  26           HG       LEU  26   9.340  18.011  -0.926
  182   HD11  LEU  26          1HD1      LEU  26   8.167  17.040   1.677
  183   HD12  LEU  26          2HD1      LEU  26   8.168  18.707   1.103
  184   HD13  LEU  26          3HD1      LEU  26   9.691  17.908   1.484
  185   HD21  LEU  26          3HD2      LEU  26   9.035  15.205   0.131
  186   HD22  LEU  26          1HD2      LEU  26  10.547  16.106   0.027
  187   HD23  LEU  26          2HD2      LEU  26   9.683  15.663  -1.444
  188    H    LYS  27           H        LYS  27   6.263  18.469  -3.559
  189    HA   LYS  27           HA       LYS  27   8.234  20.539  -4.065
  190    HB2  LYS  27           2HB      LYS  27   6.231  19.319  -5.990
  191    HB3  LYS  27           1HB      LYS  27   7.694  20.185  -6.411
  192    HG2  LYS  27           2HG      LYS  27   7.539  17.472  -5.108
  193    HG3  LYS  27           1HG      LYS  27   7.943  17.804  -6.791
  194    HD2  LYS  27           2HD      LYS  27   9.939  19.034  -6.047
  195    HD3  LYS  27           1HD      LYS  27   9.523  18.672  -4.374
  196    HE2  LYS  27           2HE      LYS  27  11.222  17.126  -5.197
  197    HE3  LYS  27           1HE      LYS  27   9.724  16.281  -4.819
  198    HZ1  LYS  27           3HZ      LYS  27  10.737  15.560  -6.909
  199    HZ2  LYS  27           1HZ      LYS  27  10.568  17.097  -7.556
  200    HZ3  LYS  27           2HZ      LYS  27   9.200  16.176  -7.172
  201    H    GLY  28           H        GLY  28   4.774  20.030  -4.704
  202    HA2  GLY  28           2HA      GLY  28   3.435  21.911  -3.512
  203    HA3  GLY  28           1HA      GLY  28   4.259  22.925  -4.678
  204    H    ILE  29           H        ILE  29   1.664  20.734  -4.164
  205    HA   ILE  29           HA       ILE  29   0.705  21.407  -6.693
  206    HB   ILE  29           HB       ILE  29  -0.145  19.106  -7.180
  207   HG12  ILE  29          2HG1      ILE  29   1.301  17.180  -6.233
  208   HG13  ILE  29          1HG1      ILE  29   1.673  18.281  -4.918
  209   HG21  ILE  29          1HG2      ILE  29   1.924  18.196  -8.121
  210   HG22  ILE  29          2HG2      ILE  29   2.809  19.406  -7.176
  211   HG23  ILE  29          3HG2      ILE  29   1.686  19.923  -8.432
  212   HD11  ILE  29          3HD1      ILE  29  -0.093  16.842  -4.214
  213   HD12  ILE  29          1HD1      ILE  29  -1.011  17.177  -5.697
  214   HD13  ILE  29          2HD1      ILE  29  -0.765  18.456  -4.528
  215    H    GLY  30           H        GLY  30  -0.986  22.091  -6.409
  216    HA2  GLY  30           2HA      GLY  30  -2.537  21.934  -3.982
  217    HA3  GLY  30           1HA      GLY  30  -3.052  22.781  -5.438
  218    H    HIS  31           H        HIS  31  -3.036  19.797  -3.715
  219    HA   HIS  31           HA       HIS  31  -4.122  17.815  -3.860
  220    HB2  HIS  31           2HB      HIS  31  -6.247  19.748  -4.639
  221    HB3  HIS  31           1HB      HIS  31  -6.614  18.072  -4.184
  222    HD1  HIS  31           1HD      HIS  31  -6.791  17.663  -1.624
  223    HD2  HIS  31           2HD      HIS  31  -5.333  21.424  -2.606
  224    HE1  HIS  31           1HE      HIS  31  -6.830  19.014   0.514
  225    H    LYS  32           H        LYS  32  -2.948  16.889  -5.566
  226    HA   LYS  32           HA       LYS  32  -4.012  17.219  -8.278
  227    HB2  LYS  32           2HB      LYS  32  -1.551  17.474  -7.701
  228    HB3  LYS  32           1HB      LYS  32  -1.512  15.736  -7.453
  229    HG2  LYS  32           2HG      LYS  32  -0.651  16.215  -9.624
  230    HG3  LYS  32           1HG      LYS  32  -2.242  15.474  -9.831
  231    HD2  LYS  32           2HD      LYS  32  -3.226  17.725 -10.080
  232    HD3  LYS  32           1HD      LYS  32  -1.615  18.416  -9.924
  233    HE2  LYS  32           2HE      LYS  32  -0.915  17.218 -11.934
  234    HE3  LYS  32           1HE      LYS  32  -2.534  16.536 -12.086
  235    HZ1  LYS  32           3HZ      LYS  32  -1.843  19.410 -12.176
  236    HZ2  LYS  32           1HZ      LYS  32  -3.403  18.790 -12.326
  237    HZ3  LYS  32           2HZ      LYS  32  -2.244  18.464 -13.505
  238    H    TYR  33           H        TYR  33  -4.716  15.203  -5.816
  239    HA   TYR  33           HA       TYR  33  -5.399  12.960  -7.565
  240    HB2  TYR  33           2HB      TYR  33  -3.971  12.506  -4.913
  241    HB3  TYR  33           1HB      TYR  33  -4.544  11.298  -6.012
  242    HD1  TYR  33           1HD      TYR  33  -2.008  13.965  -5.626
  243    HD2  TYR  33           2HD      TYR  33  -3.209  10.503  -7.775
  244    HE1  TYR  33           1HE      TYR  33   0.183  13.874  -6.689
  245    HE2  TYR  33           2HE      TYR  33  -1.021  10.408  -8.841
  246    HH   TYR  33           HH       TYR  33   1.612  12.202  -7.733
  247    HA   PRO  34           HA       PRO  34  -9.198  12.966  -5.198
  248    HB2  PRO  34           2HB      PRO  34  -9.371  10.191  -4.745
  249    HB3  PRO  34           1HB      PRO  34 -10.014  11.037  -6.150
  250    HG2  PRO  34           2HG      PRO  34  -7.450   9.565  -5.851
  251    HG3  PRO  34           1HG      PRO  34  -8.553   9.654  -7.237
  252    HD2  PRO  34           2HD      PRO  34  -6.285  11.014  -7.230
  253    HD3  PRO  34           1HD      PRO  34  -7.767  11.751  -7.874
  254    H    PHE  35           H        PHE  35  -6.677  10.816  -4.042
  255    HA   PHE  35           HA       PHE  35  -7.517  10.996  -1.266
  256    HB2  PHE  35           2HB      PHE  35  -5.599   9.346  -0.966
  257    HB3  PHE  35           1HB      PHE  35  -6.958   8.819  -1.957
  258    HD1  PHE  35           2HD      PHE  35  -3.479   9.991  -2.044
  259    HD2  PHE  35           1HD      PHE  35  -6.714   8.368  -4.250
  260    HE1  PHE  35           2HE      PHE  35  -1.963   9.548  -3.936
  261    HE2  PHE  35           1HE      PHE  35  -5.282   7.940  -6.121
  262    HZ   PHE  35           HZ       PHE  35  -2.854   8.507  -6.001
  263    H    CYS  36           H        CYS  36  -6.138  13.166  -2.907
  264    HA   CYS  36           HA       CYS  36  -3.761  13.535  -1.256
  265    HB2  CYS  36           2HB      CYS  36  -3.417  13.700  -3.645
  266    HB3  CYS  36           1HB      CYS  36  -4.627  14.975  -3.781
  267    H    HIS  37           H        HIS  37  -4.055  14.711   0.505
  268    HA   HIS  37           HA       HIS  37  -6.005  16.894   0.408
  269    HB2  HIS  37           2HB      HIS  37  -5.481  14.985   2.695
  270    HB3  HIS  37           1HB      HIS  37  -6.426  16.461   2.845
  271    HD1  HIS  37           1HD      HIS  37  -8.778  16.486   1.619
  272    HD2  HIS  37           2HD      HIS  37  -6.764  12.846   1.538
  273    HE1  HIS  37           1HE      HIS  37 -10.456  14.802   0.879
  274    H    CYS  38           H        CYS  38  -2.978  16.533   0.177
  275    HA   CYS  38           HA       CYS  38  -1.928  17.940   2.420
  276    HB2  CYS  38           2HB      CYS  38  -0.551  16.375   1.068
  277    HB3  CYS  38           1HB      CYS  38  -0.722  17.451  -0.306
  278    H    ARG  39           H        ARG  39  -2.174  20.007   2.743
  279    HA   ARG  39           HA       ARG  39  -2.891  21.752   0.500
  280    HB2  ARG  39           2HB      ARG  39  -3.301  22.129   3.462
  281    HB3  ARG  39           1HB      ARG  39  -3.742  23.287   2.210
  282    HG2  ARG  39           2HG      ARG  39  -5.331  21.721   1.271
  283    HG3  ARG  39           1HG      ARG  39  -4.851  20.501   2.448
  284    HD2  ARG  39           2HD      ARG  39  -6.064  23.172   3.127
  285    HD3  ARG  39           1HD      ARG  39  -6.959  21.655   3.041
  286    HE   ARG  39           HE       ARG  39  -4.748  21.412   4.788
  287   HH11  ARG  39          1HH1      ARG  39  -7.949  22.926   4.669
  288   HH12  ARG  39          2HH1      ARG  39  -8.197  22.796   6.353
  289   HH21  ARG  39          1HH2      ARG  39  -5.127  21.227   7.057
  290   HH22  ARG  39          2HH2      ARG  39  -6.580  21.838   7.729
  Start of MODEL   16
    1    H1   HIS   1           H        HIS   1  11.950   2.084  17.161
    2    HA   HIS   1           HA       HIS   1  11.070   2.651  19.685
    3    HB2  HIS   1           2HB      HIS   1  14.057   2.145  19.483
    4    HB3  HIS   1           1HB      HIS   1  13.277   2.986  20.811
    5    HD1  HIS   1           1HD      HIS   1  12.112   1.510  22.615
    6    HD2  HIS   1           2HD      HIS   1  13.685  -0.618  19.409
    7    HE1  HIS   1           1HE      HIS   1  12.021  -0.907  23.276
    8    H    GLY   2           H        GLY   2  12.152   4.825  20.320
    9    HA2  GLY   2           2HA      GLY   2  13.463   6.660  19.430
   10    HA3  GLY   2           1HA      GLY   2  12.771   6.285  17.851
   11    H    GLU   3           H        GLU   3  12.253   8.624  18.114
   12    HA   GLU   3           HA       GLU   3  10.063   9.193  19.877
   13    HB2  GLU   3           2HB      GLU   3  11.326  10.901  17.711
   14    HB3  GLU   3           1HB      GLU   3  10.048  11.444  18.780
   15    HG2  GLU   3           2HG      GLU   3  12.031  12.343  19.664
   16    HG3  GLU   3           1HG      GLU   3  11.633  10.987  20.703
   17    H    GLY   4           H        GLY   4  10.542   9.133  16.371
   18    HA2  GLY   4           2HA      GLY   4   7.686   8.977  15.951
   19    HA3  GLY   4           1HA      GLY   4   8.923   9.035  14.697
   20    H    THR   5           H        THR   5   7.120   7.022  16.841
   21    HA   THR   5           HA       THR   5   8.556   4.671  15.996
   22    HB   THR   5           HB       THR   5   6.748   3.712  17.676
   23    HG1  THR   5           1HG      THR   5   7.067   5.956  19.130
   24   HG21  THR   5          3HG2      THR   5   8.394   4.053  19.477
   25   HG22  THR   5          1HG2      THR   5   9.196   5.287  18.507
   26   HG23  THR   5          2HG2      THR   5   9.188   3.609  17.968
   27    H    PHE   6           H        PHE   6   7.928   3.881  14.105
   28    HA   PHE   6           HA       PHE   6   5.111   3.772  13.460
   29    HB2  PHE   6           2HB      PHE   6   6.800   4.279  11.656
   30    HB3  PHE   6           1HB      PHE   6   7.495   2.681  11.911
   31    HD1  PHE   6           2HD      PHE   6   6.293   0.670  11.208
   32    HD2  PHE   6           1HD      PHE   6   4.692   4.551  10.547
   33    HE1  PHE   6           2HE      PHE   6   4.654  -0.274   9.670
   34    HE2  PHE   6           1HE      PHE   6   3.042   3.613   9.002
   35    HZ   PHE   6           HZ       PHE   6   3.013   1.196   8.557
   36    H    THR   7           H        THR   7   3.959   1.956  13.872
   37    HA   THR   7           HA       THR   7   5.490  -0.184  15.097
   38    HB   THR   7           HB       THR   7   3.871   0.801  16.587
   39    HG1  THR   7           1HG      THR   7   3.770  -1.111  17.265
   40   HG21  THR   7          3HG2      THR   7   2.254   1.653  14.983
   41   HG22  THR   7          1HG2      THR   7   1.447   0.632  16.171
   42   HG23  THR   7          2HG2      THR   7   1.782   0.012  14.551
   43    H    SER   8           H        SER   8   5.317  -2.241  14.517
   44    HA   SER   8           HA       SER   8   4.766  -2.751  11.792
   45    HB2  SER   8           2HB      SER   8   5.460  -4.706  13.981
   46    HB3  SER   8           1HB      SER   8   5.718  -4.901  12.247
   47    HG   SER   8           HG       SER   8   7.135  -3.146  12.314
   48    H    ASP   9           H        ASP   9   2.588  -2.528  11.448
   49    HA   ASP   9           HA       ASP   9   0.558  -3.245  10.958
   50    HB2  ASP   9           2HB      ASP   9   1.647  -5.833  11.950
   51    HB3  ASP   9           1HB      ASP   9  -0.037  -5.703  11.435
   52    H    LEU  10           H        LEU  10   1.413  -2.781  14.015
   53    HA   LEU  10           HA       LEU  10  -0.952  -3.629  15.367
   54    HB2  LEU  10           2HB      LEU  10   1.274  -3.074  16.410
   55    HB3  LEU  10           1HB      LEU  10   0.937  -1.401  16.115
   56    HG   LEU  10           HG       LEU  10  -0.784  -3.107  17.949
   57   HD11  LEU  10          1HD1      LEU  10   1.501  -3.083  18.785
   58   HD12  LEU  10          2HD1      LEU  10   0.453  -2.097  19.803
   59   HD13  LEU  10          3HD1      LEU  10   1.543  -1.325  18.651
   60   HD21  LEU  10          3HD2      LEU  10  -0.439  -0.107  17.744
   61   HD22  LEU  10          1HD2      LEU  10  -1.482  -0.954  18.887
   62   HD23  LEU  10          2HD2      LEU  10  -1.833  -1.015  17.160
   63    H    SER  11           H        SER  11   0.089  -0.606  13.898
   64    HA   SER  11           HA       SER  11  -2.516   0.590  14.314
   65    HB2  SER  11           2HB      SER  11  -0.456   1.960  14.524
   66    HB3  SER  11           1HB      SER  11  -0.072   1.623  12.840
   67    HG   SER  11           HG       SER  11  -2.514   2.560  12.832
   68    H    LYS  12           H        LYS  12  -0.935  -1.385  12.174
   69    HA   LYS  12           HA       LYS  12  -1.044  -1.962  10.077
   70    HB2  LYS  12           2HB      LYS  12  -3.287  -2.896   9.393
   71    HB3  LYS  12           1HB      LYS  12  -2.549  -3.512  10.859
   72    HG2  LYS  12           2HG      LYS  12  -4.037  -1.981  12.141
   73    HG3  LYS  12           1HG      LYS  12  -4.859  -1.611  10.617
   74    HD2  LYS  12           2HD      LYS  12  -5.312  -3.919  10.271
   75    HD3  LYS  12           1HD      LYS  12  -4.441  -4.333  11.751
   76    HE2  LYS  12           2HE      LYS  12  -6.833  -4.375  12.214
   77    HE3  LYS  12           1HE      LYS  12  -6.091  -3.020  13.052
   78    HZ1  LYS  12           3HZ      LYS  12  -8.202  -2.495  11.959
   79    HZ2  LYS  12           1HZ      LYS  12  -7.523  -2.816  10.467
   80    HZ3  LYS  12           2HZ      LYS  12  -6.951  -1.518  11.381
   81    H    GLN  13           H        GLN  13  -0.431   0.091   9.705
   82    HA   GLN  13           HA       GLN  13  -2.140   1.635   7.951
   83    HB2  GLN  13           2HB      GLN  13   0.701   2.023   8.862
   84    HB3  GLN  13           1HB      GLN  13  -0.013   3.005   7.597
   85    HG2  GLN  13           2HG      GLN  13  -1.737   3.750   9.183
