*HEADER    METAL BINDING PROTEIN                   30-OCT-13   2MG9              
*TITLE     TRUNCATED EGF-A                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: LOW-DENSITY LIPOPROTEIN RECEPTOR;                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: EGF-A DOMAIN, UNP RESIDUES 314-339;                        
*COMPND   5 SYNONYM: LDL RECEPTOR;                                               
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606;                                                
*SOURCE   6 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED.               
*KEYWDS    EGF-A, DISULFIDE RICH, METAL BINDING PROTEIN                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.I.SCHROEDER, K.ROSENGREN                                            
*REVDAT   1   02-APR-14 2MG9    0                                                


!Distance restraints
assign (resid    2 and name O    ) (resid   27 and name XX   )    3.00    0.60    0.00
assign (resid   19 and name O    ) (resid   27 and name XX   )    3.00    0.60    0.00
assign (resid   22 and name O    ) (resid   27 and name XX   )    3.00    0.60    0.00
assign (resid   18 and name OD1  ) (resid   27 and name XX   )    3.00    0.60    0.00
assign (resid   18 and name OD2  ) (resid   27 and name XX   )    4.00    0.00    1.00
assign (resid    4 and name OE1  ) (resid   27 and name XX   )    3.00    0.60    0.00
assign (resid    4 and name OE2  ) (resid   27 and name XX   )    3.50    0.00    1.00
assign (resid   15 and name HN   ) (resid   15 and name HB   )    2.65    2.65    0.00
assign (resid   14 and name HB2  ) (resid   15 and name HN   )    3.09    3.09    0.00 !added 0.5
assign (resid   14 and name HB1  ) (resid   15 and name HN   )    3.09    3.09    0.00 !added 0.5
assign (resid   15 and name HA   ) (resid   16 and name HN   )    2.40    2.40    0.00
assign (resid   16 and name HB1  ) (resid   17 and name HN   )    3.83    3.83    0.00
assign (resid   16 and name HA   ) (resid   25 and name HA   )    2.93    2.93    0.00
assign (resid   16 and name HA   ) (resid   17 and name HN   )    2.46    2.46    0.00
assign (resid   17 and name HA   ) (resid   18 and name HN   )    2.40    2.40    0.00
assign (resid   17 and name HB2  ) (resid   18 and name HN   )    4.38    4.38    0.00
assign (resid   18 and name HA   ) (resid   19 and name HN   )    2.43    2.43    0.00
assign (resid   18 and name HB1  ) (resid   19 and name HN   )    4.50    4.50    0.00 !4.42
assign (resid   18 and name HB2  ) (resid   19 and name HN   )    4.50    4.50    0.00 !4.07
assign (resid   19 and name HB2  ) (resid   23 and name HA   )    4.14    4.14    0.00
assign (resid   19 and name HB1  ) (resid   23 and name HA   )    4.20    4.20    0.00
assign (resid   19 and name HB2  ) (resid   21 and name HN   )    3.33    3.33    0.00
assign (resid   24 and name HA   ) (resid   25 and name HN   )    2.77    2.77    0.00
assign (resid   23 and name HB1  ) (resid   24 and name HN   )    3.92    3.92    0.00
assign (resid   25 and name HB2  ) (resid   26 and name HN   )    4.17    4.17    0.00
assign (resid   24 and name HB#  ) (resid   25 and name HN   )    4.95    4.95    0.00
assign (resid   25 and name HA   ) (resid   26 and name HN   )    2.49    2.49    0.00
assign (resid   17 and name HN   ) (resid   25 and name HA   )    3.73    3.73    0.00
assign (resid   16 and name HA   ) (resid   26 and name HN   )    3.73    3.73    0.00
assign (resid   23 and name HB2  ) (resid   24 and name HN   )    3.92    3.92    0.00
assign (resid   22 and name HA1  ) (resid   23 and name HN   )    2.56    2.56    0.00
assign (resid   22 and name HA2  ) (resid   23 and name HN   )    3.02    3.02    0.00
assign (resid   21 and name HA   ) (resid   22 and name HN   )    2.40    2.40    0.00
assign (resid   11 and name HA1  ) (resid   12 and name HN   )    3.45    3.45    0.00
assign (resid   11 and name HA2  ) (resid   12 and name HN   )    3.45    3.45    0.00
assign (resid   10 and name HA2  ) (resid   11 and name HN   )    3.39    3.39    0.00
assign (resid   10 and name HA1  ) (resid   11 and name HN   )    3.39    3.39    0.00
assign (resid    8 and name HA   ) (resid    9 and name HN   )    2.87    2.87    0.00
assign (resid    4 and name HA   ) (resid    5 and name HN   )    3.52    3.52    0.00
assign (resid    3 and name HB2  ) (resid    4 and name HN   )    4.54    4.54    0.00
assign (resid    3 and name HB1  ) (resid    4 and name HN   )    4.45    4.45    0.00
assign (resid    8 and name HB2  ) (resid    9 and name HN   )    4.17    4.17    0.00
assign (resid    3 and name HA   ) (resid    5 and name HN   )    3.67    3.67    0.00
assign (resid    3 and name HA   ) (resid    4 and name HN   )    2.49    2.49    0.00
assign (resid   11 and name HN   ) (resid   12 and name HN   )    2.77    2.77    0.00
assign (resid    9 and name HN   ) (resid   10 and name HN   )    3.17    3.17    0.00
assign (resid   15 and name HN   ) (resid   26 and name HN   )    4.51    4.51    0.00
assign (resid    5 and name HN   ) (resid    6 and name HN   )    2.90    2.90    0.00
assign (resid   15 and name HB   ) (resid   16 and name HN   )    4.26    4.26    0.00
assign (resid   20 and name HA   ) (resid   21 and name HN   )    3.48    3.48    0.00
assign (resid   19 and name HN   ) (resid   23 and name HB1  )    3.95    3.95    0.00
assign (resid   18 and name HN   ) (resid   19 and name HN   )    4.57    4.57    0.00
assign (resid    6 and name HB1  ) (resid    7 and name HN   )    3.58    3.58    0.00
assign (resid    6 and name HB2  ) (resid    7 and name HN   )    3.58    3.58    0.00
assign (resid    9 and name HA   ) (resid   10 and name HN   )    3.21    3.21    0.00
assign (resid    5 and name HA   ) (resid   10 and name HN   )    3.27    3.27    0.00
assign (resid   17 and name HN   ) (resid   18 and name HN   )    4.76    4.76    0.00
assign (resid    9 and name HA   ) (resid   11 and name HN   )    4.42    4.42    0.00
assign (resid   19 and name HA   ) (resid   21 and name HN   )    5.19    5.19    0.00
assign (resid    4 and name HA   ) (resid    7 and name HN   )    4.14    4.14    0.00
assign (resid   16 and name HB2  ) (resid   17 and name HN   )    4.57    4.57    0.00
assign (resid    4 and name HB#  ) (resid    5 and name HN   )    4.74    4.74    0.00
assign (resid    5 and name HB2  ) (resid    6 and name HN   )    4.05    4.05    0.00 !added 0.1
assign (resid    5 and name HB1  ) (resid    6 and name HN   )    3.71    3.71    0.00 !added 0.1
assign (resid   25 and name HB1  ) (resid   26 and name HN   )    3.52    3.52    0.00
assign (resid   20 and name HB2  ) (resid   21 and name HN   )    4.48    4.48    0.00
assign (resid   20 and name HB1  ) (resid   21 and name HN   )    4.48    4.48    0.00
assign (resid   19 and name HB1  ) (resid   21 and name HN   )    3.98    3.98    0.00
assign (resid   13 and name HB#  ) (resid   14 and name HN   )    5.30    5.30    0.00
assign (resid    8 and name HN   ) (resid    9 and name HN   )    3.21    3.21    0.00
assign (resid    5 and name HA   ) (resid    9 and name HN   )    4.94    4.94    0.00
assign (resid   19 and name HB2  ) (resid   20 and name HN   )    3.39    3.39    0.00
assign (resid   21 and name HB   ) (resid   22 and name HN   )    4.88    4.88    0.00
assign (resid   12 and name HN   ) (resid   16 and name HB2  )    4.42    4.42    0.00
assign (resid   17 and name HB1  ) (resid   18 and name HN   )    4.38    4.38    0.00
assign (resid   12 and name HA   ) (resid   13 and name HN   )    3.02    3.02    0.00
assign (resid    7 and name HA   ) (resid    8 and name HN   )    2.46    2.46    0.00
assign (resid   19 and name HA   ) (resid   20 and name HN   )    2.77    2.77    0.00