   86    HG3  GLN  13           1HG      GLN  13  -0.956   2.797  10.447
   87   HE21  GLN  13          1HE2      GLN  13   0.957   3.529  11.334
   88   HE22  GLN  13          2HE2      GLN  13   1.568   5.104  11.054
   89    H    MET  14           H        MET  14  -2.145   1.542   5.867
   90    HA   MET  14           HA       MET  14   0.017   0.223   4.429
   91    HB2  MET  14           2HB      MET  14  -2.949  -0.143   3.925
   92    HB3  MET  14           1HB      MET  14  -1.682  -0.670   2.838
   93    HG2  MET  14           2HG      MET  14  -0.887  -2.234   4.528
   94    HG3  MET  14           1HG      MET  14  -2.160  -1.690   5.625
   95    HE1  MET  14           3HE      MET  14  -2.961  -4.213   5.904
   96    HE2  MET  14           1HE      MET  14  -1.703  -4.746   4.788
   97    HE3  MET  14           2HE      MET  14  -3.374  -5.263   4.547
   98    H    GLU  15           H        GLU  15   0.831   2.046   3.627
   99    HA   GLU  15           HA       GLU  15  -0.952   4.083   2.630
  100    HB2  GLU  15           2HB      GLU  15   2.064   3.957   2.831
  101    HB3  GLU  15           1HB      GLU  15   1.190   5.331   2.165
  102    HG2  GLU  15           2HG      GLU  15   0.154   5.769   4.294
  103    HG3  GLU  15           1HG      GLU  15   0.832   4.298   4.978
  104    H    GLU  16           H        GLU  16  -1.923   3.015   0.919
  105    HA   GLU  16           HA       GLU  16  -0.305   2.047  -1.299
  106    HB2  GLU  16           2HB      GLU  16  -2.405   1.542  -2.430
  107    HB3  GLU  16           1HB      GLU  16  -2.552   1.026  -0.762
  108    HG2  GLU  16           2HG      GLU  16  -3.854   2.999  -0.234
  109    HG3  GLU  16           1HG      GLU  16  -3.646   3.599  -1.873
  110    H    GLU  17           H        GLU  17  -1.829   4.885  -0.216
  111    HA   GLU  17           HA       GLU  17  -0.911   6.349  -2.490
  112    HB2  GLU  17           2HB      GLU  17  -2.871   7.873  -1.964
  113    HB3  GLU  17           1HB      GLU  17  -3.230   6.305  -2.663
  114    HG2  GLU  17           2HG      GLU  17  -4.899   6.859  -1.033
  115    HG3  GLU  17           1HG      GLU  17  -3.956   5.486  -0.485
  116    H    ALA  18           H        ALA  18  -1.532   8.729  -1.065
  117    HA   ALA  18           HA       ALA  18  -0.500  10.281   0.210
  118    HB1  ALA  18           1HB      ALA  18  -1.454   8.971   2.073
  119    HB2  ALA  18           2HB      ALA  18   0.065   9.758   2.513
  120    HB3  ALA  18           3HB      ALA  18   0.040   8.034   2.154
  121    H    VAL  19           H        VAL  19   1.268   8.033  -1.330
  122    HA   VAL  19           HA       VAL  19   3.754   9.429  -0.641
  123    HB   VAL  19           HB       VAL  19   3.429   6.983  -2.429
  124   HG11  VAL  19          1HG1      VAL  19   5.400   8.268  -2.878
  125   HG12  VAL  19          2HG1      VAL  19   5.803   6.710  -2.147
  126   HG13  VAL  19          3HG1      VAL  19   5.864   8.188  -1.176
  127   HG21  VAL  19          3HG2      VAL  19   4.288   5.655  -0.550
  128   HG22  VAL  19          1HG2      VAL  19   2.740   6.407  -0.163
  129   HG23  VAL  19          2HG2      VAL  19   4.235   7.090   0.473
  130    H    ARG  20           H        ARG  20   1.700   8.343  -3.242
  131    HA   ARG  20           HA       ARG  20   2.554   9.942  -5.365
  132    HB2  ARG  20           2HB      ARG  20  -0.061   8.697  -4.605
  133    HB3  ARG  20           1HB      ARG  20   0.013   9.701  -6.023
  134    HG2  ARG  20           2HG      ARG  20   1.758   7.259  -5.631
  135    HG3  ARG  20           1HG      ARG  20   0.149   7.237  -6.368
  136    HD2  ARG  20           2HD      ARG  20   1.908   7.275  -8.051
  137    HD3  ARG  20           1HD      ARG  20   0.882   8.698  -8.123
  138    HE   ARG  20           HE       ARG  20   3.527   8.722  -6.838
  139   HH11  ARG  20          1HH1      ARG  20   1.271  10.014  -9.225
  140   HH12  ARG  20          2HH1      ARG  20   2.131  11.455  -9.464
  141   HH21  ARG  20          1HH2      ARG  20   4.783  10.674  -7.261
  142   HH22  ARG  20          2HH2      ARG  20   4.148  11.846  -8.323
  143    H    CYS  21           H        CYS  21   1.063  10.813  -2.470
  144    HA   CYS  21           HA       CYS  21   0.216  13.412  -3.546
  145    HB2  CYS  21           2HB      CYS  21  -1.553  12.346  -2.311
  146    HB3  CYS  21           1HB      CYS  21  -0.469  11.978  -0.983
  147    H    PHE  22           H        PHE  22   2.531  11.816  -1.556
  148    HA   PHE  22           HA       PHE  22   3.060  13.863   0.298
  149    HB2  PHE  22           2HB      PHE  22   3.469  11.417   0.566
  150    HB3  PHE  22           1HB      PHE  22   4.833  11.568  -0.520
  151    HD1  PHE  22           2HD      PHE  22   3.487  12.279   2.743
  152    HD2  PHE  22           1HD      PHE  22   6.884  12.656   0.231
  153    HE1  PHE  22           2HE      PHE  22   4.854  12.819   4.704
  154    HE2  PHE  22           1HE      PHE  22   8.277  13.195   2.168
  155    HZ   PHE  22           HZ       PHE  22   7.274  13.284   4.424
  156    H    ILE  23           H        ILE  23   5.170  12.600  -2.280
  157    HA   ILE  23           HA       ILE  23   7.045  14.687  -2.017
  158    HB   ILE  23           HB       ILE  23   6.629  12.804  -4.380
  159   HG12  ILE  23          2HG1      ILE  23   8.784  11.762  -3.419
  160   HG13  ILE  23          1HG1      ILE  23   8.383  12.677  -1.965
  161   HG21  ILE  23          1HG2      ILE  23   8.917  13.360  -5.042
  162   HG22  ILE  23          2HG2      ILE  23   8.998  14.531  -3.723
  163   HG23  ILE  23          3HG2      ILE  23   7.866  14.782  -5.055
  164   HD11  ILE  23          3HD1      ILE  23   6.643  10.568  -3.219
  165   HD12  ILE  23          1HD1      ILE  23   6.345  11.430  -1.712
  166   HD13  ILE  23          2HD1      ILE  23   7.710  10.322  -1.833
  167    H    GLU  24           H        GLU  24   4.276  14.283  -3.886
  168    HA   GLU  24           HA       GLU  24   4.611  16.407  -5.751
  169    HB2  GLU  24           2HB      GLU  24   1.957  15.371  -4.778
  170    HB3  GLU  24           1HB      GLU  24   2.360  16.061  -6.347
  171    HG2  GLU  24           2HG      GLU  24   3.340  13.459  -5.267
  172    HG3  GLU  24           1HG      GLU  24   2.050  13.650  -6.438
  173    H    CYS  25           H        CYS  25   2.860  16.177  -2.662
  174    HA   CYS  25           HA       CYS  25   2.071  18.878  -2.637
  175    HB2  CYS  25           2HB      CYS  25   0.947  17.257  -1.225
  176    HB3  CYS  25           1HB      CYS  25   2.384  16.945  -0.281
  177    H    LEU  26           H        LEU  26   4.972  17.244  -1.581
  178    HA   LEU  26           HA       LEU  26   6.188  19.504  -0.387
  179    HB2  LEU  26           2HB      LEU  26   7.193  16.857  -1.327
  180    HB3  LEU  26           1HB      LEU  26   8.364  18.121  -1.042
  181    HG   LEU  26           HG       LEU  26   8.204  16.624   0.872
  182   HD11  LEU  26          1HD1      LEU  26   8.778  18.931   1.264
  183   HD12  LEU  26          2HD1      LEU  26   7.889  18.244   2.620
  184   HD13  LEU  26          3HD1      LEU  26   7.076  19.335   1.500
  185   HD21  LEU  26          3HD2      LEU  26   6.203  16.535   2.280
  186   HD22  LEU  26          1HD2      LEU  26   5.880  15.899   0.668
  187   HD23  LEU  26          2HD2      LEU  26   5.331  17.518   1.102
  188    H    LYS  27           H        LYS  27   5.678  18.695  -3.666
  189    HA   LYS  27           HA       LYS  27   7.744  20.402  -4.750
  190    HB2  LYS  27           2HB      LYS  27   5.237  19.261  -5.987
  191    HB3  LYS  27           1HB      LYS  27   6.365  20.273  -6.861
  192    HG2  LYS  27           2HG      LYS  27   8.102  18.570  -6.552
  193    HG3  LYS  27           1HG      LYS  27   6.935  17.559  -5.689
  194    HD2  LYS  27           2HD      LYS  27   5.530  17.398  -7.621
  195    HD3  LYS  27           1HD      LYS  27   6.492  18.589  -8.485
  196    HE2  LYS  27           2HE      LYS  27   6.953  16.353  -9.279
  197    HE3  LYS  27           1HE      LYS  27   8.380  17.041  -8.513
  198    HZ1  LYS  27           3HZ      LYS  27   7.961  15.743  -6.579
  199    HZ2  LYS  27           1HZ      LYS  27   7.993  14.739  -7.924
  200    HZ3  LYS  27           2HZ      LYS  27   6.509  15.109  -7.233
  201    H    GLY  28           H        GLY  28   4.463  20.679  -3.758
  202    HA2  GLY  28           2HA      GLY  28   3.665  22.871  -3.018
  203    HA3  GLY  28           1HA      GLY  28   4.516  23.570  -4.386
  204    H    ILE  29           H        ILE  29   2.468  20.644  -4.431
  205    HA   ILE  29           HA       ILE  29   0.650  22.186  -5.937
  206    HB   ILE  29           HB       ILE  29   0.221  20.393  -7.511
  207   HG12  ILE  29          2HG1      ILE  29   2.004  18.426  -7.608
  208   HG13  ILE  29          1HG1      ILE  29   2.121  18.737  -5.881
  209   HG21  ILE  29          1HG2      ILE  29   1.884  21.892  -8.239
  210   HG22  ILE  29          2HG2      ILE  29   2.330  20.275  -8.787
  211   HG23  ILE  29          3HG2      ILE  29   3.147  20.994  -7.400
  212   HD11  ILE  29          3HD1      ILE  29   0.545  16.943  -6.270
  213   HD12  ILE  29          1HD1      ILE  29  -0.357  17.961  -7.402
  214   HD13  ILE  29          2HD1      ILE  29  -0.307  18.380  -5.697
  215    H    GLY  30           H        GLY  30  -0.868  22.276  -4.929
  216    HA2  GLY  30           2HA      GLY  30  -1.629  20.459  -2.795
  217    HA3  GLY  30           1HA      GLY  30  -2.462  21.960  -3.189
  218    H    HIS  31           H        HIS  31  -3.292  19.163  -2.681
  219    HA   HIS  31           HA       HIS  31  -4.998  17.812  -3.238
  220    HB2  HIS  31           2HB      HIS  31  -6.319  19.872  -3.452
  221    HB3  HIS  31           1HB      HIS  31  -5.781  20.075  -5.103
  222    HD1  HIS  31           1HD      HIS  31  -7.718  19.590  -6.643
  223    HD2  HIS  31           2HD      HIS  31  -7.682  17.101  -3.308
  224    HE1  HIS  31           1HE      HIS  31  -9.724  18.111  -6.868
  225    H    LYS  32           H        LYS  32  -5.042  18.846  -6.475
  226    HA   LYS  32           HA       LYS  32  -4.927  17.781  -8.410
  227    HB2  LYS  32           2HB      LYS  32  -2.611  18.320  -7.950
  228    HB3  LYS  32           1HB      LYS  32  -2.387  16.734  -7.231
  229    HG2  LYS  32           2HG      LYS  32  -1.526  16.809  -9.396
  230    HG3  LYS  32           1HG      LYS  32  -2.928  15.708  -9.357
  231    HD2  LYS  32           2HD      LYS  32  -4.301  17.552 -10.314
  232    HD3  LYS  32           1HD      LYS  32  -2.854  18.548 -10.427
  233    HE2  LYS  32           2HE      LYS  32  -3.353  17.564 -12.586
  234    HE3  LYS  32           1HE      LYS  32  -1.858  16.890 -11.940
  235    HZ1  LYS  32           3HZ      LYS  32  -3.062  14.896 -11.296
  236    HZ2  LYS  32           1HZ      LYS  32  -3.309  15.191 -12.920
  237    HZ3  LYS  32           2HZ      LYS  32  -4.516  15.535 -11.824
  238    H    TYR  33           H        TYR  33  -3.902  15.324  -6.112
  239    HA   TYR  33           HA       TYR  33  -5.001  13.189  -7.776
  240    HB2  TYR  33           2HB      TYR  33  -3.406  13.107  -5.203
  241    HB3  TYR  33           1HB      TYR  33  -3.867  11.703  -6.153
  242    HD1  TYR  33           1HD      TYR  33  -1.902  14.862  -6.322
  243    HD2  TYR  33           2HD      TYR  33  -2.481  10.959  -7.893
  244    HE1  TYR  33           1HE      TYR  33   0.086  15.143  -7.646
  245    HE2  TYR  33           2HE      TYR  33  -0.459  11.181  -9.218
  246    HH   TYR  33           HH       TYR  33   1.863  13.636  -8.782
  247    HA   PRO  34           HA       PRO  34  -8.925  12.734  -5.857
  248    HB2  PRO  34           2HB      PRO  34  -8.726   9.938  -5.403
  249    HB3  PRO  34           1HB      PRO  34  -9.459  10.727  -6.795
  250    HG2  PRO  34           2HG      PRO  34  -6.742   9.569  -6.492
  251    HG3  PRO  34           1HG      PRO  34  -7.768   9.682  -7.932
  252    HD2  PRO  34           2HD      PRO  34  -5.642  11.241  -7.628
  253    HD3  PRO  34           1HD      PRO  34  -7.136  11.874  -8.358
  254    H    PHE  35           H        PHE  35  -6.365  10.893  -4.373
  255    HA   PHE  35           HA       PHE  35  -7.624  10.897  -1.755
  256    HB2  PHE  35           2HB      PHE  35  -5.561   9.479  -1.230
  257    HB3  PHE  35           1HB      PHE  35  -6.750   8.815  -2.350
  258    HD1  PHE  35           1HD      PHE  35  -3.438  10.476  -2.165
  259    HD2  PHE  35           2HD      PHE  35  -6.204   8.322  -4.566
  260    HE1  PHE  35           1HE      PHE  35  -1.728  10.215  -3.903
  261    HE2  PHE  35           2HE      PHE  35  -4.537   8.056  -6.282
  262    HZ   PHE  35           HZ       PHE  35  -2.272   8.991  -5.982
  263    H    CYS  36           H        CYS  36  -5.815  13.114  -3.335
  264    HA   CYS  36           HA       CYS  36  -4.062  13.576  -1.057
  265    HB2  CYS  36           2HB      CYS  36  -2.988  13.362  -3.277
  266    HB3  CYS  36           1HB      CYS  36  -3.882  14.782  -3.814
  267    H    HIS  37           H        HIS  37  -4.591  15.023   0.292
  268    HA   HIS  37           HA       HIS  37  -6.219  17.287  -0.580
  269    HB2  HIS  37           2HB      HIS  37  -7.070  17.295   1.857
  270    HB3  HIS  37           1HB      HIS  37  -7.688  16.040   0.794
  271    HD1  HIS  37           1HD      HIS  37  -5.912  16.511   4.015
  272    HD2  HIS  37           2HD      HIS  37  -6.582  13.460   1.274
  273    HE1  HIS  37           1HE      HIS  37  -5.324  14.365   5.204
  274    H    CYS  38           H        CYS  38  -3.261  16.498   0.085
  275    HA   CYS  38           HA       CYS  38  -2.461  18.443   2.039
  276    HB2  CYS  38           2HB      CYS  38  -1.220  16.301   1.577
  277    HB3  CYS  38           1HB      CYS  38  -0.755  16.973   0.020
  278    H    ARG  39           H        ARG  39  -1.384  20.372   1.631
  279    HA   ARG  39           HA       ARG  39  -1.082  21.409  -1.020
  280    HB2  ARG  39           2HB      ARG  39  -2.615  23.348  -0.579
  281    HB3  ARG  39           1HB      ARG  39  -3.438  21.811  -0.820
  282    HG2  ARG  39           2HG      ARG  39  -3.729  21.555   1.559
  283    HG3  ARG  39           1HG      ARG  39  -2.839  23.045   1.854
  284    HD2  ARG  39           2HD      ARG  39  -4.537  24.307   0.689
  285    HD3  ARG  39           1HD      ARG  39  -5.407  22.819   0.307
  286    HE   ARG  39           HE       ARG  39  -5.122  22.795   3.004
  287   HH11  ARG  39          1HH1      ARG  39  -6.573  25.039   0.670
  288   HH12  ARG  39          2HH1      ARG  39  -7.765  25.605   1.744
  289   HH21  ARG  39          1HH2      ARG  39  -6.805  23.546   4.473
  290   HH22  ARG  39          2HH2      ARG  39  -7.909  24.718   3.929
  Start of MODEL   17
    1    H1   HIS   1           H        HIS   1   4.234 -18.887  -6.574
    2    HA   HIS   1           HA       HIS   1   5.090 -20.152  -4.199
    3    HB2  HIS   1           2HB      HIS   1   5.227 -22.078  -5.836
    4    HB3  HIS   1           1HB      HIS   1   6.380 -21.135  -6.763
    5    HD1  HIS   1           1HD      HIS   1   6.081 -23.239  -3.681
    6    HD2  HIS   1           2HD      HIS   1   8.960 -20.980  -5.662
    7    HE1  HIS   1           1HE      HIS   1   8.284 -23.851  -2.632
    8    H    GLY   2           H        GLY   2   6.626 -18.848  -3.358
    9    HA2  GLY   2           2HA      GLY   2   8.817 -17.741  -3.929
   10    HA3  GLY   2           1HA      GLY   2   7.906 -16.937  -5.205
   11    H    GLU   3           H        GLU   3   8.542 -14.929  -4.212
   12    HA   GLU   3           HA       GLU   3   7.491 -14.354  -1.585
   13    HB2  GLU   3           2HB      GLU   3   8.883 -12.540  -3.558
   14    HB3  GLU   3           1HB      GLU   3   8.488 -12.129  -1.901
   15    HG2  GLU   3           2HG      GLU   3   9.966 -14.020  -1.177
   16    HG3  GLU   3           1HG      GLU   3  10.454 -14.178  -2.860
   17    H    GLY   4           H        GLY   4   6.316 -12.213  -1.385
   18    HA2  GLY   4           2HA      GLY   4   4.413 -11.820  -3.578
   19    HA3  GLY   4           1HA      GLY   4   3.839 -12.156  -1.950
   20    H    THR   5           H        THR   5   2.906  -9.931  -2.775
   21    HA   THR   5           HA       THR   5   4.715  -7.787  -2.046
   22    HB   THR   5           HB       THR   5   1.836  -7.683  -3.018
   23    HG1  THR   5           1HG      THR   5   4.291  -7.440  -4.418
   24   HG21  THR   5          3HG2      THR   5   2.641  -5.619  -1.899
   25   HG22  THR   5          1HG2      THR   5   2.389  -5.360  -3.626
   26   HG23  THR   5          2HG2      THR   5   4.020  -5.576  -2.997
   27    H    PHE   6           H        PHE   6   4.813  -7.427   0.069
   28    HA   PHE   6           HA       PHE   6   2.501  -8.134   1.720
   29    HB2  PHE   6           2HB      PHE   6   4.621  -9.360   2.147
   30    HB3  PHE   6           1HB      PHE   6   5.403  -7.834   2.527
   31    HD1  PHE   6           2HD      PHE   6   2.532  -9.970   3.562
   32    HD2  PHE   6           1HD      PHE   6   5.483  -7.141   4.732
   33    HE1  PHE   6           2HE      PHE   6   1.870 -10.261   5.909
   34    HE2  PHE   6           1HE      PHE   6   4.831  -7.430   7.090
   35    HZ   PHE   6           HZ       PHE   6   3.023  -8.988   7.679
   36    H    THR   7           H        THR   7   1.511  -6.597   2.841
   37    HA   THR   7           HA       THR   7   2.781  -4.001   3.029
   38    HB   THR   7           HB       THR   7  -0.106  -4.425   2.241
   39    HG1  THR   7           1HG      THR   7   2.274  -3.941   0.865
   40   HG21  THR   7          3HG2      THR   7  -0.129  -1.985   1.965
   41   HG22  THR   7          1HG2      THR   7   1.563  -1.912   2.475
   42   HG23  THR   7          2HG2      THR   7   0.330  -2.424   3.616
   43    H    SER   8           H        SER   8   2.962  -3.577   5.049
   44    HA   SER   8           HA       SER   8   0.819  -3.735   6.873
   45    HB2  SER   8           2HB      SER   8   1.591  -6.128   6.799
   46    HB3  SER   8           1HB      SER   8   3.201  -5.591   7.259
   47    HG   SER   8           HG       SER   8   0.809  -5.370   8.774
   48    H    ASP   9           H        ASP   9   2.455  -3.644   9.111
   49    HA   ASP   9           HA       ASP   9   3.499  -1.007   8.962
   50    HB2  ASP   9           2HB      ASP   9   3.661  -3.037  11.190
   51    HB3  ASP   9           1HB      ASP   9   4.188  -1.365  11.328
   52    H    LEU  10           H        LEU  10   4.811  -3.668   7.756
   53    HA   LEU  10           HA       LEU  10   7.514  -3.696   8.520
   54    HB2  LEU  10           2HB      LEU  10   6.330  -5.379   7.026
   55    HB3  LEU  10           1HB      LEU  10   6.308  -4.210   5.754
   56    HG   LEU  10           HG       LEU  10   8.888  -5.343   6.901
   57   HD11  LEU  10          1HD1      LEU  10   7.361  -6.203   4.456
   58   HD12  LEU  10          2HD1      LEU  10   7.528  -7.129   5.950
   59   HD13  LEU  10          3HD1      LEU  10   8.944  -6.796   4.953
   60   HD21  LEU  10          3HD2      LEU  10   9.884  -4.575   4.808
   61   HD22  LEU  10          1HD2      LEU  10   9.158  -3.222   5.677
   62   HD23  LEU  10          2HD2      LEU  10   8.328  -3.927   4.289
   63    H    SER  11           H        SER  11   5.819  -1.895   5.949
   64    HA   SER  11           HA       SER  11   7.965   0.086   6.074
   65    HB2  SER  11           2HB      SER  11   5.879  -0.315   3.920
   66    HB3  SER  11           1HB      SER  11   7.259   0.782   3.865
   67    HG   SER  11           HG       SER  11   8.548  -1.145   4.222
   68    H    LYS  12           H        LYS  12   4.772  -0.640   6.926
   69    HA   LYS  12           HA       LYS  12   2.925   0.377   7.556
   70    HB2  LYS  12           2HB      LYS  12   3.086   2.199   9.183
   71    HB3  LYS  12           1HB      LYS  12   4.228   0.911   9.520
   72    HG2  LYS  12           2HG      LYS  12   5.972   2.367   8.424
   73    HG3  LYS  12           1HG      LYS  12   4.770   3.659   8.447
   74    HD2  LYS  12           2HD      LYS  12   4.578   3.478  10.836
   75    HD3  LYS  12           1HD      LYS  12   5.713   2.121  10.845
   76    HE2  LYS  12           2HE      LYS  12   7.421   3.646   9.859
   77    HE3  LYS  12           1HE      LYS  12   6.284   4.976  10.067
   78    HZ1  LYS  12           3HZ      LYS  12   6.316   4.514  12.485
   79    HZ2  LYS  12           1HZ      LYS  12   7.834   4.898  11.875
   80    HZ3  LYS  12           2HZ      LYS  12   7.458   3.306  12.218
   81    H    GLN  13           H        GLN  13   3.771   0.849   5.153
   82    HA   GLN  13           HA       GLN  13   2.174   3.156   4.292
   83    HB2  GLN  13           2HB      GLN  13   4.900   2.421   3.177
   84    HB3  GLN  13           1HB      GLN  13   3.834   3.636   2.507
   85    HG2  GLN  13           2HG      GLN  13   4.098   4.988   4.508
   86    HG3  GLN  13           1HG      GLN  13   5.108   3.739   5.227
   87   HE21  GLN  13          1HE2      GLN  13   5.308   4.603   1.823
   88   HE22  GLN  13          2HE2      GLN  13   6.849   5.357   1.939
   89    H    MET  14           H        MET  14   1.632   2.841   1.958
   90    HA   MET  14           HA       MET  14   1.809   0.063   1.091
   91    HB2  MET  14           2HB      MET  14  -0.497   0.594   2.026
   92    HB3  MET  14           1HB      MET  14  -0.663   1.832   0.798
   93    HG2  MET  14           2HG      MET  14  -0.097  -0.957  -0.096
   94    HG3  MET  14           1HG      MET  14  -1.705  -0.607   0.515
   95    HE1  MET  14           3HE      MET  14  -3.487   0.803  -0.733
   96    HE2  MET  14           1HE      MET  14  -3.101   1.953  -2.013
   97    HE3  MET  14           2HE      MET  14  -2.448   2.179  -0.385
   98    H    GLU  15           H        GLU  15   1.416  -0.038  -1.352
   99    HA   GLU  15           HA       GLU  15   3.368   1.399  -2.678
  100    HB2  GLU  15           2HB      GLU  15   2.406  -0.779  -3.341
  101    HB3  GLU  15           1HB      GLU  15   0.944   0.047  -3.843
  102    HG2  GLU  15           2HG      GLU  15   2.210   1.212  -5.563
  103    HG3  GLU  15           1HG      GLU  15   3.681   0.396  -5.030
  104    H    GLU  16           H        GLU  16  -0.072   2.072  -2.397
  105    HA   GLU  16           HA       GLU  16   0.498   4.626  -3.667
  106    HB2  GLU  16           2HB      GLU  16  -0.921   3.087  -5.108
  107    HB3  GLU  16           1HB      GLU  16  -2.160   3.156  -3.867
  108    HG2  GLU  16           2HG      GLU  16  -2.645   5.392  -4.309
  109    HG3  GLU  16           1HG      GLU  16  -1.110   5.647  -5.138
  110    H    GLU  17           H        GLU  17  -1.742   6.054  -2.986
  111    HA   GLU  17           HA       GLU  17  -2.315   7.524  -1.557
  112    HB2  GLU  17           2HB      GLU  17  -3.581   6.904   0.408
  113    HB3  GLU  17           1HB      GLU  17  -3.908   5.805  -0.926
  114    HG2  GLU  17           2HG      GLU  17  -2.714   4.072   0.066
  115    HG3  GLU  17           1HG      GLU  17  -1.965   5.137   1.249
  116    H    ALA  18           H        ALA  18  -1.652   8.975  -0.366
  117    HA   ALA  18           HA       ALA  18  -0.325  10.321   0.810
  118    HB1  ALA  18           1HB      ALA  18   0.165   7.947   2.587
  119    HB2  ALA  18           2HB      ALA  18  -1.269   8.971   2.638
  120    HB3  ALA  18           3HB      ALA  18   0.314   9.652   3.019
  121    H    VAL  19           H        VAL  19   1.067   7.932  -0.893
  122    HA   VAL  19           HA       VAL  19   3.694   9.128  -0.482
  123    HB   VAL  19           HB       VAL  19   3.720   6.660  -0.405
  124   HG11  VAL  19          1HG1      VAL  19   2.597   6.720  -3.192
  125   HG12  VAL  19          2HG1      VAL  19   1.775   6.158  -1.735
  126   HG13  VAL  19          3HG1      VAL  19   3.180   5.281  -2.349
  127   HG21  VAL  19          3HG2      VAL  19   5.675   7.755  -1.296
  128   HG22  VAL  19          1HG2      VAL  19   4.975   7.722  -2.915
  129   HG23  VAL  19          2HG2      VAL  19   5.418   6.207  -2.115
  130    H    ARG  20           H        ARG  20   1.207   8.414  -2.766
  131    HA   ARG  20           HA       ARG  20   2.060   9.649  -5.123
  132    HB2  ARG  20           2HB      ARG  20  -0.604   9.297  -3.846
  133    HB3  ARG  20           1HB      ARG  20  -0.488  10.036  -5.417
  134    HG2  ARG  20           2HG      ARG  20   0.377   7.240  -4.687
  135    HG3  ARG  20           1HG      ARG  20  -1.129   7.689  -5.492
  136    HD2  ARG  20           2HD      ARG  20   0.270   8.684  -7.327
  137    HD3  ARG  20           1HD      ARG  20   1.675   7.947  -6.548
  138    HE   ARG  20           HE       ARG  20  -0.459   6.093  -7.058
  139   HH11  ARG  20          1HH1      ARG  20   2.360   7.631  -8.557
  140   HH12  ARG  20          2HH1      ARG  20   2.578   6.373  -9.681
  141   HH21  ARG  20          1HH2      ARG  20  -0.152   4.445  -8.553
  142   HH22  ARG  20          2HH2      ARG  20   1.104   4.509  -9.700
  143    H    CYS  21           H        CYS  21   0.845  10.958  -2.157
  144    HA   CYS  21           HA       CYS  21   0.580  13.603  -3.373
  145    HB2  CYS  21           2HB      CYS  21  -1.445  12.747  -2.284
  146    HB3  CYS  21           1HB      CYS  21  -0.562  12.486  -0.791
  147    H    PHE  22           H        PHE  22   2.710  11.737  -1.608
  148    HA   PHE  22           HA       PHE  22   3.454  13.526   0.516
  149    HB2  PHE  22           2HB      PHE  22   3.718  10.994   0.441
  150    HB3  PHE  22           1HB      PHE  22   5.081  11.260  -0.631
  151    HD1  PHE  22           2HD      PHE  22   6.741  13.226   0.520
  152    HD2  PHE  22           1HD      PHE  22   4.279  10.402   2.517
  153    HE1  PHE  22           2HE      PHE  22   8.180  13.390   2.513
  154    HE2  PHE  22           1HE      PHE  22   5.708  10.564   4.517
  155    HZ   PHE  22           HZ       PHE  22   7.659  12.056   4.515
  156    H    ILE  23           H        ILE  23   5.270  12.282  -2.242
  157    HA   ILE  23           HA       ILE  23   7.433  14.074  -1.945
  158    HB   ILE  23           HB       ILE  23   6.681  12.396  -4.349
  159   HG12  ILE  23          2HG1      ILE  23   6.700  11.003  -2.345
  160   HG13  ILE  23          1HG1      ILE  23   8.070  10.624  -3.376
  161   HG21  ILE  23          1HG2      ILE  23   9.072  12.379  -4.842
  162   HG22  ILE  23          2HG2      ILE  23   9.389  13.319  -3.390
  163   HG23  ILE  23          3HG2      ILE  23   8.501  14.049  -4.723
  164   HD11  ILE  23          3HD1      ILE  23   8.149  12.305  -0.879
  165   HD12  ILE  23          1HD1      ILE  23   9.526  11.925  -1.914
  166   HD13  ILE  23          2HD1      ILE  23   8.694  10.637  -1.039
  167    H    GLU  24           H        GLU  24   4.470  14.174  -3.595
  168    HA   GLU  24           HA       GLU  24   5.220  16.199  -5.488
  169    HB2  GLU  24           2HB      GLU  24   2.417  15.350  -4.811
  170    HB3  GLU  24           1HB      GLU  24   3.042  15.988  -6.327
  171    HG2  GLU  24           2HG      GLU  24   3.583  13.302  -5.141
  172    HG3  GLU  24           1HG      GLU  24   2.562  13.642  -6.528
  173    H    CYS  25           H        CYS  25   3.489  15.944  -2.414
  174    HA   CYS  25           HA       CYS  25   2.563  18.610  -2.286
  175    HB2  CYS  25           2HB      CYS  25   1.806  16.757  -0.740
  176    HB3  CYS  25           1HB      CYS  25   3.361  16.864   0.069
  177    H    LEU  26           H        LEU  26   5.589  17.071  -1.499
  178    HA   LEU  26           HA       LEU  26   6.894  19.203  -0.222
  179    HB2  LEU  26           2HB      LEU  26   8.067  17.039  -1.967
  180    HB3  LEU  26           1HB      LEU  26   8.986  18.081  -0.902
  181    HG   LEU  26           HG       LEU  26   6.942  16.033  -0.030
  182   HD11  LEU  26          1HD1      LEU  26   9.947  16.041   0.185
  183   HD12  LEU  26          2HD1      LEU  26   8.994  15.036  -0.901
  184   HD13  LEU  26          3HD1      LEU  26   8.865  14.814   0.844
  185   HD21  LEU  26          3HD2      LEU  26   7.023  17.940   1.496