assign (resid    2 and name HA   ) (resid    3 and name HN   )    2.65    2.65    0.00
assign (resid   16 and name HN   ) (resid   17 and name HN   )    4.79    4.79    0.00
assign (resid    4 and name HN   ) (resid    5 and name HN   )    3.08    3.08    0.00
assign (resid    7 and name HB1  ) (resid    8 and name HN   )    4.38    4.38    0.00
assign (resid    7 and name HB2  ) (resid    8 and name HN   )    4.76    4.76    0.00
assign (resid    8 and name HB1  ) (resid    9 and name HN   )    4.17    4.17    0.00
assign (resid   12 and name HB2  ) (resid   14 and name HN   )    4.85    4.85    0.00
assign (resid    4 and name HA   ) (resid    6 and name HN   )    4.17    4.17    0.00
assign (resid   19 and name HB1  ) (resid   20 and name HN   )    3.92    3.92    0.00
assign (resid    2 and name HB   ) (resid    3 and name HN   )    5.16    5.16    0.00
assign (resid   19 and name HN   ) (resid   23 and name HB2  )    3.95    3.95    0.00
assign (resid   20 and name HN   ) (resid   21 and name HN   )    3.21    3.21    0.00
assign (resid   10 and name HN   ) (resid   11 and name HN   )    2.80    2.80    0.00
assign (resid    5 and name HB1  ) (resid    9 and name HA   )    3.79    3.79    0.00
assign (resid   25 and name HA   ) (resid   26 and name HB#  )    5.79    5.79    0.00
assign (resid   23 and name HN   ) (resid   24 and name HN   )    4.48    4.48    0.00
assign (resid   12 and name HB1  ) (resid   13 and name HN   )    5.04    5.04    0.00
assign (resid   12 and name HB2  ) (resid   13 and name HN   )    5.50    5.50    0.00
assign (resid    7 and name HN   ) (resid    8 and name HN   )    4.42    4.42    0.00
assign (resid    7 and name HN   ) (resid    9 and name HN   )    4.01    4.01    0.00
assign (resid    7 and name HN   ) (resid   10 and name HN   )    3.76    3.76    0.00
assign (resid    9 and name HN   ) (resid   11 and name HN   )    4.69    4.69    0.00
assign (resid    5 and name HA   ) (resid    7 and name HN   )    4.69    4.69    0.00
assign (resid   12 and name HN   ) (resid   16 and name HB1  )    5.50    5.50    0.00
assign (resid   14 and name HN   ) (resid   15 and name HN   )    4.72    4.72    0.00
assign (resid    6 and name HA   ) (resid    9 and name HN   )    5.13    5.13    0.00
assign (resid   19 and name HN   ) (resid   24 and name HN   )    4.82    4.82    0.00
assign (resid   19 and name HN   ) (resid   20 and name HN   )    5.07    5.07    0.00
assign (resid   17 and name HN   ) (resid   24 and name HN   )    3.98    3.98    0.00
assign (resid   17 and name HN   ) (resid   26 and name HN   )    4.42    4.42    0.00
assign (resid   19 and name HG   ) (resid   23 and name HA   )    3.58    3.58    0.00
assign (resid   22 and name HA2  ) (resid   23 and name HD#  )    7.57    7.57    0.00
assign (resid    5 and name HN   ) (resid   18 and name HB1  )    5.50    5.50    0.00
assign (resid    3 and name HD21 ) (resid    6 and name HG   )    4.17    4.17    0.00
assign (resid   20 and name HG2  ) (resid   21 and name HN   )    5.50    5.50    0.00
assign (resid    9 and name HD22 ) (resid   16 and name HN   )    4.76    4.76    0.00
assign (resid   23 and name HD#  ) (resid   24 and name HN   )    6.64    6.64    0.00
assign (resid    9 and name HD22 ) (resid   12 and name HN   )    5.50    5.50    0.00
assign (resid   15 and name HB   ) (resid   26 and name HB#  )    4.15    4.15    0.00
assign (resid   15 and name HB   ) (resid   26 and name HG   )    4.82    4.82    0.00
assign (resid   24 and name HG1  ) (resid   26 and name HG   )    4.45    4.45    0.00
assign (resid   17 and name HD22 ) (resid   19 and name HG   )    5.50    5.50    0.00
assign (resid   18 and name HA   ) (resid   23 and name HB1  )    3.64    3.64    0.00
assign (resid   18 and name HA   ) (resid   23 and name HB2  )    3.64    3.64    0.00
assign (resid   12 and name HB1  ) (resid   25 and name HA   )    4.72    4.72    0.00
assign (resid    9 and name HD22 ) (resid   12 and name HB1  )    5.41    5.41    0.00
assign (resid    9 and name HD22 ) (resid   12 and name HB2  )    3.83    3.83    0.00
assign (resid   22 and name HA1  ) (resid   23 and name HD#  )    7.10    7.10    0.00
assign (resid    4 and name HB#  ) (resid   23 and name HD#  )    7.36    7.36    0.00
assign (resid   23 and name HD#  ) (resid   24 and name HB#  )    8.51    8.51    0.00
assign (resid    9 and name HD21 ) (resid   12 and name HB1  )    5.07    5.07    0.00
assign (resid    9 and name HD21 ) (resid   15 and name HA   )    5.50    5.50    0.00
assign (resid    9 and name HD21 ) (resid   12 and name HB2  )    3.76    3.76    0.00
assign (resid    9 and name HD21 ) (resid   16 and name HB2  )    5.50    5.50    0.00
assign (resid   10 and name HA1  ) (resid   23 and name HD#  )    7.63    7.63    0.00
assign (resid    3 and name HD22 ) (resid   18 and name HB1  )    4.54    4.54    0.00
assign (resid    9 and name HA   ) (resid   16 and name HB2  )    4.91    4.91    0.00
assign (resid   20 and name HG1  ) (resid   21 and name HN   )    5.50    5.50    0.00
assign (resid   25 and name HA   ) (resid   26 and name HG   )    5.50    5.50    0.00
assign (resid   12 and name HB1  ) (resid   26 and name HN   )    5.50    5.50    0.00
assign (resid   24 and name HG2  ) (resid   26 and name HG   )    4.45    4.45    0.00
assign (resid   21 and name HG11 ) (resid   22 and name HN   )    5.50    5.50    0.00
assign (resid   21 and name HG12 ) (resid   22 and name HN   )    5.50    5.50    0.00
assign (resid   16 and name HA   ) (resid   23 and name HD#  )    7.63    7.63    0.00
assign (resid   16 and name HA   ) (resid   23 and name HE#  )    7.63    7.63    0.00
assign (resid   23 and name HD#  ) (resid   24 and name HA   )    7.32    7.32    0.00
assign (resid   23 and name HE#  ) (resid   24 and name HA   )    7.63    7.63    0.00
assign (resid   22 and name HA1  ) (resid   23 and name HE#  )    7.63    7.63    0.00
assign (resid   10 and name HA2  ) (resid   23 and name HE#  )    7.11    7.11    0.00
assign (resid   10 and name HA1  ) (resid   23 and name HE#  )    7.11    7.11    0.00
assign (resid    4 and name HB#  ) (resid   23 and name HE#  )    7.55    7.55    0.00
assign (resid   23 and name HE#  ) (resid   24 and name HB#  )    8.51    8.51    0.00
assign (resid   23 and name HE#  ) (resid   25 and name HA   )    7.63    7.63    0.00
assign (resid    3 and name HD21 ) (resid   18 and name HB2  )    5.50    5.50    0.00
assign (resid   15 and name HB   ) (resid   26 and name HN   )    4.17    4.17    0.00
assign (resid   19 and name HG   ) (resid   24 and name HN   )    4.57    4.57    0.00
assign (resid    9 and name HD21 ) (resid   12 and name HN   )    4.97    4.97    0.00
assign (resid   13 and name HB#  ) (resid   14 and name HD2  )    6.38    6.38    0.00
assign (resid   20 and name HN   ) (resid   20 and name HD#  )    6.38    6.38    0.00
assign (resid   19 and name HG   ) (resid   23 and name HN   )    5.50    5.50    0.00
assign (resid    9 and name HD22 ) (resid   15 and name HA   )    4.35    4.35    0.00
assign (resid   14 and name HB2  ) (resid   26 and name H2   )    5.50    5.50    0.00
assign (resid   14 and name HB1  ) (resid   26 and name H2   )    5.50    5.50    0.00
assign (resid   19 and name HG   ) (resid   20 and name HN   )    5.50    5.50    0.00
assign (resid    5 and name HN   ) (resid   18 and name HB2  )    5.07    5.07    0.00
assign (resid   23 and name HD#  ) (resid   25 and name HA   )    7.63    7.63    0.00
assign (resid   10 and name HA2  ) (resid   23 and name HD#  )    7.63    7.63    0.00
assign (resid   22 and name HA2  ) (resid   23 and name HE#  )    7.63    7.63    0.00