  186   HD22  LEU  26          1HD2      LEU  26   8.778  17.794   1.599
  187   HD23  LEU  26          2HD2      LEU  26   7.747  16.513   2.234
  188    H    LYS  27           H        LYS  27   6.063  18.738  -3.518
  189    HA   LYS  27           HA       LYS  27   7.912  20.776  -4.506
  190    HB2  LYS  27           2HB      LYS  27   5.683  19.339  -5.971
  191    HB3  LYS  27           1HB      LYS  27   6.964  20.293  -6.694
  192    HG2  LYS  27           2HG      LYS  27   7.316  17.681  -5.237
  193    HG3  LYS  27           1HG      LYS  27   7.324  17.898  -6.985
  194    HD2  LYS  27           2HD      LYS  27   9.291  19.381  -6.749
  195    HD3  LYS  27           1HD      LYS  27   9.286  19.065  -5.016
  196    HE2  LYS  27           2HE      LYS  27   9.646  17.001  -7.192
  197    HE3  LYS  27           1HE      LYS  27  10.917  17.661  -6.168
  198    HZ1  LYS  27           3HZ      LYS  27  10.162  15.505  -5.416
  199    HZ2  LYS  27           1HZ      LYS  27   8.591  16.077  -5.208
  200    HZ3  LYS  27           2HZ      LYS  27   9.855  16.677  -4.248
  201    H    GLY  28           H        GLY  28   4.465  20.154  -4.177
  202    HA2  GLY  28           2HA      GLY  28   3.119  21.994  -3.187
  203    HA3  GLY  28           1HA      GLY  28   3.861  23.067  -4.358
  204    H    ILE  29           H        ILE  29   1.534  20.585  -3.834
  205    HA   ILE  29           HA       ILE  29   0.392  21.324  -6.261
  206    HB   ILE  29           HB       ILE  29  -0.190  18.989  -6.849
  207   HG12  ILE  29          2HG1      ILE  29   1.436  17.163  -5.902
  208   HG13  ILE  29          1HG1      ILE  29   1.568  18.251  -4.528
  209   HG21  ILE  29          1HG2      ILE  29   1.930  18.247  -7.809
  210   HG22  ILE  29          2HG2      ILE  29   2.767  19.443  -6.818
  211   HG23  ILE  29          3HG2      ILE  29   1.622  19.969  -8.050
  212   HD11  ILE  29          3HD1      ILE  29  -0.903  18.104  -4.271
  213   HD12  ILE  29          1HD1      ILE  29  -0.084  16.549  -4.084
  214   HD13  ILE  29          2HD1      ILE  29  -0.929  16.951  -5.580
  215    H    GLY  30           H        GLY  30  -1.393  21.668  -5.866
  216    HA2  GLY  30           2HA      GLY  30  -2.744  21.348  -3.352
  217    HA3  GLY  30           1HA      GLY  30  -3.533  21.912  -4.822
  218    H    HIS  31           H        HIS  31  -5.283  20.699  -5.030
  219    HA   HIS  31           HA       HIS  31  -5.280  17.905  -4.301
  220    HB2  HIS  31           2HB      HIS  31  -7.285  19.466  -3.944
  221    HB3  HIS  31           1HB      HIS  31  -7.519  19.416  -5.679
  222    HD1  HIS  31           1HD      HIS  31  -9.313  17.764  -6.327
  223    HD2  HIS  31           2HD      HIS  31  -7.271  16.642  -2.884
  224    HE1  HIS  31           1HE      HIS  31 -10.430  15.677  -5.519
  225    H    LYS  32           H        LYS  32  -3.653  17.318  -5.755
  226    HA   LYS  32           HA       LYS  32  -4.243  17.290  -8.612
  227    HB2  LYS  32           2HB      LYS  32  -1.926  17.714  -7.755
  228    HB3  LYS  32           1HB      LYS  32  -1.920  16.083  -7.114
  229    HG2  LYS  32           2HG      LYS  32  -2.055  15.152  -9.331
  230    HG3  LYS  32           1HG      LYS  32  -2.155  16.766 -10.038
  231    HD2  LYS  32           2HD      LYS  32   0.078  17.277  -9.168
  232    HD3  LYS  32           1HD      LYS  32   0.162  15.674  -8.440
  233    HE2  LYS  32           2HE      LYS  32  -0.103  16.231 -11.399
  234    HE3  LYS  32           1HE      LYS  32   1.398  15.828 -10.569
  235    HZ1  LYS  32           3HZ      LYS  32   0.407  13.666  -9.968
  236    HZ2  LYS  32           1HZ      LYS  32   0.476  13.881 -11.619
  237    HZ3  LYS  32           2HZ      LYS  32  -0.985  14.043 -10.838
  238    H    TYR  33           H        TYR  33  -4.549  15.236  -5.898
  239    HA   TYR  33           HA       TYR  33  -5.402  13.020  -7.627
  240    HB2  TYR  33           2HB      TYR  33  -3.931  12.692  -4.987
  241    HB3  TYR  33           1HB      TYR  33  -4.430  11.412  -6.073
  242    HD1  TYR  33           1HD      TYR  33  -1.984  14.101  -5.511
  243    HD2  TYR  33           2HD      TYR  33  -3.124  10.880  -8.061
  244    HE1  TYR  33           1HE      TYR  33   0.180  14.208  -6.596
  245    HE2  TYR  33           2HE      TYR  33  -0.938  10.985  -9.155
  246    HH   TYR  33           HH       TYR  33   1.678  12.651  -7.911
  247    HA   PRO  34           HA       PRO  34  -9.236  13.429  -5.411
  248    HB2  PRO  34           2HB      PRO  34  -9.810  10.707  -5.107
  249    HB3  PRO  34           1HB      PRO  34 -10.239  11.700  -6.496
  250    HG2  PRO  34           2HG      PRO  34  -7.940   9.841  -6.137
  251    HG3  PRO  34           1HG      PRO  34  -8.910  10.166  -7.580
  252    HD2  PRO  34           2HD      PRO  34  -6.460  11.158  -7.318
  253    HD3  PRO  34           1HD      PRO  34  -7.755  12.118  -8.066
  254    H    PHE  35           H        PHE  35  -6.717  11.521  -4.100
  255    HA   PHE  35           HA       PHE  35  -7.921  11.550  -1.415
  256    HB2  PHE  35           2HB      PHE  35  -6.354   9.595  -0.997
  257    HB3  PHE  35           1HB      PHE  35  -7.689   9.306  -2.112
  258    HD1  PHE  35           1HD      PHE  35  -4.085   9.738  -1.824
  259    HD2  PHE  35           2HD      PHE  35  -7.312   8.950  -4.427
  260    HE1  PHE  35           1HE      PHE  35  -2.502   9.096  -3.550
  261    HE2  PHE  35           2HE      PHE  35  -5.789   8.303  -6.181
  262    HZ   PHE  35           HZ       PHE  35  -3.341   8.351  -5.785
  263    H    CYS  36           H        CYS  36  -6.038  13.422  -3.003
  264    HA   CYS  36           HA       CYS  36  -3.822  13.435  -1.113
  265    HB2  CYS  36           2HB      CYS  36  -3.100  13.504  -3.391
  266    HB3  CYS  36           1HB      CYS  36  -4.190  14.834  -3.766
  267    H    HIS  37           H        HIS  37  -3.895  14.809   0.499
  268    HA   HIS  37           HA       HIS  37  -5.733  17.081   0.314
  269    HB2  HIS  37           2HB      HIS  37  -5.097  15.300   2.658
  270    HB3  HIS  37           1HB      HIS  37  -5.830  16.886   2.866
  271    HD1  HIS  37           1HD      HIS  37  -8.323  16.863   2.888
  272    HD2  HIS  37           2HD      HIS  37  -6.732  13.625   0.832
  273    HE1  HIS  37           1HE      HIS  37 -10.298  15.453   2.185
  274    H    CYS  38           H        CYS  38  -2.974  17.114  -0.482
  275    HA   CYS  38           HA       CYS  38  -1.427  18.519   1.435
  276    HB2  CYS  38           2HB      CYS  38  -0.431  17.497  -0.613
  277    HB3  CYS  38           1HB      CYS  38  -1.303  18.655  -1.606
  278    H    ARG  39           H        ARG  39  -0.895  20.928   1.154
  279    HA   ARG  39           HA       ARG  39  -3.428  22.328   0.666
  280    HB2  ARG  39           2HB      ARG  39  -1.324  23.068   2.698
  281    HB3  ARG  39           1HB      ARG  39  -2.897  23.823   2.473
  282    HG2  ARG  39           2HG      ARG  39  -3.977  21.696   3.127
  283    HG3  ARG  39           1HG      ARG  39  -2.382  21.020   3.442
  284    HD2  ARG  39           2HD      ARG  39  -2.007  22.855   5.082
  285    HD3  ARG  39           1HD      ARG  39  -3.680  23.352   4.838
  286    HE   ARG  39           HE       ARG  39  -2.829  20.759   5.908
  287   HH11  ARG  39          1HH1      ARG  39  -5.300  23.313   5.680
  288   HH12  ARG  39          2HH1      ARG  39  -6.221  22.731   6.972
  289   HH21  ARG  39          1HH2      ARG  39  -4.129  19.973   7.732
  290   HH22  ARG  39          2HH2      ARG  39  -5.553  20.806   8.152
  Start of MODEL   18
    1    H1   HIS   1           H        HIS   1  -2.935  12.464  10.286
    2    HA   HIS   1           HA       HIS   1  -4.810  12.614  11.542
    3    HB2  HIS   1           2HB      HIS   1  -4.876  15.079  11.257
    4    HB3  HIS   1           1HB      HIS   1  -5.675  14.863   9.707
    5    HD1  HIS   1           1HD      HIS   1  -6.332  14.106  13.391
    6    HD2  HIS   1           2HD      HIS   1  -8.367  14.799   9.835
    7    HE1  HIS   1           1HE      HIS   1  -8.766  14.230  14.010
    8    H    GLY   2           H        GLY   2  -6.098  10.966  11.308
    9    HA2  GLY   2           2HA      GLY   2  -8.146  10.272  10.038
   10    HA3  GLY   2           1HA      GLY   2  -7.081  10.324   8.632
   11    H    GLU   3           H        GLU   3  -8.408   8.045   9.410
   12    HA   GLU   3           HA       GLU   3  -6.528   6.389  10.848
   13    HB2  GLU   3           2HB      GLU   3  -9.227   5.766   9.648
   14    HB3  GLU   3           1HB      GLU   3  -8.256   4.632  10.572
   15    HG2  GLU   3           2HG      GLU   3  -9.390   7.222  11.607
   16    HG3  GLU   3           1HG      GLU   3 -10.050   5.616  11.908
   17    H    GLY   4           H        GLY   4  -4.847   5.786   9.688
   18    HA2  GLY   4           2HA      GLY   4  -4.934   5.399   6.858
   19    HA3  GLY   4           1HA      GLY   4  -3.568   5.065   7.918
   20    H    THR   5           H        THR   5  -6.547   3.871   6.681
   21    HA   THR   5           HA       THR   5  -6.109   1.240   7.806
   22    HB   THR   5           HB       THR   5  -8.428   2.299   6.179
   23    HG1  THR   5           1HG      THR   5  -7.577   2.727   8.716
   24   HG21  THR   5          3HG2      THR   5  -8.193  -0.044   8.086
   25   HG22  THR   5          1HG2      THR   5  -8.274  -0.168   6.328
   26   HG23  THR   5          2HG2      THR   5  -9.656   0.449   7.233
   27    H    PHE   6           H        PHE   6  -4.858  -0.037   6.626
   28    HA   PHE   6           HA       PHE   6  -4.642   0.358   3.765
   29    HB2  PHE   6           2HB      PHE   6  -3.060  -1.409   5.643
   30    HB3  PHE   6           1HB      PHE   6  -2.731  -1.207   3.927
   31    HD1  PHE   6           1HD      PHE   6  -1.951   1.011   3.090
   32    HD2  PHE   6           2HD      PHE   6  -2.297   0.144   7.241
   33    HE1  PHE   6           1HE      PHE   6  -0.494   2.914   3.603
   34    HE2  PHE   6           2HE      PHE   6  -0.843   2.045   7.765
   35    HZ   PHE   6           HZ       PHE   6   0.067   3.441   5.948
   36    H    THR   7           H        THR   7  -5.810  -0.823   2.460
   37    HA   THR   7           HA       THR   7  -6.970  -3.325   3.446
   38    HB   THR   7           HB       THR   7  -7.809  -1.615   1.071
   39    HG1  THR   7           1HG      THR   7  -8.511  -1.640   3.774
   40   HG21  THR   7          3HG2      THR   7  -8.527  -3.986   0.952
   41   HG22  THR   7          1HG2      THR   7  -9.900  -2.910   1.210
   42   HG23  THR   7          2HG2      THR   7  -9.243  -3.837   2.557
   43    H    SER   8           H        SER   8  -6.255  -5.205   2.527
   44    HA   SER   8           HA       SER   8  -3.993  -5.182   0.876
   45    HB2  SER   8           2HB      SER   8  -4.567  -7.002   2.485
   46    HB3  SER   8           1HB      SER   8  -5.839  -7.524   1.384
   47    HG   SER   8           HG       SER   8  -4.204  -7.958  -0.196
   48    H    ASP   9           H        ASP   9  -3.737  -5.170  -1.174
   49    HA   ASP   9           HA       ASP   9  -4.012  -5.203  -3.391
   50    HB2  ASP   9           2HB      ASP   9  -6.191  -7.150  -2.678
   51    HB3  ASP   9           1HB      ASP   9  -5.655  -6.852  -4.334
   52    H    LEU  10           H        LEU  10  -5.490  -3.317  -1.704
   53    HA   LEU  10           HA       LEU  10  -8.044  -2.766  -2.773
   54    HB2  LEU  10           2HB      LEU  10  -7.028  -1.917  -0.631
   55    HB3  LEU  10           1HB      LEU  10  -6.058  -0.828  -1.574
   56    HG   LEU  10           HG       LEU  10  -8.015   0.252  -0.451
   57   HD11  LEU  10          1HD1      LEU  10  -8.067   0.407  -3.448
   58   HD12  LEU  10          2HD1      LEU  10  -7.023   1.330  -2.375
   59   HD13  LEU  10          3HD1      LEU  10  -8.774   1.577  -2.334
   60   HD21  LEU  10          3HD2      LEU  10  -9.635  -1.357  -2.411
   61   HD22  LEU  10          1HD2      LEU  10 -10.246  -0.075  -1.370
   62   HD23  LEU  10          2HD2      LEU  10  -9.614  -1.562  -0.660
   63    H    SER  11           H        SER  11  -4.822  -1.542  -3.512
   64    HA   SER  11           HA       SER  11  -5.926  -0.564  -6.031
   65    HB2  SER  11           2HB      SER  11  -3.405   0.264  -4.572
   66    HB3  SER  11           1HB      SER  11  -3.972   0.956  -6.100
   67    HG   SER  11           HG       SER  11  -4.552   1.994  -3.929
   68    H    LYS  12           H        LYS  12  -3.924  -2.837  -4.526
   69    HA   LYS  12           HA       LYS  12  -2.801  -4.655  -5.136
   70    HB2  LYS  12           2HB      LYS  12  -4.996  -4.934  -6.326
   71    HB3  LYS  12           1HB      LYS  12  -4.214  -4.342  -7.777
   72    HG2  LYS  12           2HG      LYS  12  -2.689  -6.262  -7.718
   73    HG3  LYS  12           1HG      LYS  12  -3.522  -6.860  -6.275
   74    HD2  LYS  12           2HD      LYS  12  -5.608  -6.900  -7.510
   75    HD3  LYS  12           1HD      LYS  12  -4.752  -6.332  -8.945
   76    HE2  LYS  12           2HE      LYS  12  -3.365  -8.387  -8.895
   77    HE3  LYS  12           1HE      LYS  12  -4.297  -8.942  -7.505
   78    HZ1  LYS  12           3HZ      LYS  12  -5.075  -9.925  -9.592
   79    HZ2  LYS  12           1HZ      LYS  12  -5.423  -8.395 -10.200
   80    HZ3  LYS  12           2HZ      LYS  12  -6.272  -9.000  -8.878
   81    H    GLN  13           H        GLN  13  -1.832  -1.876  -6.093
   82    HA   GLN  13           HA       GLN  13   0.503  -2.913  -7.512
   83    HB2  GLN  13           2HB      GLN  13  -0.994  -0.390  -8.301
   84    HB3  GLN  13           1HB      GLN  13   0.562  -0.871  -8.947
   85    HG2  GLN  13           2HG      GLN  13  -2.025  -2.383  -9.286
   86    HG3  GLN  13           1HG      GLN  13  -1.281  -1.343 -10.493
   87   HE21  GLN  13          1HE2      GLN  13   1.452  -2.279  -9.927
   88   HE22  GLN  13          2HE2      GLN  13   1.525  -3.874 -10.564
   89    H    MET  14           H        MET  14   2.395  -1.568  -7.154
   90    HA   MET  14           HA       MET  14   2.192  -0.295  -4.592
   91    HB2  MET  14           2HB      MET  14   4.621  -0.917  -6.260
   92    HB3  MET  14           1HB      MET  14   4.705  -0.032  -4.742
   93    HG2  MET  14           2HG      MET  14   3.657  -1.966  -3.607
   94    HG3  MET  14           1HG      MET  14   3.711  -2.843  -5.129
   95    HE1  MET  14           3HE      MET  14   7.551  -3.231  -5.730
   96    HE2  MET  14           1HE      MET  14   6.504  -1.950  -6.341
   97    HE3  MET  14           2HE      MET  14   5.935  -3.621  -6.318
   98    H    GLU  15           H        GLU  15   0.827   1.222  -5.390
   99    HA   GLU  15           HA       GLU  15   2.184   3.728  -5.827
  100    HB2  GLU  15           2HB      GLU  15   1.356   2.810  -8.094
  101    HB3  GLU  15           1HB      GLU  15  -0.268   2.899  -7.439
  102    HG2  GLU  15           2HG      GLU  15  -0.047   5.310  -7.201
  103    HG3  GLU  15           1HG      GLU  15   1.598   5.228  -7.830
  104    H    GLU  16           H        GLU  16   1.680   4.261  -3.747
  105    HA   GLU  16           HA       GLU  16  -0.996   3.602  -2.770
  106    HB2  GLU  16           2HB      GLU  16   0.845   2.403  -1.698
  107    HB3  GLU  16           1HB      GLU  16   1.590   3.925  -1.254
  108    HG2  GLU  16           2HG      GLU  16  -0.262   4.432   0.225
  109    HG3  GLU  16           1HG      GLU  16  -1.090   2.957  -0.260
  110    H    GLU  17           H        GLU  17  -2.077   5.006  -1.350
  111    HA   GLU  17           HA       GLU  17  -2.031   7.661  -1.915
  112    HB2  GLU  17           2HB      GLU  17  -3.752   7.673  -0.176
  113    HB3  GLU  17           1HB      GLU  17  -4.012   6.336  -1.289
  114    HG2  GLU  17           2HG      GLU  17  -2.845   4.845   0.355
  115    HG3  GLU  17           1HG      GLU  17  -2.837   6.196   1.478
  116    H    ALA  18           H        ALA  18  -1.722   9.056  -0.428
  117    HA   ALA  18           HA       ALA  18  -0.386  10.468   0.868
  118    HB1  ALA  18           1HB      ALA  18   0.146   9.741   3.112
  119    HB2  ALA  18           2HB      ALA  18  -0.133   8.059   2.661
  120    HB3  ALA  18           3HB      ALA  18  -1.476   9.200   2.675
  121    H    VAL  19           H        VAL  19   0.979   8.044  -0.844
  122    HA   VAL  19           HA       VAL  19   3.680   8.972  -0.172
  123    HB   VAL  19           HB       VAL  19   2.857   6.699  -2.014
  124   HG11  VAL  19          1HG1      VAL  19   5.531   7.454  -0.857
  125   HG12  VAL  19          2HG1      VAL  19   5.020   7.635  -2.537
  126   HG13  VAL  19          3HG1      VAL  19   5.212   6.022  -1.840
  127   HG21  VAL  19          3HG2      VAL  19   3.824   6.542   0.842
  128   HG22  VAL  19          1HG2      VAL  19   3.590   5.165  -0.238
  129   HG23  VAL  19          2HG2      VAL  19   2.208   6.143   0.257
  130    H    ARG  20           H        ARG  20   1.456   8.219  -2.743
  131    HA   ARG  20           HA       ARG  20   2.711   9.761  -4.749
  132    HB2  ARG  20           2HB      ARG  20   0.056   8.484  -4.438
  133    HB3  ARG  20           1HB      ARG  20   0.440   9.393  -5.875
  134    HG2  ARG  20           2HG      ARG  20   1.758   6.887  -4.809
  135    HG3  ARG  20           1HG      ARG  20   0.838   7.059  -6.301
  136    HD2  ARG  20           2HD      ARG  20   3.572   8.244  -5.697
  137    HD3  ARG  20           1HD      ARG  20   3.205   6.944  -6.814
  138    HE   ARG  20           HE       ARG  20   1.940   8.576  -8.129
  139   HH11  ARG  20          1HH1      ARG  20   4.569   9.766  -6.020
  140   HH12  ARG  20          2HH1      ARG  20   4.736  11.238  -6.862
  141   HH21  ARG  20          1HH2      ARG  20   2.297  10.579  -9.320
  142   HH22  ARG  20          2HH2      ARG  20   3.436  11.698  -8.758
  143    H    CYS  21           H        CYS  21   0.979  10.670  -2.167
  144    HA   CYS  21           HA       CYS  21   0.283  13.248  -3.403
  145    HB2  CYS  21           2HB      CYS  21  -1.560  12.361  -2.136
  146    HB3  CYS  21           1HB      CYS  21  -0.524  12.044  -0.746
  147    H    PHE  22           H        PHE  22   2.383  11.653  -1.199
  148    HA   PHE  22           HA       PHE  22   3.125  13.790   0.470
  149    HB2  PHE  22           2HB      PHE  22   3.277  11.341   0.928
  150    HB3  PHE  22           1HB      PHE  22   4.635  11.278  -0.181
  151    HD1  PHE  22           2HD      PHE  22   3.426  12.486   3.011
  152    HD2  PHE  22           1HD      PHE  22   6.778  12.056   0.469
  153    HE1  PHE  22           2HE      PHE  22   4.902  13.021   4.890
  154    HE2  PHE  22           1HE      PHE  22   8.282  12.588   2.321
  155    HZ   PHE  22           HZ       PHE  22   7.352  13.078   4.550
  156    H    ILE  23           H        ILE  23   4.948  12.100  -2.078
  157    HA   ILE  23           HA       ILE  23   7.155  13.852  -2.017
  158    HB   ILE  23           HB       ILE  23   6.270  12.038  -4.290
  159   HG12  ILE  23          2HG1      ILE  23   6.536  10.809  -2.159
  160   HG13  ILE  23          1HG1      ILE  23   7.757  10.349  -3.336
  161   HG21  ILE  23          1HG2      ILE  23   7.939  13.657  -5.007
  162   HG22  ILE  23          2HG2      ILE  23   8.644  12.038  -4.943
  163   HG23  ILE  23          3HG2      ILE  23   8.982  13.200  -3.661
  164   HD11  ILE  23          3HD1      ILE  23   9.397  11.731  -2.182
  165   HD12  ILE  23          1HD1      ILE  23   8.687  10.546  -1.092
  166   HD13  ILE  23          2HD1      ILE  23   8.180  12.236  -1.016
  167    H    GLU  24           H        GLU  24   4.191  13.888  -3.778
  168    HA   GLU  24           HA       GLU  24   4.918  15.858  -5.716
  169    HB2  GLU  24           2HB      GLU  24   2.126  15.225  -4.793
  170    HB3  GLU  24           1HB      GLU  24   2.659  15.789  -6.368
  171    HG2  GLU  24           2HG      GLU  24   3.221  13.095  -5.200
  172    HG3  GLU  24           1HG      GLU  24   1.958  13.453  -6.368
  173    H    CYS  25           H        CYS  25   3.329  15.802  -2.572
  174    HA   CYS  25           HA       CYS  25   2.458  18.473  -2.519
  175    HB2  CYS  25           2HB      CYS  25   1.686  16.599  -0.995
  176    HB3  CYS  25           1HB      CYS  25   3.194  16.811  -0.109
  177    H    LEU  26           H        LEU  26   5.452  16.912  -1.698
  178    HA   LEU  26           HA       LEU  26   6.721  19.031  -0.368
  179    HB2  LEU  26           2HB      LEU  26   7.916  16.838  -2.060
  180    HB3  LEU  26           1HB      LEU  26   8.830  17.882  -0.991
  181    HG   LEU  26           HG       LEU  26   6.722  15.896  -0.129
  182   HD11  LEU  26          1HD1      LEU  26   9.716  15.826   0.160
  183   HD12  LEU  26          2HD1      LEU  26   8.763  14.829  -0.936
  184   HD13  LEU  26          3HD1      LEU  26   8.583  14.642   0.808
  185   HD21  LEU  26          3HD2      LEU  26   6.798  17.805   1.381
  186   HD22  LEU  26          1HD2      LEU  26   8.555  17.660   1.499
  187   HD23  LEU  26          2HD2      LEU  26   7.518  16.389   2.142
  188    H    LYS  27           H        LYS  27   6.070  18.475  -3.708
  189    HA   LYS  27           HA       LYS  27   7.917  20.457  -4.715
  190    HB2  LYS  27           2HB      LYS  27   5.455  19.318  -6.061
  191    HB3  LYS  27           1HB      LYS  27   6.786  20.160  -6.835
  192    HG2  LYS  27           2HG      LYS  27   8.272  18.318  -6.321
  193    HG3  LYS  27           1HG      LYS  27   6.966  17.480  -5.480
  194    HD2  LYS  27           2HD      LYS  27   7.216  16.558  -7.700
  195    HD3  LYS  27           1HD      LYS  27   5.691  17.429  -7.602
  196    HE2  LYS  27           2HE      LYS  27   6.652  19.327  -8.742
  197    HE3  LYS  27           1HE      LYS  27   8.241  18.561  -8.757
  198    HZ1  LYS  27           3HZ      LYS  27   7.305  16.825 -10.182
  199    HZ2  LYS  27           1HZ      LYS  27   7.155  18.337 -10.883
  200    HZ3  LYS  27           2HZ      LYS  27   5.818  17.593 -10.189
  201    H    GLY  28           H        GLY  28   4.427  20.144  -4.426
  202    HA2  GLY  28           2HA      GLY  28   3.323  22.049  -3.236
  203    HA3  GLY  28           1HA      GLY  28   4.177  23.085  -4.378
  204    H    ILE  29           H        ILE  29   1.698  20.574  -4.090
  205    HA   ILE  29           HA       ILE  29   0.621  21.626  -6.445
  206    HB   ILE  29           HB       ILE  29  -0.087  19.361  -7.218
  207   HG12  ILE  29          2HG1      ILE  29   1.499  17.440  -6.504
  208   HG13  ILE  29          1HG1      ILE  29   1.778  18.395  -5.055
  209   HG21  ILE  29          1HG2      ILE  29   2.868  19.835  -7.199
  210   HG22  ILE  29          2HG2      ILE  29   1.688  20.462  -8.348
  211   HG23  ILE  29          3HG2      ILE  29   2.020  18.730  -8.280
  212   HD11  ILE  29          3HD1      ILE  29  -0.832  17.257  -6.014
  213   HD12  ILE  29          1HD1      ILE  29  -0.638  18.357  -4.653
  214   HD13  ILE  29          2HD1      ILE  29   0.105  16.747  -4.595
  215    H    GLY  30           H        GLY  30  -1.043  22.219  -6.046
  216    HA2  GLY  30           2HA      GLY  30  -2.622  21.869  -3.704
  217    HA3  GLY  30           1HA      GLY  30  -3.198  22.654  -5.169
  218    H    HIS  31           H        HIS  31  -3.211  19.874  -3.272
  219    HA   HIS  31           HA       HIS  31  -4.225  17.914  -3.257
  220    HB2  HIS  31           2HB      HIS  31  -6.111  19.501  -4.890
  221    HB3  HIS  31           1HB      HIS  31  -6.531  17.877  -4.292
  222    HD1  HIS  31           1HD      HIS  31  -6.604  21.436  -3.392
  223    HD2  HIS  31           2HD      HIS  31  -6.521  17.810  -1.386
  224    HE1  HIS  31           1HE      HIS  31  -7.319  21.948  -1.034
  225    H    LYS  32           H        LYS  32  -5.217  18.551  -6.458
  226    HA   LYS  32           HA       LYS  32  -4.920  17.498  -8.483
  227    HB2  LYS  32           2HB      LYS  32  -2.401  16.418  -7.232
  228    HB3  LYS  32           1HB      LYS  32  -2.846  16.165  -8.908
  229    HG2  LYS  32           2HG      LYS  32  -2.212  18.783  -7.569
  230    HG3  LYS  32           1HG      LYS  32  -1.201  17.917  -8.727
  231    HD2  LYS  32           2HD      LYS  32  -3.113  18.165 -10.369
  232    HD3  LYS  32           1HD      LYS  32  -3.846  19.274  -9.207
  233    HE2  LYS  32           2HE      LYS  32  -2.656  20.615 -10.753
  234    HE3  LYS  32           1HE      LYS  32  -1.708  20.584  -9.272
  235    HZ1  LYS  32           3HZ      LYS  32  -1.193  18.953 -11.696
  236    HZ2  LYS  32           1HZ      LYS  32  -0.270  18.856 -10.298
  237    HZ3  LYS  32           2HZ      LYS  32  -0.290  20.265 -11.210
  238    H    TYR  33           H        TYR  33  -3.829  15.151  -6.147
  239    HA   TYR  33           HA       TYR  33  -5.176  13.055  -7.596
  240    HB2  TYR  33           2HB      TYR  33  -3.560  12.941  -5.032
  241    HB3  TYR  33           1HB      TYR  33  -4.088  11.552  -5.966
  242    HD1  TYR  33           1HD      TYR  33  -1.972  14.615  -6.194
  243    HD2  TYR  33           2HD      TYR  33  -2.707  10.697  -7.664
  244    HE1  TYR  33           1HE      TYR  33   0.024  14.781  -7.517
  245    HE2  TYR  33           2HE      TYR  33  -0.661  10.819  -9.003
  246    HH   TYR  33           HH       TYR  33   1.709  13.235  -8.613
  247    HA   PRO  34           HA       PRO  34  -9.022  13.219  -5.449
  248    HB2  PRO  34           2HB      PRO  34  -9.372  10.465  -5.083
  249    HB3  PRO  34           1HB      PRO  34  -9.841  11.375  -6.517
  250    HG2  PRO  34           2HG      PRO  34  -7.375   9.771  -6.041
  251    HG3  PRO  34           1HG      PRO  34  -8.357   9.917  -7.506
  252    HD2  PRO  34           2HD      PRO  34  -6.051  11.184  -7.296
  253    HD3  PRO  34           1HD      PRO  34  -7.448  11.995  -8.043
  254    H    PHE  35           H        PHE  35  -6.585  11.090  -4.149
  255    HA   PHE  35           HA       PHE  35  -7.698  11.151  -1.459
  256    HB2  PHE  35           2HB      PHE  35  -5.824   9.473  -1.055
  257    HB3  PHE  35           1HB      PHE  35  -7.103   8.985  -2.165
  258    HD1  PHE  35           1HD      PHE  35  -3.585   9.989  -1.909
  259    HD2  PHE  35           2HD      PHE  35  -6.689   8.714  -4.485
  260    HE1  PHE  35           1HE      PHE  35  -1.937   9.586  -3.678
  261    HE2  PHE  35           2HE      PHE  35  -5.114   8.313  -6.257
  262    HZ   PHE  35           HZ       PHE  35  -2.681   8.737  -5.879
  263    H    CYS  36           H        CYS  36  -5.840  13.230  -3.079
  264    HA   CYS  36           HA       CYS  36  -3.806  13.433  -1.006
  265    HB2  CYS  36           2HB      CYS  36  -2.981  13.370  -3.276
  266    HB3  CYS  36           1HB      CYS  36  -3.942  14.791  -3.701
  267    H    HIS  37           H        HIS  37  -4.035  14.774   0.523
  268    HA   HIS  37           HA       HIS  37  -5.965  16.982   0.334
  269    HB2  HIS  37           2HB      HIS  37  -4.706  15.644   2.753
  270    HB3  HIS  37           1HB      HIS  37  -5.838  16.980   2.824
  271    HD1  HIS  37           1HD      HIS  37  -8.120  16.146   3.510
  272    HD2  HIS  37           2HD      HIS  37  -6.061  13.376   1.180
  273    HE1  HIS  37           1HE      HIS  37  -9.585  14.105   3.391
  274    H    CYS  38           H        CYS  38  -3.256  17.073  -0.801
  275    HA   CYS  38           HA       CYS  38  -1.576  18.579   0.948
  276    HB2  CYS  38           2HB      CYS  38  -0.618  17.302  -0.912
  277    HB3  CYS  38           1HB      CYS  38  -1.453  18.349  -2.060
  278    H    ARG  39           H        ARG  39  -2.122  20.463   1.676
  279    HA   ARG  39           HA       ARG  39  -2.853  22.617  -0.093
  280    HB2  ARG  39           2HB      ARG  39  -4.929  23.146   1.090
  281    HB3  ARG  39           1HB      ARG  39  -5.014  21.565   0.325
  282    HG2  ARG  39           2HG      ARG  39  -4.474  20.538   2.534
  283    HG3  ARG  39           1HG      ARG  39  -4.593  22.141   3.256
  284    HD2  ARG  39           2HD      ARG  39  -6.778  20.700   1.768
  285    HD3  ARG  39           1HD      ARG  39  -6.659  20.845   3.518