assign (resid   23 and name HE#  ) (resid   24 and name HN   )    7.29    7.29    0.00
assign (resid    3 and name HD22 ) (resid    5 and name HB2  )    4.51    4.51    0.00
assign (resid    9 and name HD21 ) (resid   16 and name HN   )    5.50    5.50    0.00
assign (resid    9 and name HD22 ) (resid   16 and name HB2  )    5.50    5.50    0.00
assign (resid   12 and name HB1  ) (resid   25 and name HB1  )    3.98    3.98    0.00
assign (resid   17 and name HB1  ) (resid   24 and name HB#  )    6.29    6.29    0.00
assign (resid    3 and name HD22 ) (resid   18 and name HB2  )    4.66    4.66    0.00
assign (resid    9 and name HD22 ) (resid   16 and name HB1  )    5.50    5.50    0.00
assign (resid    5 and name HB2  ) (resid   16 and name HB2  )    5.50    5.50    0.00
assign (resid   12 and name HB1  ) (resid   16 and name HB2  )    4.97    4.97    0.00
assign (resid    5 and name HA   ) (resid   16 and name HB1  )    5.50    5.50    0.00
assign (resid    5 and name HB2  ) (resid   16 and name HB1  )    3.95    3.95    0.00
assign (resid    5 and name HB1  ) (resid   16 and name HB1  )    2.93    2.93    0.00
assign (resid   12 and name HA   ) (resid   25 and name HB1  )    5.19    5.19    0.00
assign (resid   14 and name HB1  ) (resid   15 and name HB   )    5.50    5.50    0.00
assign (resid   14 and name HB2  ) (resid   15 and name HB   )    5.50    5.50    0.00
assign (resid   17 and name HB1  ) (resid   26 and name HG   )    5.50    5.50    0.00
assign (resid    3 and name HB1  ) (resid    6 and name HG   )    5.50    5.50    0.00
assign (resid    3 and name HB2  ) (resid    6 and name HG   )    5.50    5.50    0.00
assign (resid   17 and name HN   ) (resid   23 and name HD#  )    7.63    7.63    0.00
assign (resid   19 and name HD1# ) (resid   23 and name HN   )    5.93    5.93    0.00
assign (resid   19 and name HD1# ) (resid   24 and name HN   )    6.52    6.52    0.00
assign (resid    3 and name HD22 ) (resid    6 and name HD1# )    5.31    5.31    0.00
assign (resid    3 and name HD22 ) (resid    6 and name HD2# )    5.31    5.31    0.00
assign (resid    2 and name HA   ) (resid    2 and name HG2# )    4.16    4.16    0.00
assign (resid   15 and name HG## ) (resid   16 and name HN   )    5.58    5.58    0.00
assign (resid   17 and name HD22 ) (resid   19 and name HD2# )    4.16    4.16    0.00
assign (resid   17 and name HN   ) (resid   26 and name HD## )    7.19    7.19    0.00
assign (resid   19 and name HD1# ) (resid   21 and name HN   )    6.52    6.52    0.00
assign (resid   14 and name HD2  ) (resid   26 and name HD## )    7.38    7.38    0.00
assign (resid   19 and name HD1# ) (resid   24 and name HB#  )    5.48    5.48    0.00
assign (resid   19 and name HD1# ) (resid   24 and name HG1  )    5.43    5.43    0.00
assign (resid   19 and name HD1# ) (resid   24 and name HG2  )    5.43    5.43    0.00
assign (resid    3 and name HD21 ) (resid    6 and name HD1# )    5.34    5.34    0.00
assign (resid    3 and name HD21 ) (resid    6 and name HD2# )    5.34    5.34    0.00
assign (resid    2 and name HG2# ) (resid    4 and name HN   )    5.19    5.19    0.00
assign (resid   19 and name HD2# ) (resid   21 and name HN   )    6.52    6.52    0.00
assign (resid   19 and name HD1# ) (resid   20 and name HN   )    6.27    6.27    0.00
assign (resid   19 and name HD2# ) (resid   20 and name HN   )    4.84    4.84    0.00
assign (resid    2 and name HG2# ) (resid    3 and name HN   )    5.19    5.19    0.00
assign (resid   21 and name HD1# ) (resid   22 and name HN   )    4.60    4.60    0.00
assign (resid   17 and name HD21 ) (resid   19 and name HD2# )    4.07    4.07    0.00
assign (resid   18 and name HN   ) (resid   19 and name HD2# )    6.52    6.52    0.00
assign (resid    9 and name HD22 ) (resid   15 and name HG## )    7.60    7.60    0.00
assign (resid   25 and name HA   ) (resid   26 and name HD## )    7.60    7.60    0.00
assign (resid   16 and name HA   ) (resid   26 and name HD## )    7.60    7.60    0.00
assign (resid    2 and name HG2# ) (resid    4 and name HA   )    5.62    5.62    0.00
assign (resid    2 and name HG2# ) (resid    4 and name HG#  )    4.38    4.38    0.00
assign (resid    3 and name HB2  ) (resid    6 and name HB#  )    4.68    4.68    0.00
assign (resid    3 and name HB2  ) (resid    6 and name HD## )    4.72    4.72    0.00
assign (resid    3 and name HB1  ) (resid    6 and name HB#  )    3.79    3.79    0.00
assign (resid    3 and name HB1  ) (resid    6 and name HD## )    4.08    4.08    0.00
assign (resid    3 and name HD21 ) (resid    6 and name HD## )    4.64    4.64    0.00
assign (resid    3 and name HD22 ) (resid    6 and name HD## )    4.43    4.43    0.00
assign (resid    4 and name HB#  ) (resid   23 and name HB#  )    4.68    4.68    0.00
assign (resid    4 and name HG#  ) (resid   23 and name HD#  )    5.59    5.59    0.00
assign (resid    4 and name HG#  ) (resid   23 and name HE#  )    5.65    5.65    0.00
assign (resid    5 and name HA   ) (resid   10 and name HA#  )    3.65    3.65    0.00
assign (resid    6 and name HD## ) (resid    7 and name HN   )    6.42    6.42    0.00
assign (resid    8 and name HB#  ) (resid   11 and name HN   )    3.47    3.47    0.00
assign (resid    9 and name HN   ) (resid   10 and name HA#  )    5.26    5.26    0.00
assign (resid    9 and name HB#  ) (resid   11 and name HN   )    3.54    3.54    0.00
assign (resid    9 and name HB#  ) (resid   12 and name HN   )    3.48    3.48    0.00
assign (resid   10 and name HA#  ) (resid   12 and name HN   )    3.62    3.62    0.00
assign (resid   10 and name HA#  ) (resid   23 and name HE#  )    6.27    6.27    0.00
assign (resid   11 and name HA#  ) (resid   12 and name HN   )    3.00    3.00    0.00
assign (resid   17 and name HN   ) (resid   23 and name HB#  )    5.34    5.34    0.00
assign (resid   17 and name HN   ) (resid   24 and name HG#  )    5.17    5.17    0.00
assign (resid   17 and name HB1  ) (resid   24 and name HG#  )    3.11    3.11    0.00
assign (resid   17 and name HD21 ) (resid   24 and name HG#  )    4.09    4.09    0.00
assign (resid   17 and name HD22 ) (resid   24 and name HG#  )    5.34    5.34    0.00
assign (resid   18 and name HA   ) (resid   23 and name HB#  )    2.90    2.90    0.00
assign (resid   19 and name HN   ) (resid   23 and name HB#  )    3.16    3.16    0.00
assign (resid   19 and name HD1# ) (resid   24 and name HG#  )    4.60    4.60    0.00
assign (resid   20 and name HB#  ) (resid   21 and name HN   )    3.87    3.87    0.00
assign (resid   23 and name HB#  ) (resid   24 and name HN   )    3.39    3.39    0.00
assign (resid   24 and name HG#  ) (resid   26 and name HG   )    3.90    3.90    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 -100.0   80.0 2
assign (resid    3 and name C    ) (resid    4 and name N    )
       (resid    4 and name CA   ) (resid    4 and name C    )    1.0  -60.0   30.0 2
assign (resid    4 and name C    ) (resid    5 and name N    )
       (resid    5 and name CA   ) (resid    5 and name C    )    1.0  -60.0   30.0 2
assign (resid    6 and name C    ) (resid    7 and name N    )
       (resid    7 and name CA   ) (resid    7 and name C    )    1.0 -120.0   30.0 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0  -60.0   30.0 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0 -120.0   30.0 2
assign (resid   17 and name C    ) (resid   18 and name N    )
       (resid   18 and name CA   ) (resid   18 and name C    )    1.0  -60.0   30.0 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )    1.0 -120.0   30.0 2
assign (resid   25 and name C    ) (resid   26 and name N    )
       (resid   26 and name CA   ) (resid   26 and name C    )    1.0 -120.0   30.0 2