  286    HE   ARG  39           HE       ARG  39  -6.771  23.342   3.015
  287   HH11  ARG  39          1HH1      ARG  39  -8.506  20.831   1.143
  288   HH12  ARG  39          2HH1      ARG  39  -9.756  21.872   0.675
  289   HH21  ARG  39          1HH2      ARG  39  -8.632  24.722   2.418
  290   HH22  ARG  39          2HH2      ARG  39  -9.853  24.066   1.416
  Start of MODEL   19
    1    H1   HIS   1           H        HIS   1  25.203  -4.639   2.951
    2    HA   HIS   1           HA       HIS   1  23.769  -4.949   1.193
    3    HB2  HIS   1           2HB      HIS   1  21.628  -5.427   3.296
    4    HB3  HIS   1           1HB      HIS   1  21.414  -5.634   1.562
    5    HD1  HIS   1           1HD      HIS   1  22.352  -7.822   0.521
    6    HD2  HIS   1           2HD      HIS   1  23.116  -7.399   4.576
    7    HE1  HIS   1           1HE      HIS   1  23.208 -10.068   1.298
    8    H    GLY   2           H        GLY   2  23.833  -2.805   3.548
    9    HA2  GLY   2           2HA      GLY   2  23.666  -0.468   3.062
   10    HA3  GLY   2           1HA      GLY   2  22.306  -0.828   2.000
   11    H    GLU   3           H        GLU   3  22.155   1.097   3.952
   12    HA   GLU   3           HA       GLU   3  20.854  -0.128   6.205
   13    HB2  GLU   3           2HB      GLU   3  21.284   2.779   5.549
   14    HB3  GLU   3           1HB      GLU   3  20.496   2.191   7.007
   15    HG2  GLU   3           2HG      GLU   3  23.342   1.696   6.174
   16    HG3  GLU   3           1HG      GLU   3  22.781   2.706   7.509
   17    H    GLY   4           H        GLY   4  19.916   1.807   3.440
   18    HA2  GLY   4           2HA      GLY   4  17.144   1.817   4.184
   19    HA3  GLY   4           1HA      GLY   4  17.824   2.359   2.651
   20    H    THR   5           H        THR   5  16.578  -0.318   4.426
   21    HA   THR   5           HA       THR   5  16.839  -2.003   2.061
   22    HB   THR   5           HB       THR   5  16.091  -2.760   4.895
   23    HG1  THR   5           1HG      THR   5  18.495  -2.537   3.485
   24   HG21  THR   5          3HG2      THR   5  15.248  -4.334   3.177
   25   HG22  THR   5          1HG2      THR   5  16.536  -5.062   4.141
   26   HG23  THR   5          2HG2      THR   5  16.882  -4.465   2.522
   27    H    PHE   6           H        PHE   6  15.218  -1.756   0.744
   28    HA   PHE   6           HA       PHE   6  12.518  -1.703   1.846
   29    HB2  PHE   6           2HB      PHE   6  13.540  -0.529  -0.749
   30    HB3  PHE   6           1HB      PHE   6  11.854  -0.546  -0.243
   31    HD1  PHE   6           1HD      PHE   6  11.104   0.850   1.613
   32    HD2  PHE   6           2HD      PHE   6  15.110   1.010   0.185
   33    HE1  PHE   6           1HE      PHE   6  11.444   2.961   2.809
   34    HE2  PHE   6           2HE      PHE   6  15.453   3.125   1.376
   35    HZ   PHE   6           HZ       PHE   6  13.618   4.102   2.694
   36    H    THR   7           H        THR   7  11.874  -3.697   1.744
   37    HA   THR   7           HA       THR   7  12.279  -5.054  -0.772
   38    HB   THR   7           HB       THR   7  13.833  -6.006   0.889
   39    HG1  THR   7           1HG      THR   7  13.477  -8.003   0.387
   40   HG21  THR   7          3HG2      THR   7  13.008  -7.229   2.857
   41   HG22  THR   7          1HG2      THR   7  11.370  -6.712   2.464
   42   HG23  THR   7          2HG2      THR   7  12.580  -5.517   2.935
   43    H    SER   8           H        SER   8  10.620  -6.291  -1.483
   44    HA   SER   8           HA       SER   8   8.048  -5.402  -0.965
   45    HB2  SER   8           2HB      SER   8   8.909  -7.975  -2.282
   46    HB3  SER   8           1HB      SER   8   7.418  -7.071  -2.558
   47    HG   SER   8           HG       SER   8   8.589  -6.317  -4.131
   48    H    ASP   9           H        ASP   9   6.340  -6.487  -0.032
   49    HA   ASP   9           HA       ASP   9   5.128  -7.882   1.317
   50    HB2  ASP   9           2HB      ASP   9   6.298  -9.797   0.228
   51    HB3  ASP   9           1HB      ASP   9   7.593  -9.647   1.402
   52    H    LEU  10           H        LEU  10   8.229  -6.820   2.306
   53    HA   LEU  10           HA       LEU  10   7.849  -7.057   5.094
   54    HB2  LEU  10           2HB      LEU  10   9.970  -6.554   3.827
   55    HB3  LEU  10           1HB      LEU  10   9.390  -4.936   3.582
   56    HG   LEU  10           HG       LEU  10  11.124  -5.093   5.356
   57   HD11  LEU  10          1HD1      LEU  10  10.031  -3.825   7.117
   58   HD12  LEU  10          2HD1      LEU  10   8.457  -4.262   6.452
   59   HD13  LEU  10          3HD1      LEU  10   9.558  -3.260   5.512
   60   HD21  LEU  10          3HD2      LEU  10   9.099  -6.756   6.844
   61   HD22  LEU  10          1HD2      LEU  10  10.613  -6.141   7.503
   62   HD23  LEU  10          2HD2      LEU  10  10.640  -7.314   6.189
   63    H    SER  11           H        SER  11   7.113  -4.451   2.756
   64    HA   SER  11           HA       SER  11   5.760  -2.902   4.725
   65    HB2  SER  11           2HB      SER  11   5.130  -1.654   2.507
   66    HB3  SER  11           1HB      SER  11   6.792  -1.609   3.107
   67    HG   SER  11           HG       SER  11   6.995  -2.163   1.045
   68    H    LYS  12           H        LYS  12   5.024  -5.472   2.710
   69    HA   LYS  12           HA       LYS  12   3.255  -6.725   2.135
   70    HB2  LYS  12           2HB      LYS  12   1.741  -7.289   3.931
   71    HB3  LYS  12           1HB      LYS  12   3.463  -7.437   4.311
   72    HG2  LYS  12           2HG      LYS  12   3.282  -5.267   5.539
   73    HG3  LYS  12           1HG      LYS  12   1.543  -5.292   5.238
   74    HD2  LYS  12           2HD      LYS  12   2.996  -7.526   6.514
   75    HD3  LYS  12           1HD      LYS  12   2.364  -6.184   7.492
   76    HE2  LYS  12           2HE      LYS  12   0.731  -8.000   5.681
   77    HE3  LYS  12           1HE      LYS  12   0.851  -8.183   7.428
   78    HZ1  LYS  12           3HZ      LYS  12  -0.306  -5.822   6.017
   79    HZ2  LYS  12           1HZ      LYS  12  -0.203  -6.020   7.679
   80    HZ3  LYS  12           2HZ      LYS  12  -1.183  -7.026   6.758
   81    H    GLN  13           H        GLN  13   2.622  -3.771   1.690
   82    HA   GLN  13           HA       GLN  13  -0.209  -4.241   1.267
   83    HB2  GLN  13           2HB      GLN  13  -0.026  -3.150   3.363
   84    HB3  GLN  13           1HB      GLN  13   1.039  -1.929   2.686
   85    HG2  GLN  13           2HG      GLN  13  -0.632  -1.091   1.366
   86    HG3  GLN  13           1HG      GLN  13  -1.726  -2.417   1.815
   87   HE21  GLN  13          1HE2      GLN  13  -3.286  -1.025   2.691
   88   HE22  GLN  13          2HE2      GLN  13  -3.068  -0.155   4.161
   89    H    MET  14           H        MET  14   2.721  -2.459   0.376
   90    HA   MET  14           HA       MET  14   3.187  -0.890  -1.083
   91    HB2  MET  14           2HB      MET  14   1.523  -2.799  -2.585
   92    HB3  MET  14           1HB      MET  14   2.121  -1.365  -3.447
   93    HG2  MET  14           2HG      MET  14   3.705  -3.579  -2.134
   94    HG3  MET  14           1HG      MET  14   3.563  -3.260  -3.859
   95    HE1  MET  14           3HE      MET  14   6.399  -3.631  -2.384
   96    HE2  MET  14           1HE      MET  14   7.317  -2.347  -3.166
   97    HE3  MET  14           2HE      MET  14   6.209  -3.343  -4.112
   98    H    GLU  15           H        GLU  15   2.170   0.601   0.215
   99    HA   GLU  15           HA       GLU  15  -0.458   1.553  -0.527
  100    HB2  GLU  15           2HB      GLU  15   0.336   1.428   1.838
  101    HB3  GLU  15           1HB      GLU  15   1.554   2.631   1.452
  102    HG2  GLU  15           2HG      GLU  15  -0.197   3.777   2.530
  103    HG3  GLU  15           1HG      GLU  15  -0.333   4.168   0.818
  104    H    GLU  16           H        GLU  16  -0.570   2.900  -2.256
  105    HA   GLU  16           HA       GLU  16   1.687   4.705  -2.693
  106    HB2  GLU  16           2HB      GLU  16   0.790   5.112  -4.927
  107    HB3  GLU  16           1HB      GLU  16   1.083   3.397  -4.654
  108    HG2  GLU  16           2HG      GLU  16  -1.279   3.035  -4.351
  109    HG3  GLU  16           1HG      GLU  16  -1.585   4.764  -4.514
  110    H    GLU  17           H        GLU  17  -1.605   4.599  -1.738
  111    HA   GLU  17           HA       GLU  17  -2.148   7.258  -2.160
  112    HB2  GLU  17           2HB      GLU  17  -3.396   5.230  -0.340
  113    HB3  GLU  17           1HB      GLU  17  -4.010   6.867  -0.508
  114    HG2  GLU  17           2HG      GLU  17  -4.385   6.439  -2.911
  115    HG3  GLU  17           1HG      GLU  17  -3.845   4.777  -2.676
  116    H    ALA  18           H        ALA  18  -1.923   8.684  -1.081
  117    HA   ALA  18           HA       ALA  18  -1.158  10.379   0.319
  118    HB1  ALA  18           1HB      ALA  18  -0.801   9.967   2.702
  119    HB2  ALA  18           2HB      ALA  18  -0.830   8.227   2.412
  120    HB3  ALA  18           3HB      ALA  18  -2.284   9.189   2.142
  121    H    VAL  19           H        VAL  19   0.633   8.080  -0.977
  122    HA   VAL  19           HA       VAL  19   3.182   9.234  -0.091
  123    HB   VAL  19           HB       VAL  19   2.650   6.813  -1.868
  124   HG11  VAL  19          1HG1      VAL  19   5.018   6.298  -1.552
  125   HG12  VAL  19          2HG1      VAL  19   5.210   7.783  -0.613
  126   HG13  VAL  19          3HG1      VAL  19   4.785   7.868  -2.324
  127   HG21  VAL  19          3HG2      VAL  19   3.483   6.899   1.032
  128   HG22  VAL  19          1HG2      VAL  19   3.350   5.445   0.043
  129   HG23  VAL  19          2HG2      VAL  19   1.909   6.392   0.418
  130    H    ARG  20           H        ARG  20   1.248   8.357  -2.862
  131    HA   ARG  20           HA       ARG  20   2.515   9.786  -4.904
  132    HB2  ARG  20           2HB      ARG  20  -0.253   8.781  -4.441
  133    HB3  ARG  20           1HB      ARG  20   0.074   9.678  -5.897
  134    HG2  ARG  20           2HG      ARG  20   1.522   7.177  -5.028
  135    HG3  ARG  20           1HG      ARG  20   0.155   7.218  -6.146
  136    HD2  ARG  20           2HD      ARG  20   2.737   8.704  -6.614
  137    HD3  ARG  20           1HD      ARG  20   2.414   7.089  -7.240
  138    HE   ARG  20           HE       ARG  20   0.312   8.374  -8.153
  139   HH11  ARG  20          1HH1      ARG  20   3.683   9.509  -8.153
  140   HH12  ARG  20          2HH1      ARG  20   3.559  10.314  -9.644
  141   HH21  ARG  20          1HH2      ARG  20   0.183   9.471 -10.260
  142   HH22  ARG  20          2HH2      ARG  20   1.550  10.255 -10.879
  143    H    CYS  21           H        CYS  21   0.808  10.928  -2.280
  144    HA   CYS  21           HA       CYS  21   0.348  13.537  -3.559
  145    HB2  CYS  21           2HB      CYS  21  -1.633  12.783  -2.449
  146    HB3  CYS  21           1HB      CYS  21  -0.733  12.352  -1.004
  147    H    PHE  22           H        PHE  22   2.242  11.830  -1.258
  148    HA   PHE  22           HA       PHE  22   2.896  13.911   0.523
  149    HB2  PHE  22           2HB      PHE  22   3.020  11.388   0.848
  150    HB3  PHE  22           1HB      PHE  22   4.507  11.470  -0.090
  151    HD1  PHE  22           1HD      PHE  22   6.478  12.576   0.821
  152    HD2  PHE  22           2HD      PHE  22   2.923  12.105   3.085
  153    HE1  PHE  22           1HE      PHE  22   7.744  13.038   2.853
  154    HE2  PHE  22           2HE      PHE  22   4.148  12.566   5.146
  155    HZ   PHE  22           HZ       PHE  22   6.580  13.040   5.057
  156    H    ILE  23           H        ILE  23   4.826  12.282  -1.978
  157    HA   ILE  23           HA       ILE  23   7.015  14.066  -1.713
  158    HB   ILE  23           HB       ILE  23   6.379  12.252  -4.070
  159   HG12  ILE  23          2HG1      ILE  23   6.394  10.999  -1.938
  160   HG13  ILE  23          1HG1      ILE  23   7.748  10.554  -2.965
  161   HG21  ILE  23          1HG2      ILE  23   8.807  12.276  -4.464
  162   HG22  ILE  23          2HG2      ILE  23   9.004  13.360  -3.085
  163   HG23  ILE  23          3HG2      ILE  23   8.141  13.917  -4.520
  164   HD11  ILE  23          3HD1      ILE  23   7.892  12.423  -0.603
  165   HD12  ILE  23          1HD1      ILE  23   9.242  11.911  -1.607
  166   HD13  ILE  23          2HD1      ILE  23   8.390  10.732  -0.608
  167    H    GLU  24           H        GLU  24   4.152  14.088  -3.612
  168    HA   GLU  24           HA       GLU  24   4.959  16.071  -5.505
  169    HB2  GLU  24           2HB      GLU  24   2.157  15.323  -4.689
  170    HB3  GLU  24           1HB      GLU  24   2.699  16.055  -6.198
  171    HG2  GLU  24           2HG      GLU  24   3.467  13.374  -5.237
  172    HG3  GLU  24           1HG      GLU  24   2.137  13.656  -6.355
  173    H    CYS  25           H        CYS  25   3.369  15.998  -2.429
  174    HA   CYS  25           HA       CYS  25   2.520  18.695  -2.319
  175    HB2  CYS  25           2HB      CYS  25   1.746  16.850  -0.763
  176    HB3  CYS  25           1HB      CYS  25   3.297  16.969   0.052
  177    H    LEU  26           H        LEU  26   5.551  17.106  -1.566
  178    HA   LEU  26           HA       LEU  26   6.815  19.466  -0.560
  179    HB2  LEU  26           2HB      LEU  26   7.862  16.783  -1.402
  180    HB3  LEU  26           1HB      LEU  26   8.970  18.106  -1.138
  181    HG   LEU  26           HG       LEU  26   8.924  16.689   0.798
  182   HD11  LEU  26          1HD1      LEU  26   7.515  19.274   1.379
  183   HD12  LEU  26          2HD1      LEU  26   9.251  19.036   1.197
  184   HD13  LEU  26          3HD1      LEU  26   8.395  18.283   2.541
  185   HD21  LEU  26          3HD2      LEU  26   5.966  17.241   0.967
  186   HD22  LEU  26          1HD2      LEU  26   6.923  16.386   2.177
  187   HD23  LEU  26          2HD2      LEU  26   6.715  15.696   0.566
  188    H    LYS  27           H        LYS  27   5.892  18.640  -3.617
  189    HA   LYS  27           HA       LYS  27   7.996  20.224  -4.896
  190    HB2  LYS  27           2HB      LYS  27   5.705  18.645  -6.095
  191    HB3  LYS  27           1HB      LYS  27   6.917  19.523  -7.019
  192    HG2  LYS  27           2HG      LYS  27   8.651  18.052  -6.252
  193    HG3  LYS  27           1HG      LYS  27   7.537  17.255  -5.142
  194    HD2  LYS  27           2HD      LYS  27   6.205  16.485  -7.076
  195    HD3  LYS  27           1HD      LYS  27   7.367  17.255  -8.152
  196    HE2  LYS  27           2HE      LYS  27   9.113  15.796  -7.437
  197    HE3  LYS  27           1HE      LYS  27   8.105  15.132  -6.152
  198    HZ1  LYS  27           3HZ      LYS  27   8.227  13.655  -8.069
  199    HZ2  LYS  27           1HZ      LYS  27   7.561  14.859  -9.056
  200    HZ3  LYS  27           2HZ      LYS  27   6.652  14.202  -7.796
  201    H    GLY  28           H        GLY  28   4.480  20.038  -4.651
  202    HA2  GLY  28           2HA      GLY  28   3.522  22.241  -3.841
  203    HA3  GLY  28           1HA      GLY  28   4.311  22.946  -5.232
  204    H    ILE  29           H        ILE  29   1.848  20.680  -4.232
  205    HA   ILE  29           HA       ILE  29   0.502  21.448  -6.550
  206    HB   ILE  29           HB       ILE  29  -0.408  19.153  -6.878
  207   HG12  ILE  29          2HG1      ILE  29   1.158  17.234  -6.193
  208   HG13  ILE  29          1HG1      ILE  29   1.758  18.325  -4.949
  209   HG21  ILE  29          1HG2      ILE  29   2.506  19.439  -7.386
  210   HG22  ILE  29          2HG2      ILE  29   1.175  19.956  -8.428
  211   HG23  ILE  29          3HG2      ILE  29   1.467  18.234  -8.147
  212   HD11  ILE  29          3HD1      ILE  29  -0.567  18.449  -4.069
  213   HD12  ILE  29          1HD1      ILE  29   0.105  16.814  -4.036
  214   HD13  ILE  29          2HD1      ILE  29  -1.048  17.295  -5.286
  215    H    GLY  30           H        GLY  30  -1.178  21.908  -6.079
  216    HA2  GLY  30           2HA      GLY  30  -2.465  21.853  -3.540
  217    HA3  GLY  30           1HA      GLY  30  -3.309  22.229  -5.042
  218    H    HIS  31           H        HIS  31  -5.079  20.963  -5.032
  219    HA   HIS  31           HA       HIS  31  -4.829  18.212  -4.132
  220    HB2  HIS  31           2HB      HIS  31  -6.824  19.649  -3.485
  221    HB3  HIS  31           1HB      HIS  31  -7.326  19.580  -5.170
  222    HD1  HIS  31           1HD      HIS  31  -9.049  17.808  -5.576
  223    HD2  HIS  31           2HD      HIS  31  -6.552  16.890  -2.384
  224    HE1  HIS  31           1HE      HIS  31  -9.941  15.652  -4.567
  225    H    LYS  32           H        LYS  32  -3.481  17.520  -5.728
  226    HA   LYS  32           HA       LYS  32  -4.412  17.556  -8.488
  227    HB2  LYS  32           2HB      LYS  32  -2.037  18.021  -8.030
  228    HB3  LYS  32           1HB      LYS  32  -1.855  16.429  -7.315
  229    HG2  LYS  32           2HG      LYS  32  -0.935  16.486  -9.571
  230    HG3  LYS  32           1HG      LYS  32  -2.326  15.399  -9.493
  231    HD2  LYS  32           2HD      LYS  32  -3.747  17.173 -10.390
  232    HD3  LYS  32           1HD      LYS  32  -2.352  18.239 -10.483
  233    HE2  LYS  32           2HE      LYS  32  -1.307  16.714 -12.087
  234    HE3  LYS  32           1HE      LYS  32  -2.714  15.653 -11.986
  235    HZ1  LYS  32           3HZ      LYS  32  -4.082  17.477 -12.801
  236    HZ2  LYS  32           1HZ      LYS  32  -2.887  17.074 -13.907
  237    HZ3  LYS  32           2HZ      LYS  32  -2.724  18.462 -12.967
  238    H    TYR  33           H        TYR  33  -4.030  15.346  -5.866
  239    HA   TYR  33           HA       TYR  33  -4.979  13.162  -7.573
  240    HB2  TYR  33           2HB      TYR  33  -3.437  12.854  -4.946
  241    HB3  TYR  33           1HB      TYR  33  -3.935  11.603  -6.016
  242    HD1  TYR  33           1HD      TYR  33  -1.692  14.596  -5.914
  243    HD2  TYR  33           2HD      TYR  33  -2.581  10.887  -7.803
  244    HE1  TYR  33           1HE      TYR  33   0.361  14.782  -7.226
  245    HE2  TYR  33           2HE      TYR  33  -0.519  11.061  -9.102
  246    HH   TYR  33           HH       TYR  33   1.947  13.362  -8.516
  247    HA   PRO  34           HA       PRO  34  -8.908  13.224  -5.557
  248    HB2  PRO  34           2HB      PRO  34  -9.215  10.448  -5.259
  249    HB3  PRO  34           1HB      PRO  34  -9.685  11.397  -6.664
  250    HG2  PRO  34           2HG      PRO  34  -7.234   9.776  -6.225
  251    HG3  PRO  34           1HG      PRO  34  -8.171  10.032  -7.703
  252    HD2  PRO  34           2HD      PRO  34  -5.843  11.242  -7.323
  253    HD3  PRO  34           1HD      PRO  34  -7.194  12.086  -8.112
  254    H    PHE  35           H        PHE  35  -6.352  11.436  -4.122
  255    HA   PHE  35           HA       PHE  35  -7.658  11.451  -1.486
  256    HB2  PHE  35           2HB      PHE  35  -6.056   9.587  -0.976
  257    HB3  PHE  35           1HB      PHE  35  -7.270   9.228  -2.208
  258    HD1  PHE  35           2HD      PHE  35  -6.663   8.969  -4.493
  259    HD2  PHE  35           1HD      PHE  35  -3.718   9.795  -1.579
  260    HE1  PHE  35           2HE      PHE  35  -4.984   8.371  -6.095
  261    HE2  PHE  35           1HE      PHE  35  -1.955   9.161  -3.170
  262    HZ   PHE  35           HZ       PHE  35  -2.572   8.448  -5.467
  263    H    CYS  36           H        CYS  36  -5.929  13.490  -2.914
  264    HA   CYS  36           HA       CYS  36  -3.535  13.340  -1.318
  265    HB2  CYS  36           2HB      CYS  36  -3.126  13.869  -3.513
  266    HB3  CYS  36           1HB      CYS  36  -4.252  15.216  -3.591
  267    H    HIS  37           H        HIS  37  -3.355  14.064   0.525
  268    HA   HIS  37           HA       HIS  37  -5.277  15.739   1.787
  269    HB2  HIS  37           2HB      HIS  37  -3.824  15.380   3.776
  270    HB3  HIS  37           1HB      HIS  37  -4.374  13.895   3.016
  271    HD1  HIS  37           1HD      HIS  37  -2.537  12.169   2.858
  272    HD2  HIS  37           2HD      HIS  37  -1.032  16.046   2.770
  273    HE1  HIS  37           1HE      HIS  37  -0.022  11.956   2.681
  274    H    CYS  38           H        CYS  38  -2.695  16.560  -0.135
  275    HA   CYS  38           HA       CYS  38  -1.434  18.503   1.487
  276    HB2  CYS  38           2HB      CYS  38  -0.380  17.368  -0.505
  277    HB3  CYS  38           1HB      CYS  38  -1.388  18.378  -1.532
  278    H    ARG  39           H        ARG  39  -1.632  20.696   1.510
  279    HA   ARG  39           HA       ARG  39  -3.899  21.897   0.166
  280    HB2  ARG  39           2HB      ARG  39  -4.733  22.843   2.299
  281    HB3  ARG  39           1HB      ARG  39  -4.886  21.096   2.207
  282    HG2  ARG  39           2HG      ARG  39  -2.832  20.901   3.570
  283    HG3  ARG  39           1HG      ARG  39  -2.825  22.654   3.754
  284    HD2  ARG  39           2HD      ARG  39  -5.055  22.533   4.779
  285    HD3  ARG  39           1HD      ARG  39  -5.022  20.779   4.622
  286    HE   ARG  39           HE       ARG  39  -3.066  22.281   6.209
  287   HH11  ARG  39          1HH1      ARG  39  -5.255  19.492   5.890
  288   HH12  ARG  39          2HH1      ARG  39  -4.969  18.905   7.441
  289   HH21  ARG  39          1HH2      ARG  39  -2.664  21.452   8.363
  290   HH22  ARG  39          2HH2      ARG  39  -3.432  20.027   8.877
  Start of MODEL   20
    1    H1   HIS   1           H        HIS   1   8.147  11.296 -10.795
    2    HA   HIS   1           HA       HIS   1   8.446   8.661 -10.310
    3    HB2  HIS   1           2HB      HIS   1  11.151  10.023 -10.001
    4    HB3  HIS   1           1HB      HIS   1  10.768   8.362  -9.593
    5    HD1  HIS   1           1HD      HIS   1  12.249  10.372 -12.208
    6    HD2  HIS   1           2HD      HIS   1  10.138   6.790 -12.037
    7    HE1  HIS   1           1HE      HIS   1  12.733   9.183 -14.367
    8    H    GLY   2           H        GLY   2  10.246  11.444  -9.102
    9    HA2  GLY   2           2HA      GLY   2   9.288  12.879  -7.440
   10    HA3  GLY   2           1HA      GLY   2   8.604  11.445  -6.671
   11    H    GLU   3           H        GLU   3  10.183  13.304  -5.386
   12    HA   GLU   3           HA       GLU   3  12.826  12.177  -5.134
   13    HB2  GLU   3           2HB      GLU   3  12.519  14.626  -5.064
   14    HB3  GLU   3           1HB      GLU   3  11.491  14.457  -3.656
   15    HG2  GLU   3           2HG      GLU   3  13.369  13.646  -2.359
   16    HG3  GLU   3           1HG      GLU   3  14.406  13.742  -3.784
   17    H    GLY   4           H        GLY   4  12.366  10.178  -4.407
   18    HA2  GLY   4           2HA      GLY   4  12.585   9.421  -1.918
   19    HA3  GLY   4           1HA      GLY   4  10.865   9.822  -1.964
   20    H    THR   5           H        THR   5  11.924   7.232  -1.532
   21    HA   THR   5           HA       THR   5  11.200   5.945  -4.047
   22    HB   THR   5           HB       THR   5  12.821   4.789  -1.767
   23    HG1  THR   5           1HG      THR   5  13.504   6.038  -4.204
   24   HG21  THR   5          3HG2      THR   5  11.681   3.102  -3.157
   25   HG22  THR   5          1HG2      THR   5  13.422   3.067  -3.434
   26   HG23  THR   5          2HG2      THR   5  12.355   3.835  -4.609
   27    H    PHE   6           H        PHE   6   9.117   5.445  -3.979
   28    HA   PHE   6           HA       PHE   6   8.255   3.858  -1.731
   29    HB2  PHE   6           2HB      PHE   6   5.852   4.431  -2.439
   30    HB3  PHE   6           1HB      PHE   6   6.770   5.717  -1.685
   31    HD1  PHE   6           1HD      PHE   6   7.495   7.650  -2.999
   32    HD2  PHE   6           2HD      PHE   6   5.123   4.566  -4.712
   33    HE1  PHE   6           1HE      PHE   6   6.913   9.142  -4.860
   34    HE2  PHE   6           2HE      PHE   6   4.543   6.063  -6.585
   35    HZ   PHE   6           HZ       PHE   6   5.435   8.343  -6.651
   36    H    THR   7           H        THR   7   8.404   1.907  -2.149
   37    HA   THR   7           HA       THR   7   8.035   0.908  -4.847
   38    HB   THR   7           HB       THR   7  10.422   1.265  -4.574
   39    HG1  THR   7           1HG      THR   7  10.807  -0.549  -5.471
   40   HG21  THR   7          3HG2      THR   7  10.579   1.249  -2.138
   41   HG22  THR   7          1HG2      THR   7  11.721   0.103  -2.842
   42   HG23  THR   7          2HG2      THR   7  10.222  -0.476  -2.115
   43    H    SER   8           H        SER   8   7.581  -1.254  -4.971
   44    HA   SER   8           HA       SER   8   5.765  -2.468  -3.362
   45    HB2  SER   8           2HB      SER   8   7.867  -3.681  -5.150
   46    HB3  SER   8           1HB      SER   8   6.358  -4.452  -4.660
   47    HG   SER   8           HG       SER   8   5.235  -2.832  -5.678
   48    H    ASP   9           H        ASP   9   6.815  -5.129  -2.910
   49    HA   ASP   9           HA       ASP   9   7.634  -4.954  -0.223
   50    HB2  ASP   9           2HB      ASP   9   7.539  -7.299  -2.095
   51    HB3  ASP   9           1HB      ASP   9   7.992  -7.448  -0.402
   52    H    LEU  10           H        LEU  10   9.502  -4.142  -2.541
   53    HA   LEU  10           HA       LEU  10  12.033  -5.299  -2.151
   54    HB2  LEU  10           2HB      LEU  10  11.202  -3.843  -4.061
   55    HB3  LEU  10           1HB      LEU  10  11.273  -2.475  -3.001
   56    HG   LEU  10           HG       LEU  10  13.706  -4.080  -3.844
   57   HD11  LEU  10          1HD1      LEU  10  12.653  -3.078  -5.776
   58   HD12  LEU  10          2HD1      LEU  10  14.139  -2.213  -5.376
   59   HD13  LEU  10          3HD1      LEU  10  12.576  -1.522  -4.952
   60   HD21  LEU  10          3HD2      LEU  10  13.989  -2.771  -1.773
   61   HD22  LEU  10          1HD2      LEU  10  13.474  -1.319  -2.628
   62   HD23  LEU  10          2HD2      LEU  10  14.970  -2.134  -3.094
   63    H    SER  11           H        SER  11  10.361  -2.478  -0.688
   64    HA   SER  11           HA       SER  11  12.409  -2.392   1.398
   65    HB2  SER  11           2HB      SER  11  11.203  -0.225   1.975
   66    HB3  SER  11           1HB      SER  11  12.005  -0.251   0.399
   67    HG   SER  11           HG       SER  11   9.917   0.569   0.230
   68    H    LYS  12           H        LYS  12   9.560  -3.719   0.682
   69    HA   LYS  12           HA       LYS  12   7.856  -4.775   1.641
   70    HB2  LYS  12           2HB      LYS  12   8.268  -6.185   3.496
   71    HB3  LYS  12           1HB      LYS  12   9.595  -6.198   2.333
   72    HG2  LYS  12           2HG      LYS  12  10.948  -4.862   3.847
   73    HG3  LYS  12           1HG      LYS  12   9.597  -4.751   4.981
   74    HD2  LYS  12           2HD      LYS  12   9.610  -7.169   5.232
   75    HD3  LYS  12           1HD      LYS  12  10.952  -7.277   4.098
   76    HE2  LYS  12           2HE      LYS  12  11.021  -5.797   6.731
   77    HE3  LYS  12           1HE      LYS  12  11.665  -7.415   6.469
   78    HZ1  LYS  12           3HZ      LYS  12  13.247  -6.515   4.903
   79    HZ2  LYS  12           1HZ      LYS  12  13.379  -5.719   6.374
   80    HZ3  LYS  12           2HZ      LYS  12  12.634  -4.962   5.066
   81    H    GLN  13           H        GLN  13   8.077  -2.018   2.342
   82    HA   GLN  13           HA       GLN  13   6.431  -1.887   4.737
   83    HB2  GLN  13           2HB      GLN  13   7.273   0.290   2.789
   84    HB3  GLN  13           1HB      GLN  13   6.264   0.564   4.188
   85    HG2  GLN  13           2HG      GLN  13   8.132  -0.165   5.627
   86    HG3  GLN  13           1HG      GLN  13   9.132  -0.335   4.183
   87   HE21  GLN  13          1HE2      GLN  13  10.575   1.272   4.970
   88   HE22  GLN  13          2HE2      GLN  13  10.118   2.935   4.932
   89    H    MET  14           H        MET  14   4.455  -0.177   4.143
   90    HA   MET  14           HA       MET  14   2.845  -1.741   2.345
   91    HB2  MET  14           2HB      MET  14   1.866  -0.983   4.457
   92    HB3  MET  14           1HB      MET  14   2.150   0.691   4.002
   93    HG2  MET  14           2HG      MET  14  -0.175   0.118   3.676
   94    HG3  MET  14           1HG      MET  14   0.618   0.451   2.140
   95    HE1  MET  14           3HE      MET  14  -2.208  -0.929   2.418