assign (resid   25 and name N    ) (resid   25 and name CA   )
       (resid   25 and name CB   ) (resid   25 and name SG   )    1.0  -60.0   30.0 2
assign (resid    3 and name C    ) (resid    4 and name N    )
       (resid    4 and name CA   ) (resid    4 and name C    )    1.0  -62.2   20.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name C    ) (resid    5 and name N    )    1.0  -24.6   23.0 2
assign (resid    4 and name C    ) (resid    5 and name N    )
       (resid    5 and name CA   ) (resid    5 and name C    )    1.0  -87.1   29.4 2
assign (resid    5 and name N    ) (resid    5 and name CA   )
       (resid    5 and name C    ) (resid    6 and name N    )    1.0   -3.6   55.3 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0  -75.7   20.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name C    ) (resid   14 and name N    )    1.0  -28.7   34.2 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0 -106.5   39.4 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name C    ) (resid   15 and name N    )    1.0  147.9   45.2 2
assign (resid   14 and name C    ) (resid   15 and name N    )
       (resid   15 and name CA   ) (resid   15 and name C    )    1.0 -109.3   52.1 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name C    ) (resid   16 and name N    )    1.0  135.2   55.4 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0 -104.1   60.9 2
assign (resid   17 and name N    ) (resid   17 and name CA   )
       (resid   17 and name C    ) (resid   18 and name N    )    1.0  145.4   53.2 2
assign (resid   18 and name C    ) (resid   19 and name N    )
       (resid   19 and name CA   ) (resid   19 and name C    )    1.0  -78.5   50.8 2
assign (resid   19 and name C    ) (resid   20 and name N    )
       (resid   20 and name CA   ) (resid   20 and name C    )    1.0  -57.9   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  -32.6   20.0 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )    1.0  -85.5   32.0 2
assign (resid   24 and name C    ) (resid   25 and name N    )
       (resid   25 and name CA   ) (resid   25 and name C    )    1.0 -107.3   45.8 2
assign (resid   25 and name N    ) (resid   25 and name CA   )
       (resid   25 and name C    ) (resid   26 and name N    )    1.0  128.7   29.0 2
assign (resid    2 and name N    ) (resid    2 and name CA   )
       (resid    2 and name CB   ) (resid    2 and name OG1  )    1.0   60.0  150.0 2
assign (resid    2 and name N    ) (resid    2 and name CA   )
       (resid    2 and name CB   ) (resid    2 and name OG1  )    1.0  180.0  150.0 2
assign (resid    2 and name N    ) (resid    2 and name CA   )
       (resid    2 and name CB   ) (resid    2 and name OG1  )    1.0  -60.0  150.0 2
assign (resid    3 and name N    ) (resid    3 and name CA   )
       (resid    3 and name CB   ) (resid    3 and name CG   )    1.0  180.0   30.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name CB   ) (resid    4 and name CG   )    1.0   60.0  150.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name CB   ) (resid    4 and name CG   )    1.0  180.0  150.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name CB   ) (resid    4 and name CG   )    1.0  -60.0  150.0 2
assign (resid    4 and name CA   ) (resid    4 and name CB   )
       (resid    4 and name CG   ) (resid    4 and name CD   )    1.0   60.0   30.0 2
assign (resid    4 and name CA   ) (resid    4 and name CB   )
       (resid    4 and name CG   ) (resid    4 and name CD   )    1.0  180.0  150.0 2
assign (resid    4 and name CA   ) (resid    4 and name CB   )
       (resid    4 and name CG   ) (resid    4 and name CD   )    1.0  -60.0  150.0 2
assign (resid    5 and name N    ) (resid    5 and name CA   )
       (resid    5 and name CB   ) (resid    5 and name SG   )    1.0  -60.0   30.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name CB   ) (resid    6 and name CG   )    1.0   60.0  150.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name CB   ) (resid    6 and name CG   )    1.0  180.0  150.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name CB   ) (resid    6 and name CG   )    1.0  -60.0  150.0 2
assign (resid    6 and name CA   ) (resid    6 and name CB   )
       (resid    6 and name CG   ) (resid    6 and name CD1  )    1.0   60.0  150.0 2
assign (resid    6 and name CA   ) (resid    6 and name CB   )
       (resid    6 and name CG   ) (resid    6 and name CD1  )    1.0  180.0  150.0 2
assign (resid    6 and name CA   ) (resid    6 and name CB   )
       (resid    6 and name CG   ) (resid    6 and name CD1  )    1.0  -60.0  150.0 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
       (resid    7 and name CB   ) (resid    7 and name CG   )    1.0  180.0   30.0 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name CB   ) (resid    8 and name CG   )    1.0   60.0  150.0 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name CB   ) (resid    8 and name CG   )    1.0  180.0  150.0 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name CB   ) (resid    8 and name CG   )    1.0  -60.0  150.0 2
assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name CB   ) (resid    9 and name CG   )    1.0   60.0  150.0 2
assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name CB   ) (resid    9 and name CG   )    1.0  180.0  150.0 2
assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name CB   ) (resid    9 and name CG   )    1.0  -60.0  150.0 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name CB   ) (resid   12 and name SG   )    1.0  -60.0   30.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name CB   ) (resid   13 and name OG   )    1.0   60.0  150.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name CB   ) (resid   13 and name OG   )    1.0  180.0  150.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name CB   ) (resid   13 and name OG   )    1.0  -60.0  150.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name CB   ) (resid   14 and name CG   )    1.0   60.0  150.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name CB   ) (resid   14 and name CG   )    1.0  180.0  150.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name CB   ) (resid   14 and name CG   )    1.0  -60.0  150.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name CB   ) (resid   15 and name CG1  )    1.0   60.0  150.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name CB   ) (resid   15 and name CG1  )    1.0  180.0  150.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name CB   ) (resid   15 and name CG1  )    1.0  -60.0  150.0 2
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name CB   ) (resid   19 and name CG   )    1.0  -60.0   30.0 2
assign (resid   18 and name N    ) (resid   18 and name CA   )
       (resid   18 and name CB   ) (resid   18 and name CG   )    1.0  180.0   30.0 2
assign (resid   17 and name N    ) (resid   17 and name CA   )
       (resid   17 and name CB   ) (resid   17 and name CG   )    1.0  180.0   30.0 2
assign (resid   16 and name N    ) (resid   16 and name CA   )
       (resid   16 and name CB   ) (resid   16 and name SG   )    1.0  180.0   30.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name CB   ) (resid   20 and name CG   )    1.0   60.0  150.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name CB   ) (resid   20 and name CG   )    1.0  180.0  150.0 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name CB   ) (resid   20 and name CG   )    1.0  -60.0  150.0 2
assign (resid   20 and name CA   ) (resid   20 and name CB   )
       (resid   20 and name CG   ) (resid   20 and name CD   )    1.0   60.0  150.0 2
assign (resid   20 and name CA   ) (resid   20 and name CB   )
       (resid   20 and name CG   ) (resid   20 and name CD   )    1.0  180.0  150.0 2