   96    HE2  MET  14           1HE      MET  14  -2.086  -2.233   1.235
   97    HE3  MET  14           2HE      MET  14  -1.444  -0.637   0.856
   98    H    GLU  15           H        GLU  15   2.601  -1.323   0.327
   99    HA   GLU  15           HA       GLU  15   3.586   1.148  -0.861
  100    HB2  GLU  15           2HB      GLU  15   3.840  -1.430  -1.616
  101    HB3  GLU  15           1HB      GLU  15   2.298  -1.104  -2.374
  102    HG2  GLU  15           2HG      GLU  15   4.865   0.373  -2.925
  103    HG3  GLU  15           1HG      GLU  15   4.204  -0.919  -3.908
  104    H    GLU  16           H        GLU  16   2.004   2.681  -0.383
  105    HA   GLU  16           HA       GLU  16  -0.765   2.036  -1.101
  106    HB2  GLU  16           2HB      GLU  16  -1.518   3.214   0.952
  107    HB3  GLU  16           1HB      GLU  16  -0.674   1.709   1.272
  108    HG2  GLU  16           2HG      GLU  16   1.351   2.951   1.840
  109    HG3  GLU  16           1HG      GLU  16   0.543   4.465   1.452
  110    H    GLU  17           H        GLU  17  -2.129   4.173  -0.716
  111    HA   GLU  17           HA       GLU  17  -1.026   6.194  -2.387
  112    HB2  GLU  17           2HB      GLU  17  -3.725   5.512  -1.232
  113    HB3  GLU  17           1HB      GLU  17  -3.424   7.056  -2.002
  114    HG2  GLU  17           2HG      GLU  17  -4.498   5.436  -3.505
  115    HG3  GLU  17           1HG      GLU  17  -2.938   5.981  -4.100
  116    H    ALA  18           H        ALA  18  -2.292   8.180  -1.407
  117    HA   ALA  18           HA       ALA  18  -1.725  10.161  -0.325
  118    HB1  ALA  18           1HB      ALA  18  -1.551  10.133   2.102
  119    HB2  ALA  18           2HB      ALA  18  -1.346   8.384   2.092
  120    HB3  ALA  18           3HB      ALA  18  -2.880   9.095   1.577
  121    H    VAL  19           H        VAL  19   0.494   7.954  -0.986
  122    HA   VAL  19           HA       VAL  19   2.772   9.589  -0.124
  123    HB   VAL  19           HB       VAL  19   2.772   6.894  -1.529
  124   HG11  VAL  19          1HG1      VAL  19   5.089   6.742  -0.746
  125   HG12  VAL  19          2HG1      VAL  19   4.951   8.379  -0.088
  126   HG13  VAL  19          3HG1      VAL  19   4.811   8.109  -1.828
  127   HG21  VAL  19          3HG2      VAL  19   1.708   6.650   0.639
  128   HG22  VAL  19          1HG2      VAL  19   3.075   7.448   1.417
  129   HG23  VAL  19          2HG2      VAL  19   3.296   5.879   0.640
  130    H    ARG  20           H        ARG  20   0.745   8.675  -2.638
  131    HA   ARG  20           HA       ARG  20   2.297   8.968  -4.973
  132    HB2  ARG  20           2HB      ARG  20  -0.648   9.445  -4.595
  133    HB3  ARG  20           1HB      ARG  20   0.160   9.076  -6.133
  134    HG2  ARG  20           2HG      ARG  20  -0.165   7.327  -3.725
  135    HG3  ARG  20           1HG      ARG  20  -1.148   7.247  -5.180
  136    HD2  ARG  20           2HD      ARG  20   0.868   6.637  -6.442
  137    HD3  ARG  20           1HD      ARG  20   1.794   6.653  -4.931
  138    HE   ARG  20           HE       ARG  20  -0.594   4.993  -5.017
  139   HH11  ARG  20          1HH1      ARG  20   2.923   5.006  -5.322
  140   HH12  ARG  20          2HH1      ARG  20   3.038   3.364  -4.796
  141   HH21  ARG  20          1HH2      ARG  20  -0.394   2.907  -4.390
  142   HH22  ARG  20          2HH2      ARG  20   1.145   2.108  -4.339
  143    H    CYS  21           H        CYS  21   0.493  11.266  -3.006
  144    HA   CYS  21           HA       CYS  21   1.141  13.432  -4.864
  145    HB2  CYS  21           2HB      CYS  21  -1.259  13.069  -4.319
  146    HB3  CYS  21           1HB      CYS  21  -0.919  13.376  -2.632
  147    H    PHE  22           H        PHE  22   2.404  11.990  -2.232
  148    HA   PHE  22           HA       PHE  22   2.508  14.088  -0.326
  149    HB2  PHE  22           2HB      PHE  22   2.657  11.683   0.232
  150    HB3  PHE  22           1HB      PHE  22   4.263  11.635  -0.477
  151    HD1  PHE  22           1HD      PHE  22   2.223  12.753   2.304
  152    HD2  PHE  22           2HD      PHE  22   6.157  12.674   0.685
  153    HE1  PHE  22           1HE      PHE  22   3.109  13.397   4.472
  154    HE2  PHE  22           2HE      PHE  22   7.070  13.340   2.863
  155    HZ   PHE  22           HZ       PHE  22   5.554  13.706   4.771
  156    H    ILE  23           H        ILE  23   4.966  12.791  -2.535
  157    HA   ILE  23           HA       ILE  23   6.818  14.827  -1.722
  158    HB   ILE  23           HB       ILE  23   7.122  12.840  -4.015
  159   HG12  ILE  23          2HG1      ILE  23   8.816  11.797  -2.333
  160   HG13  ILE  23          1HG1      ILE  23   7.903  12.702  -1.127
  161   HG21  ILE  23          1HG2      ILE  23   9.506  13.360  -3.810
  162   HG22  ILE  23          2HG2      ILE  23   9.121  14.579  -2.598
  163   HG23  ILE  23          3HG2      ILE  23   8.551  14.776  -4.256
  164   HD11  ILE  23          3HD1      ILE  23   5.900  11.440  -1.692
  165   HD12  ILE  23          1HD1      ILE  23   7.216  10.367  -1.219
  166   HD13  ILE  23          2HD1      ILE  23   6.799  10.551  -2.921
  167    H    GLU  24           H        GLU  24   4.605  14.212  -4.213
  168    HA   GLU  24           HA       GLU  24   5.270  16.240  -6.066
  169    HB2  GLU  24           2HB      GLU  24   2.474  15.422  -5.251
  170    HB3  GLU  24           1HB      GLU  24   2.930  16.208  -6.754
  171    HG2  GLU  24           2HG      GLU  24   3.568  13.457  -5.836
  172    HG3  GLU  24           1HG      GLU  24   2.450  13.900  -7.109
  173    H    CYS  25           H        CYS  25   3.172  16.259  -3.252
  174    HA   CYS  25           HA       CYS  25   2.669  19.061  -3.299
  175    HB2  CYS  25           2HB      CYS  25   1.121  17.455  -2.272
  176    HB3  CYS  25           1HB      CYS  25   2.295  17.121  -1.005
  177    H    LEU  26           H        LEU  26   5.274  17.180  -2.122
  178    HA   LEU  26           HA       LEU  26   6.288  18.982  -0.183
  179    HB2  LEU  26           2HB      LEU  26   7.049  16.646  -0.372
  180    HB3  LEU  26           1HB      LEU  26   7.711  16.977  -1.953
  181    HG   LEU  26           HG       LEU  26   9.406  18.448  -0.914
  182   HD11  LEU  26          1HD1      LEU  26   9.711  18.387   1.515
  183   HD12  LEU  26          2HD1      LEU  26   8.188  17.510   1.678
  184   HD13  LEU  26          3HD1      LEU  26   8.201  19.161   1.049
  185   HD21  LEU  26          3HD2      LEU  26   9.941  16.126  -1.345
  186   HD22  LEU  26          1HD2      LEU  26   9.244  15.657   0.209
  187   HD23  LEU  26          2HD2      LEU  26  10.692  16.658   0.158
  188    H    LYS  27           H        LYS  27   6.310  18.844  -3.619
  189    HA   LYS  27           HA       LYS  27   8.159  21.032  -3.963
  190    HB2  LYS  27           2HB      LYS  27   6.238  19.681  -5.869
  191    HB3  LYS  27           1HB      LYS  27   7.266  21.027  -6.333
  192    HG2  LYS  27           2HG      LYS  27   9.241  19.715  -5.917
  193    HG3  LYS  27           1HG      LYS  27   8.260  18.388  -5.290
  194    HD2  LYS  27           2HD      LYS  27   7.267  18.024  -7.436
  195    HD3  LYS  27           1HD      LYS  27   8.025  19.475  -8.089
  196    HE2  LYS  27           2HE      LYS  27   9.154  17.374  -8.766
  197    HE3  LYS  27           1HE      LYS  27  10.198  18.497  -7.902
  198    HZ1  LYS  27           3HZ      LYS  27  10.430  16.167  -7.199
  199    HZ2  LYS  27           1HZ      LYS  27   8.847  16.171  -6.636
  200    HZ3  LYS  27           2HZ      LYS  27  10.021  17.172  -5.936
  201    H    GLY  28           H        GLY  28   4.703  20.659  -4.760
  202    HA2  GLY  28           2HA      GLY  28   3.533  22.528  -3.256
  203    HA3  GLY  28           1HA      GLY  28   4.335  23.532  -4.444
  204    H    ILE  29           H        ILE  29   2.140  20.751  -4.209
  205    HA   ILE  29           HA       ILE  29   0.570  22.019  -6.152
  206    HB   ILE  29           HB       ILE  29   0.045  19.808  -7.314
  207   HG12  ILE  29          2HG1      ILE  29   2.020  18.134  -7.231
  208   HG13  ILE  29          1HG1      ILE  29   2.324  18.830  -5.644
  209   HG21  ILE  29          1HG2      ILE  29   1.432  21.388  -8.431
  210   HG22  ILE  29          2HG2      ILE  29   2.010  19.748  -8.759
  211   HG23  ILE  29          3HG2      ILE  29   2.851  20.771  -7.587
  212   HD11  ILE  29          3HD1      ILE  29  -0.027  18.335  -5.090
  213   HD12  ILE  29          1HD1      ILE  29   0.978  16.889  -5.343
  214   HD13  ILE  29          2HD1      ILE  29  -0.130  17.439  -6.606
  215    H    GLY  30           H        GLY  30  -1.023  22.318  -5.306
  216    HA2  GLY  30           2HA      GLY  30  -1.937  20.924  -2.922
  217    HA3  GLY  30           1HA      GLY  30  -2.658  22.405  -3.547
  218    H    HIS  31           H        HIS  31  -3.070  19.192  -3.050
  219    HA   HIS  31           HA       HIS  31  -4.600  17.635  -3.629
  220    HB2  HIS  31           2HB      HIS  31  -6.063  19.308  -2.609
  221    HB3  HIS  31           1HB      HIS  31  -6.239  20.129  -4.146
  222    HD1  HIS  31           1HD      HIS  31  -8.667  19.834  -4.721
  223    HD2  HIS  31           2HD      HIS  31  -6.964  16.324  -3.284
  224    HE1  HIS  31           1HE      HIS  31 -10.447  18.095  -4.894
  225    H    LYS  32           H        LYS  32  -3.176  17.081  -5.404
  226    HA   LYS  32           HA       LYS  32  -4.237  17.703  -8.073
  227    HB2  LYS  32           2HB      LYS  32  -1.832  17.981  -7.665
  228    HB3  LYS  32           1HB      LYS  32  -1.710  16.277  -7.254
  229    HG2  LYS  32           2HG      LYS  32  -2.228  15.649  -9.509
  230    HG3  LYS  32           1HG      LYS  32  -2.535  17.328  -9.951
  231    HD2  LYS  32           2HD      LYS  32  -0.187  17.869  -9.409
  232    HD3  LYS  32           1HD      LYS  32   0.098  16.169  -9.036
  233    HE2  LYS  32           2HE      LYS  32   0.874  16.706 -11.284
  234    HE3  LYS  32           1HE      LYS  32  -0.473  15.575 -11.338
  235    HZ1  LYS  32           3HZ      LYS  32  -1.938  17.415 -11.870
  236    HZ2  LYS  32           1HZ      LYS  32  -0.708  17.285 -12.997
  237    HZ3  LYS  32           2HZ      LYS  32  -0.651  18.494 -11.833
  238    H    TYR  33           H        TYR  33  -4.245  15.284  -5.754
  239    HA   TYR  33           HA       TYR  33  -5.222  13.262  -7.666
  240    HB2  TYR  33           2HB      TYR  33  -3.769  12.825  -5.041
  241    HB3  TYR  33           1HB      TYR  33  -4.451  11.564  -6.032
  242    HD1  TYR  33           2HD      TYR  33  -2.006  14.368  -6.288
  243    HD2  TYR  33           1HD      TYR  33  -3.044  10.429  -7.446
  244    HE1  TYR  33           2HE      TYR  33   0.129  14.189  -7.386
  245    HE2  TYR  33           1HE      TYR  33  -0.886  10.168  -8.550
  246    HH   TYR  33           HH       TYR  33   1.682  12.078  -7.938
  247    HA   PRO  34           HA       PRO  34  -9.142  13.301  -5.574
  248    HB2  PRO  34           2HB      PRO  34  -9.416  10.522  -5.160
  249    HB3  PRO  34           1HB      PRO  34  -9.946  11.416  -6.582
  250    HG2  PRO  34           2HG      PRO  34  -7.448   9.869  -6.157
  251    HG3  PRO  34           1HG      PRO  34  -8.448  10.029  -7.611
  252    HD2  PRO  34           2HD      PRO  34  -6.153  11.314  -7.404
  253    HD3  PRO  34           1HD      PRO  34  -7.571  12.110  -8.127
  254    H    PHE  35           H        PHE  35  -6.694  11.243  -4.194
  255    HA   PHE  35           HA       PHE  35  -7.872  11.409  -1.525
  256    HB2  PHE  35           2HB      PHE  35  -6.175   9.609  -1.024
  257    HB3  PHE  35           1HB      PHE  35  -7.426   9.192  -2.194
  258    HD1  PHE  35           2HD      PHE  35  -3.873   9.962  -1.758
  259    HD2  PHE  35           1HD      PHE  35  -6.915   8.834  -4.491
  260    HE1  PHE  35           2HE      PHE  35  -2.176   9.434  -3.419
  261    HE2  PHE  35           1HE      PHE  35  -5.270   8.313  -6.163
  262    HZ   PHE  35           HZ       PHE  35  -2.858   8.592  -5.668
  263    H    CYS  36           H        CYS  36  -6.047  13.403  -3.089
  264    HA   CYS  36           HA       CYS  36  -3.802  13.515  -1.244
  265    HB2  CYS  36           2HB      CYS  36  -3.256  13.864  -3.543
  266    HB3  CYS  36           1HB      CYS  36  -4.430  15.173  -3.696
  267    H    HIS  37           H        HIS  37  -4.149  14.411   0.604
  268    HA   HIS  37           HA       HIS  37  -6.081  16.574   0.769
  269    HB2  HIS  37           2HB      HIS  37  -4.968  14.713   2.858
  270    HB3  HIS  37           1HB      HIS  37  -5.899  16.149   3.269
  271    HD1  HIS  37           1HD      HIS  37  -8.350  15.698   3.557
  272    HD2  HIS  37           2HD      HIS  37  -6.545  12.957   1.004
  273    HE1  HIS  37           1HE      HIS  37 -10.152  14.059   2.909
  274    H    CYS  38           H        CYS  38  -3.013  16.398   0.139
  275    HA   CYS  38           HA       CYS  38  -2.048  18.343   2.056
  276    HB2  CYS  38           2HB      CYS  38  -0.588  16.454   1.307
  277    HB3  CYS  38           1HB      CYS  38  -0.645  17.105  -0.324
  278    H    ARG  39           H        ARG  39  -2.090  20.478   1.686
  279    HA   ARG  39           HA       ARG  39  -2.056  21.510  -1.026
  280    HB2  ARG  39           2HB      ARG  39  -4.119  22.340   1.028
  281    HB3  ARG  39           1HB      ARG  39  -3.778  23.155  -0.496
  282    HG2  ARG  39           2HG      ARG  39  -4.536  21.193  -1.732
  283    HG3  ARG  39           1HG      ARG  39  -4.856  20.355  -0.215
  284    HD2  ARG  39           2HD      ARG  39  -6.183  22.914  -1.108
  285    HD3  ARG  39           1HD      ARG  39  -6.898  21.308  -1.231
  286    HE   ARG  39           HE       ARG  39  -6.101  21.876   1.429
  287   HH11  ARG  39          1HH1      ARG  39  -8.636  22.663  -0.898
  288   HH12  ARG  39          2HH1      ARG  39  -9.839  22.940   0.264
  289   HH21  ARG  39          1HH2      ARG  39  -7.739  22.237   3.042
  290   HH22  ARG  39          2HH2      ARG  39  -9.318  22.682   2.590