assign (resid   20 and name CA   ) (resid   20 and name CB   )
       (resid   20 and name CG   ) (resid   20 and name CD   )    1.0  -60.0  150.0 2
assign (resid   20 and name CB   ) (resid   20 and name CG   )
       (resid   20 and name CD   ) (resid   20 and name CE   )    1.0   60.0  150.0 2
assign (resid   20 and name CB   ) (resid   20 and name CG   )
       (resid   20 and name CD   ) (resid   20 and name CE   )    1.0  180.0  150.0 2
assign (resid   20 and name CB   ) (resid   20 and name CG   )
       (resid   20 and name CD   ) (resid   20 and name CE   )    1.0  -60.0  150.0 2
assign (resid   20 and name CG   ) (resid   20 and name CD   )
       (resid   20 and name CE   ) (resid   20 and name NZ   )    1.0   60.0  150.0 2
assign (resid   20 and name CG   ) (resid   20 and name CD   )
       (resid   20 and name CE   ) (resid   20 and name NZ   )    1.0  180.0  150.0 2
assign (resid   20 and name CG   ) (resid   20 and name CD   )
       (resid   20 and name CE   ) (resid   20 and name NZ   )    1.0  -60.0  150.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name CB   ) (resid   21 and name CG1  )    1.0   60.0  150.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name CB   ) (resid   21 and name CG1  )    1.0  180.0  150.0 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name CB   ) (resid   21 and name CG1  )    1.0  -60.0  150.0 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name CB   ) (resid   23 and name CG   )    1.0   60.0  150.0 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name CB   ) (resid   23 and name CG   )    1.0  180.0  150.0 2
assign (resid   23 and name N    ) (resid   23 and name CA   )
       (resid   23 and name CB   ) (resid   23 and name CG   )    1.0  -60.0  150.0 2
assign (resid   24 and name N    ) (resid   24 and name CA   )
       (resid   24 and name CB   ) (resid   24 and name CG   )    1.0   60.0  150.0 2
assign (resid   24 and name N    ) (resid   24 and name CA   )
       (resid   24 and name CB   ) (resid   24 and name CG   )    1.0  180.0  150.0 2
assign (resid   24 and name N    ) (resid   24 and name CA   )
       (resid   24 and name CB   ) (resid   24 and name CG   )    1.0  -60.0  150.0 2
assign (resid   24 and name CA   ) (resid   24 and name CB   )
       (resid   24 and name CG   ) (resid   24 and name CD   )    1.0   60.0  150.0 2
assign (resid   24 and name CA   ) (resid   24 and name CB   )
       (resid   24 and name CG   ) (resid   24 and name CD   )    1.0  180.0  150.0 2
assign (resid   24 and name CA   ) (resid   24 and name CB   )
       (resid   24 and name CG   ) (resid   24 and name CD   )    1.0  -60.0  150.0 2
assign (resid   25 and name N    ) (resid   25 and name CA   )
       (resid   25 and name CB   ) (resid   25 and name SG   )    1.0  -60.0   30.0 2
assign (resid   26 and name N    ) (resid   26 and name CA   )
       (resid   26 and name CB   ) (resid   26 and name CG   )    1.0   60.0  150.0 2
assign (resid   26 and name N    ) (resid   26 and name CA   )
       (resid   26 and name CB   ) (resid   26 and name CG   )    1.0  180.0  150.0 2
assign (resid   26 and name N    ) (resid   26 and name CA   )
       (resid   26 and name CB   ) (resid   26 and name CG   )    1.0  -60.0  150.0 2
assign (resid   26 and name CA   ) (resid   26 and name CB   )
       (resid   26 and name CG   ) (resid   26 and name CD1  )    1.0   60.0  150.0 2
assign (resid   26 and name CA   ) (resid   26 and name CB   )
       (resid   26 and name CG   ) (resid   26 and name CD1  )    1.0  180.0  150.0 2
assign (resid   26 and name CA   ) (resid   26 and name CB   )
       (resid   26 and name CG   ) (resid   26 and name CD1  )    1.0  -60.0  150.0 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1HT      GLY   1 -13.762   0.821  -1.886
    2    H2   GLY   1           2HT      GLY   1 -12.982   1.823  -2.995
    3    H3   GLY   1           3HT      GLY   1 -13.841   2.500  -1.731
    4    HA2  GLY   1           1HA      GLY   1 -12.306   1.597  -0.139
    5    HA3  GLY   1           2HA      GLY   1 -11.387   0.892  -1.465
    6    H    THR   2           H        THR   2  -9.543   2.089  -0.906
    7    HA   THR   2           HA       THR   2  -9.345   4.588  -2.156
    8    HB   THR   2           HB       THR   2 -10.266   5.452  -0.074
    9    HG1  THR   2           1HG      THR   2  -7.660   6.054   0.519
   10   HG21  THR   2          3HG2      THR   2  -9.811   3.584   1.424
   11   HG22  THR   2          1HG2      THR   2  -9.177   5.077   2.116
   12   HG23  THR   2          2HG2      THR   2  -8.081   3.920   1.356
   13    H    ASN   3           H        ASN   3  -7.190   4.997  -2.658
   14    HA   ASN   3           HA       ASN   3  -5.473   2.660  -2.294
   15    HB2  ASN   3           2HB      ASN   3  -5.979   3.615  -4.598
   16    HB3  ASN   3           1HB      ASN   3  -5.110   5.043  -4.112
   17   HD21  ASN   3          1HD2      ASN   3  -4.588   3.129  -6.278
   18   HD22  ASN   3          2HD2      ASN   3  -2.979   2.577  -6.029
   19    H    GLU   4           H        GLU   4  -4.195   2.744  -0.545
   20    HA   GLU   4           HA       GLU   4  -3.294   5.155   0.685
   21    HB2  GLU   4           2HB      GLU   4  -2.474   2.279   1.088
   22    HB3  GLU   4           1HB      GLU   4  -1.795   3.603   2.007
   23    HG2  GLU   4           2HG      GLU   4  -3.479   2.449   3.284
   24    HG3  GLU   4           1HG      GLU   4  -4.007   4.085   2.930
   25    H    CYS   5           H        CYS   5  -2.004   3.021  -1.720
   26    HA   CYS   5           HA       CYS   5   0.751   3.491  -1.419
   27    HB2  CYS   5           2HB      CYS   5  -0.776   2.811  -3.909
   28    HB3  CYS   5           1HB      CYS   5   0.936   2.546  -3.628
   29    H    LEU   6           H        LEU   6  -1.737   5.176  -2.966
   30    HA   LEU   6           HA       LEU   6  -0.350   6.975  -4.621
   31    HB2  LEU   6           2HB      LEU   6  -2.911   7.214  -3.105
   32    HB3  LEU   6           1HB      LEU   6  -2.355   8.481  -4.191
   33    HG   LEU   6           HG       LEU   6  -3.157   5.648  -4.848
   34   HD11  LEU   6          1HD1      LEU   6  -4.407   8.296  -5.554
   35   HD12  LEU   6          2HD1      LEU   6  -4.995   7.192  -4.319
   36   HD13  LEU   6          3HD1      LEU   6  -5.006   6.702  -6.015
   37   HD21  LEU   6          3HD2      LEU   6  -2.880   6.310  -7.184
   38   HD22  LEU   6          1HD2      LEU   6  -1.353   6.335  -6.308
   39   HD23  LEU   6          2HD2      LEU   6  -2.191   7.846  -6.661
   40    H    ASP   7           H        ASP   7  -0.961   7.026  -1.178
   41    HA   ASP   7           HA       ASP   7   0.349   9.651  -0.978
   42    HB2  ASP   7           2HB      ASP   7  -1.923   9.566  -0.036
   43    HB3  ASP   7           1HB      ASP   7  -1.428   8.249   1.021
   44    H    ASN   8           H        ASN   8   2.457   9.345  -0.710
   45    HA   ASN   8           HA       ASN   8   4.444   8.862   0.243
   46    HB2  ASN   8           2HB      ASN   8   2.730   8.120   2.604
   47    HB3  ASN   8           1HB      ASN   8   4.489   8.066   2.598
   48   HD21  ASN   8          1HD2      ASN   8   1.656  10.138   2.598
   49   HD22  ASN   8          2HD2      ASN   8   2.522  11.582   2.941
   50    H    ASN   9           H        ASN   9   3.025   6.921  -1.226
   51    HA   ASN   9           HA       ASN   9   3.124   4.750  -1.958
   52    HB2  ASN   9           2HB      ASN   9   5.585   5.325  -1.985
   53    HB3  ASN   9           1HB      ASN   9   5.720   4.640  -0.373
   54   HD21  ASN   9          1HD2      ASN   9   7.142   3.069  -0.943
   55   HD22  ASN   9          2HD2      ASN   9   6.747   1.713  -1.918
   56    H    GLY  10           H        GLY  10   1.711   5.340   0.472
   57    HA2  GLY  10           2HA      GLY  10   0.419   4.140   1.936
   58    HA3  GLY  10           1HA      GLY  10   1.189   2.675   1.351
   59    H    GLY  11           H        GLY  11   3.633   4.676   2.236
   60    HA2  GLY  11           2HA      GLY  11   4.814   4.948   4.247
   61    HA3  GLY  11           1HA      GLY  11   3.624   3.929   5.053
   62    H    CYS  12           H        CYS  12   4.442   2.530   2.170
   63    HA   CYS  12           HA       CYS  12   5.813   0.390   3.467
   64    HB2  CYS  12           2HB      CYS  12   5.201   0.853   0.545
   65    HB3  CYS  12           1HB      CYS  12   5.722  -0.665   1.262
   66    H    SER  13           H        SER  13   7.923  -0.160   3.261
   67    HA   SER  13           HA       SER  13   9.739   1.863   2.367
   68    HB2  SER  13           2HB      SER  13  10.258  -0.864   3.576
   69    HB3  SER  13           1HB      SER  13  11.477   0.386   3.304
   70    HG   SER  13           HG       SER  13   9.232   0.494   5.041
   71    H    HIS  14           H        HIS  14   8.199  -0.725   0.976
   72    HA   HIS  14           HA       HIS  14   9.940  -0.518  -1.335
   73    HB2  HIS  14           2HB      HIS  14   8.952  -3.134  -0.166
   74    HB3  HIS  14           1HB      HIS  14   9.492  -2.995  -1.829
   75    HD1  HIS  14           1HD      HIS  14  12.058  -2.350  -2.164
   76    HD2  HIS  14           2HD      HIS  14  10.970  -3.375   1.703
   77    HE1  HIS  14           1HE      HIS  14  14.205  -2.790  -0.960
   78    HE2  HIS  14           2HE      HIS  14  13.477  -2.918   1.424
   79    H    VAL  15           H        VAL  15   8.399  -2.171  -3.059
   80    HA   VAL  15           HA       VAL  15   6.536  -0.293  -3.917
   81    HB   VAL  15           HB       VAL  15   6.470  -3.262  -4.515
   82   HG11  VAL  15          1HG1      VAL  15   5.392  -0.916  -6.080
   83   HG12  VAL  15          2HG1      VAL  15   4.439  -2.118  -5.214
   84   HG13  VAL  15          3HG1      VAL  15   5.392  -2.593  -6.620
   85   HG21  VAL  15          3HG2      VAL  15   7.851  -2.734  -6.475
   86   HG22  VAL  15          1HG2      VAL  15   8.686  -2.320  -4.978
   87   HG23  VAL  15          2HG2      VAL  15   7.948  -1.052  -5.954
   88    H    CYS  16           H        CYS  16   4.543   0.204  -3.315
   89    HA   CYS  16           HA       CYS  16   3.175  -1.365  -1.315
   90    HB2  CYS  16           2HB      CYS  16   3.220   1.107  -1.158
   91    HB3  CYS  16           1HB      CYS  16   2.421   1.201  -2.720
   92    H    ASN  17           H        ASN  17   1.141  -2.265  -1.630
   93    HA   ASN  17           HA       ASN  17   0.160  -2.556  -4.379
   94    HB2  ASN  17           2HB      ASN  17   1.372  -4.606  -3.798
   95    HB3  ASN  17           1HB      ASN  17   0.484  -4.737  -2.287
   96   HD21  ASN  17          1HD2      ASN  17  -0.302  -6.798  -2.805
   97   HD22  ASN  17          2HD2      ASN  17  -1.483  -7.055  -4.019
   98    H    ASP  18           H        ASP  18  -1.747  -1.548  -4.298
   99    HA   ASP  18           HA       ASP  18  -3.125  -1.252  -1.811
  100    HB2  ASP  18           2HB      ASP  18  -3.246   0.608  -3.339
  101    HB3  ASP  18           1HB      ASP  18  -3.933  -0.414  -4.596
  102    H    LEU  19           H        LEU  19  -4.517  -2.482  -0.971
  103    HA   LEU  19           HA       LEU  19  -5.716  -4.613  -2.559
  104    HB2  LEU  19           2HB      LEU  19  -5.726  -4.253   0.435
  105    HB3  LEU  19           1HB      LEU  19  -6.279  -5.643  -0.451
  106    HG   LEU  19           HG       LEU  19  -3.416  -4.745  -0.221
  107   HD11  LEU  19          1HD1      LEU  19  -4.241  -5.675   1.828
  108   HD12  LEU  19          2HD1      LEU  19  -3.191  -6.865   1.043
  109   HD13  LEU  19          3HD1      LEU  19  -4.941  -7.036   0.963
  110   HD21  LEU  19          3HD2      LEU  19  -4.589  -7.173  -1.582
  111   HD22  LEU  19          1HD2      LEU  19  -2.874  -6.827  -1.366
  112   HD23  LEU  19          2HD2      LEU  19  -3.858  -5.788  -2.395
  113    H    LYS  20           H        LYS  20  -8.051  -5.079  -1.893
  114    HA   LYS  20           HA       LYS  20  -9.528  -2.691  -2.291
  115    HB2  LYS  20           2HB      LYS  20 -10.679  -5.309  -1.299
  116    HB3  LYS  20           1HB      LYS  20 -11.536  -4.026  -2.134
  117    HG2  LYS  20           2HG      LYS  20  -9.575  -6.010  -3.255
  118    HG3  LYS  20           1HG      LYS  20 -11.255  -5.757  -3.703
  119    HD2  LYS  20           2HD      LYS  20  -8.971  -3.853  -4.205
  120    HD3  LYS  20           1HD      LYS  20  -9.716  -4.891  -5.409
  121    HE2  LYS  20           2HE      LYS  20 -11.837  -3.679  -5.116
  122    HE3  LYS  20           1HE      LYS  20 -11.064  -2.641  -3.923
  123    HZ1  LYS  20           3HZ      LYS  20 -11.144  -1.606  -6.093
  124    HZ2  LYS  20           1HZ      LYS  20 -10.259  -2.870  -6.767
  125    HZ3  LYS  20           2HZ      LYS  20  -9.547  -1.858  -5.624
  126    H    ILE  21           H        ILE  21  -9.035  -4.792   0.453
  127    HA   ILE  21           HA       ILE  21  -9.975  -2.628   2.159
  128    HB   ILE  21           HB       ILE  21 -11.339  -4.529   2.548
  129   HG12  ILE  21          2HG1      ILE  21 -10.826  -5.155   4.932
  130   HG13  ILE  21          1HG1      ILE  21  -9.293  -4.313   4.756
  131   HG21  ILE  21          1HG2      ILE  21  -8.869  -6.207   2.804
  132   HG22  ILE  21          2HG2      ILE  21 -10.112  -6.289   1.554
  133   HG23  ILE  21          3HG2      ILE  21 -10.496  -6.752   3.211
  134   HD11  ILE  21          3HD1      ILE  21 -12.020  -3.065   4.478
  135   HD12  ILE  21          1HD1      ILE  21 -10.475  -2.226   4.340
  136   HD13  ILE  21          2HD1      ILE  21 -10.959  -2.937   5.880
  137    H    GLY  22           H        GLY  22  -8.384  -1.486   2.868
  138    HA2  GLY  22           2HA      GLY  22  -6.426  -0.991   4.013
  139    HA3  GLY  22           1HA      GLY  22  -6.102  -2.721   4.126
  140    H    TYR  23           H        TYR  23  -3.981  -2.632   3.430
  141    HA   TYR  23           HA       TYR  23  -3.619  -2.570   0.618
  142    HB2  TYR  23           2HB      TYR  23  -1.939  -0.833   0.493
  143    HB3  TYR  23           1HB      TYR  23  -3.371  -0.128   1.221
  144    HD1  TYR  23           1HD      TYR  23  -3.373   0.221   3.763
  145    HD2  TYR  23           2HD      TYR  23   0.124  -0.781   1.566
  146    HE1  TYR  23           1HE      TYR  23  -1.973   1.046   5.611
  147    HE2  TYR  23           2HE      TYR  23   1.519   0.028   3.401
  148    HH   TYR  23           HH       TYR  23   1.358   1.562   5.203
  149    H    GLU  24           H        GLU  24  -1.111  -2.934   0.264
  150    HA   GLU  24           HA       GLU  24  -0.057  -4.630   2.377
  151    HB2  GLU  24           2HB      GLU  24  -1.351  -6.056   0.960
  152    HB3  GLU  24           1HB      GLU  24  -0.656  -5.352  -0.483
  153    HG2  GLU  24           2HG      GLU  24   1.458  -6.374   0.007
  154    HG3  GLU  24           1HG      GLU  24   0.852  -7.003   1.535
  155    H    CYS  25           H        CYS  25   2.198  -4.744   2.295
  156    HA   CYS  25           HA       CYS  25   3.484  -2.968   0.348
  157    HB2  CYS  25           2HB      CYS  25   4.463  -3.847   3.069
  158    HB3  CYS  25           1HB      CYS  25   5.286  -2.737   1.982
  159    H    LEU  26           H        LEU  26   4.847  -3.908  -1.056
  160    HA   LEU  26           HA       LEU  26   5.620  -6.696  -0.551
  161    HB2  LEU  26           2HB      LEU  26   5.190  -5.262  -3.180
  162    HB3  LEU  26           1HB      LEU  26   5.729  -6.921  -3.022
  163    HG   LEU  26           HG       LEU  26   3.048  -5.832  -2.196
  164   HD11  LEU  26          1HD1      LEU  26   2.193  -7.187  -4.057
  165   HD12  LEU  26          2HD1      LEU  26   3.845  -7.629  -4.487
  166   HD13  LEU  26          3HD1      LEU  26   3.319  -5.950  -4.616
  167   HD21  LEU  26          3HD2      LEU  26   2.440  -8.184  -1.828
  168   HD22  LEU  26          1HD2      LEU  26   3.737  -7.667  -0.753
  169   HD23  LEU  26          2HD2      LEU  26   4.105  -8.660  -2.162
  170    HN1  NH2  27           1H       LEU  26   6.946  -4.952  -3.198
  171    HN2  NH2  27           2H       LEU  26   8.517  -4.696  -2.540
  Start of MODEL    2
    1    H1   GLY   1           1HT      GLY   1 -11.917   5.407  -4.926
    2    H2   GLY   1           2HT      GLY   1 -12.677   4.033  -5.558
    3    H3   GLY   1           3HT      GLY   1 -10.997   4.069  -5.406
    4    HA2  GLY   1           1HA      GLY   1 -12.964   4.108  -3.213
    5    HA3  GLY   1           2HA      GLY   1 -11.957   2.740  -3.680
    6    H    THR   2           H        THR   2 -10.590   2.518  -1.970
    7    HA   THR   2           HA       THR   2  -9.191   4.941  -1.181
    8    HB   THR   2           HB       THR   2 -10.589   4.358   0.672
    9    HG1  THR   2           1HG      THR   2  -8.187   3.268   1.621
   10   HG21  THR   2          3HG2      THR   2 -10.492   2.180   1.827
   11   HG22  THR   2          1HG2      THR   2  -9.377   1.589   0.595
   12   HG23  THR   2          2HG2      THR   2 -11.038   1.996   0.156
   13    H    ASN   3           H        ASN   3  -7.440   4.790  -2.376
   14    HA   ASN   3           HA       ASN   3  -5.764   2.423  -2.123
   15    HB2  ASN   3           2HB      ASN   3  -5.907   3.292  -4.418
   16    HB3  ASN   3           1HB      ASN   3  -5.448   4.893  -3.862
   17   HD21  ASN   3          1HD2      ASN   3  -3.735   4.753  -5.442
   18   HD22  ASN   3          2HD2      ASN   3  -2.301   3.884  -5.068
   19    H    GLU   4           H        GLU   4  -4.666   2.378  -0.358
   20    HA   GLU   4           HA       GLU   4  -3.995   4.678   1.138
   21    HB2  GLU   4           2HB      GLU   4  -3.152   1.797   1.399
   22    HB3  GLU   4           1HB      GLU   4  -2.711   3.039   2.548
   23    HG2  GLU   4           2HG      GLU   4  -4.547   1.761   3.427
   24    HG3  GLU   4           1HG      GLU   4  -5.099   3.383   3.061
   25    H    CYS   5           H        CYS   5  -2.398   2.765  -1.265
   26    HA   CYS   5           HA       CYS   5   0.300   3.433  -0.721
   27    HB2  CYS   5           2HB      CYS   5  -1.048   2.580  -3.265
   28    HB3  CYS   5           1HB      CYS   5   0.685   2.640  -3.003
   29    H    LEU   6           H        LEU   6  -2.234   4.990  -2.220
   30    HA   LEU   6           HA       LEU   6  -1.019   6.833  -3.976
   31    HB2  LEU   6           2HB      LEU   6  -3.521   6.222  -3.453
   32    HB3  LEU   6           1HB      LEU   6  -3.408   7.511  -2.296
   33    HG   LEU   6           HG       LEU   6  -2.983   7.883  -5.270
   34   HD11  LEU   6          1HD1      LEU   6  -5.205   8.904  -5.267
   35   HD12  LEU   6          2HD1      LEU   6  -5.406   8.446  -3.575
   36   HD13  LEU   6          3HD1      LEU   6  -5.259   7.201  -4.815
   37   HD21  LEU   6          3HD2      LEU   6  -1.887   9.595  -3.883
   38   HD22  LEU   6          1HD2      LEU   6  -3.418   9.909  -3.067
   39   HD23  LEU   6          2HD2      LEU   6  -3.246  10.268  -4.787
   40    H    ASP   7           H        ASP   7  -1.459   6.799  -0.528
   41    HA   ASP   7           HA       ASP   7  -0.384   9.508  -0.256
   42    HB2  ASP   7           2HB      ASP   7  -2.398   9.074   1.042
   43    HB3  ASP   7           1HB      ASP   7  -1.643   7.673   1.789
   44    H    ASN   8           H        ASN   8   1.684   9.397  -0.520
   45    HA   ASN   8           HA       ASN   8   3.896   9.004  -0.228
   46    HB2  ASN   8           2HB      ASN   8   3.022   8.467   2.597
   47    HB3  ASN   8           1HB      ASN   8   4.685   8.652   2.042
   48   HD21  ASN   8          1HD2      ASN   8   5.421  10.714   1.490
   49   HD22  ASN   8          2HD2      ASN   8   4.539  12.154   1.822
   50    H    ASN   9           H        ASN   9   2.546   6.921  -1.213
   51    HA   ASN   9           HA       ASN   9   2.884   4.784  -1.968
   52    HB2  ASN   9           2HB      ASN   9   5.312   5.610  -2.050
   53    HB3  ASN   9           1HB      ASN   9   5.543   4.811  -0.501
   54   HD21  ASN   9          1HD2      ASN   9   7.002   3.289  -1.187
   55   HD22  ASN   9          2HD2      ASN   9   6.613   2.029  -2.283
   56    H    GLY  10           H        GLY  10   1.689   5.367   0.645
   57    HA2  GLY  10           2HA      GLY  10   0.603   4.113   2.244
   58    HA3  GLY  10           1HA      GLY  10   1.297   2.673   1.516
   59    H    GLY  11           H        GLY  11   3.756   4.813   2.152
   60    HA2  GLY  11           2HA      GLY  11   5.271   5.016   3.862
   61    HA3  GLY  11           1HA      GLY  11   4.192   4.087   4.898
   62    H    CYS  12           H        CYS  12   4.730   2.623   1.885
   63    HA   CYS  12           HA       CYS  12   6.266   0.545   3.144
   64    HB2  CYS  12           2HB      CYS  12   5.290   0.830   0.291
   65    HB3  CYS  12           1HB      CYS  12   5.966  -0.630   1.000
   66    H    SER  13           H        SER  13   8.400   0.144   2.776
   67    HA   SER  13           HA       SER  13   9.933   2.228   1.539
   68    HB2  SER  13           2HB      SER  13  11.850   0.800   2.422
   69    HB3  SER  13           1HB      SER  13  10.745   1.442   3.639
   70    HG   SER  13           HG       SER  13  10.075  -0.502   4.084
   71    H    HIS  14           H        HIS  14   8.415  -0.475   0.547
   72    HA   HIS  14           HA       HIS  14  10.139  -0.760  -1.809
   73    HB2  HIS  14           2HB      HIS  14   8.683  -3.021  -0.391
   74    HB3  HIS  14           1HB      HIS  14   9.551  -3.192  -1.901
   75    HD1  HIS  14           1HD      HIS  14  12.165  -3.346  -1.756
   76    HD2  HIS  14           2HD      HIS  14  10.282  -2.840   1.914
   77    HE1  HIS  14           1HE      HIS  14  13.913  -3.764  -0.038
   78    HE2  HIS  14           2HE      HIS  14  12.826  -3.075   2.105
   79    H    VAL  15           H        VAL  15   8.437  -2.413  -3.301
   80    HA   VAL  15           HA       VAL  15   6.510  -0.660  -4.311
   81    HB   VAL  15           HB       VAL  15   6.427  -3.698  -4.453
   82   HG11  VAL  15          1HG1      VAL  15   5.208  -1.643  -6.290
   83   HG12  VAL  15          2HG1      VAL  15   4.338  -2.681  -5.163
   84   HG13  VAL  15          3HG1      VAL  15   5.187  -3.390  -6.538
   85   HG21  VAL  15          3HG2      VAL  15   8.586  -2.866  -5.223
   86   HG22  VAL  15          1HG2      VAL  15   7.779  -1.735  -6.308
   87   HG23  VAL  15          2HG2      VAL  15   7.638  -3.473  -6.580
   88    H    CYS  16           H        CYS  16   4.481  -0.144  -3.674
   89    HA   CYS  16           HA       CYS  16   3.402  -1.453  -1.307
   90    HB2  CYS  16           2HB      CYS  16   3.526   1.071  -1.472
   91    HB3  CYS  16           1HB      CYS  16   2.394   0.966  -2.816
   92    H    ASN  17           H        ASN  17   1.352  -2.454  -1.374
   93    HA   ASN  17           HA       ASN  17   0.239  -2.802  -4.060
   94    HB2  ASN  17           2HB      ASN  17   1.423  -4.879  -3.393
   95    HB3  ASN  17           1HB      ASN  17   0.421  -4.964  -1.947
   96   HD21  ASN  17          1HD2      ASN  17  -0.530  -6.987  -2.531
   97   HD22  ASN  17          2HD2      ASN  17  -1.622  -7.087  -3.850
   98    H    ASP  18           H        ASP  18  -1.538  -1.740  -4.031
   99    HA   ASP  18           HA       ASP  18  -3.050  -1.334  -1.660
  100    HB2  ASP  18           2HB      ASP  18  -3.083   0.468  -3.139
  101    HB3  ASP  18           1HB      ASP  18  -3.462  -0.515  -4.536
  102    H    LEU  19           H        LEU  19  -4.239  -2.801  -0.806
  103    HA   LEU  19           HA       LEU  19  -5.555  -4.820  -2.454
  104    HB2  LEU  19           2HB      LEU  19  -5.502  -4.629   0.559
  105    HB3  LEU  19           1HB      LEU  19  -6.033  -5.955  -0.417
  106    HG   LEU  19           HG       LEU  19  -3.163  -5.055  -0.412
  107   HD11  LEU  19          1HD1      LEU  19  -4.500  -7.312   1.062
  108   HD12  LEU  19          2HD1      LEU  19  -3.757  -5.881   1.780
  109   HD13  LEU  19          3HD1      LEU  19  -2.759  -7.064   0.933
  110   HD21  LEU  19          3HD2      LEU  19  -4.527  -7.527  -1.480
  111   HD22  LEU  19          1HD2      LEU  19  -2.792  -7.215  -1.493
  112   HD23  LEU  19          2HD2      LEU  19  -3.874  -6.202  -2.445
  113    H    LYS  20           H        LYS  20  -7.830  -5.364  -1.669
  114    HA   LYS  20           HA       LYS  20  -9.435  -3.153  -2.254
  115    HB2  LYS  20           2HB      LYS  20 -10.048  -5.570  -2.607
  116    HB3  LYS  20           1HB      LYS  20 -10.319  -5.693  -0.881
  117    HG2  LYS  20           2HG      LYS  20 -12.388  -5.421  -2.211
  118    HG3  LYS  20           1HG      LYS  20 -12.156  -4.164  -0.992
  119    HD2  LYS  20           2HD      LYS  20 -11.430  -2.592  -2.635
  120    HD3  LYS  20           1HD      LYS  20 -11.348  -3.837  -3.882
  121    HE2  LYS  20           2HE      LYS  20 -13.320  -2.325  -4.038
  122    HE3  LYS  20           1HE      LYS  20 -13.724  -4.033  -3.922
  123    HZ1  LYS  20           3HZ      LYS  20 -14.253  -3.729  -1.612
  124    HZ2  LYS  20           1HZ      LYS  20 -15.131  -2.640  -2.524
  125    HZ3  LYS  20           2HZ      LYS  20 -13.805  -2.112  -1.642
  126    H    ILE  21           H        ILE  21  -8.896  -4.791   0.804
  127    HA   ILE  21           HA       ILE  21  -9.713  -2.299   2.052
  128    HB   ILE  21           HB       ILE  21 -10.219  -3.541   4.144
  129   HG12  ILE  21          2HG1      ILE  21 -10.086  -6.048   2.465
  130   HG13  ILE  21          1HG1      ILE  21  -8.830  -5.562   3.603
  131   HG21  ILE  21          1HG2      ILE  21 -12.382  -4.472   3.436
  132   HG22  ILE  21          2HG2      ILE  21 -11.849  -4.381   1.757
  133   HG23  ILE  21          3HG2      ILE  21 -12.038  -2.905   2.703
  134   HD11  ILE  21          3HD1      ILE  21 -10.430  -5.671   5.397
  135   HD12  ILE  21          1HD1      ILE  21 -10.297  -7.226   4.569
  136   HD13  ILE  21          2HD1      ILE  21 -11.690  -6.171   4.265
  137    H    GLY  22           H        GLY  22  -8.346  -1.411   3.386
  138    HA2  GLY  22           2HA      GLY  22  -6.221  -0.844   4.107
  139    HA3  GLY  22           1HA      GLY  22  -5.980  -2.566   4.378
  140    H    TYR  23           H        TYR  23  -3.899  -2.712   3.587
  141    HA   TYR  23           HA       TYR  23  -3.469  -2.927   0.801
  142    HB2  TYR  23           2HB      TYR  23  -1.902  -1.116   0.477
  143    HB3  TYR  23           1HB      TYR  23  -3.366  -0.399   1.133
  144    HD1  TYR  23           2HD      TYR  23  -3.369  -0.115   3.782
  145    HD2  TYR  23           1HD      TYR  23   0.138  -0.556   1.417
  146    HE1  TYR  23           2HE      TYR  23  -2.035   0.887   5.581
  147    HE2  TYR  23           1HE      TYR  23   1.476   0.433   3.214
  148    HH   TYR  23           HH       TYR  23   1.109   1.951   5.104
  149    H    GLU  24           H        GLU  24  -0.988  -3.367   0.520
  150    HA   GLU  24           HA       GLU  24   0.252  -4.208   3.000
  151    HB2  GLU  24           2HB      GLU  24   0.791  -6.402   2.185
  152    HB3  GLU  24           1HB      GLU  24  -0.945  -6.193   2.041
  153    HG2  GLU  24           2HG      GLU  24  -0.718  -5.761  -0.329
  154    HG3  GLU  24           1HG      GLU  24   1.037  -5.890  -0.190
  155    H    CYS  25           H        CYS  25   2.563  -4.681   2.606
  156    HA   CYS  25           HA       CYS  25   3.603  -3.092   0.366
  157    HB2  CYS  25           2HB      CYS  25   5.004  -3.859   2.949
  158    HB3  CYS  25           1HB      CYS  25   5.591  -2.767   1.703
  159    H    LEU  26           H        LEU  26   4.940  -4.120  -1.076
  160    HA   LEU  26           HA       LEU  26   5.579  -6.944  -0.534
  161    HB2  LEU  26           2HB      LEU  26   5.021  -5.615  -3.199
  162    HB3  LEU  26           1HB      LEU  26   5.541  -7.273  -2.999
  163    HG   LEU  26           HG       LEU  26   2.928  -6.092  -2.094
  164   HD11  LEU  26          1HD1      LEU  26   3.586  -8.022  -4.319
  165   HD12  LEU  26          2HD1      LEU  26   3.080  -6.343  -4.510
  166   HD13  LEU  26          3HD1      LEU  26   1.963  -7.530  -3.836
  167   HD21  LEU  26          3HD2      LEU  26   2.297  -8.398  -1.558
  168   HD22  LEU  26          1HD2      LEU  26   3.666  -7.867  -0.587
  169   HD23  LEU  26          2HD2      LEU  26   3.927  -8.941  -1.962
  170    HN1  NH2  27           1H       LEU  26   6.700  -5.078  -3.244
  171    HN2  NH2  27           2H       LEU  26   8.356  -5.016  -2.762
  Start of MODEL    3
    1    H1   GLY   1           1HT      GLY   1 -13.415   3.465  -1.775
    2    H2   GLY   1           2HT      GLY   1 -13.426   4.070  -0.211
    3    H3   GLY   1           3HT      GLY   1 -14.196   2.591  -0.566
    4    HA2  GLY   1           1HA      GLY   1 -12.070   2.241   0.524
    5    HA3  GLY   1           2HA      GLY   1 -12.101   1.593  -1.113
    6    H    THR   2           H        THR   2  -9.969   2.803   0.767
    7    HA   THR   2           HA       THR   2  -9.126   5.161  -0.673
    8    HB   THR   2           HB       THR   2  -7.346   4.913   1.234
    9    HG1  THR   2           1HG      THR   2  -7.739   3.095   2.206
   10   HG21  THR   2          3HG2      THR   2  -9.022   6.700   1.099
   11   HG22  THR   2          1HG2      THR   2  -8.847   6.104   2.750
   12   HG23  THR   2          2HG2      THR   2 -10.239   5.609   1.777
   13    H    ASN   3           H        ASN   3  -7.252   5.244  -1.892
   14    HA   ASN   3           HA       ASN   3  -5.756   2.743  -2.213
   15    HB2  ASN   3           2HB      ASN   3  -6.559   3.888  -4.308
   16    HB3  ASN   3           1HB      ASN   3  -5.580   5.278  -3.876
   17   HD21  ASN   3          1HD2      ASN   3  -5.524   3.410  -6.191
   18   HD22  ASN   3          2HD2      ASN   3  -3.888   2.860  -6.274
   19    H    GLU   4           H        GLU   4  -4.638   2.763  -0.384
   20    HA   GLU   4           HA       GLU   4  -3.408   4.922   0.846
   21    HB2  GLU   4           2HB      GLU   4  -2.728   1.998   1.013
   22    HB3  GLU   4           1HB      GLU   4  -2.094   3.226   2.084
   23    HG2  GLU   4           2HG      GLU   4  -3.824   2.127   3.245
   24    HG3  GLU   4           1HG      GLU   4  -4.455   3.697   2.777
   25    H    CYS   5           H        CYS   5  -2.215   2.757  -1.614
   26    HA   CYS   5           HA       CYS   5   0.521   3.265  -1.222
   27    HB2  CYS   5           2HB      CYS   5  -0.924   2.273  -3.654
   28    HB3  CYS   5           1HB      CYS   5   0.814   2.261  -3.422
   29    H    LEU   6           H        LEU   6  -1.868   4.922  -3.041
   30    HA   LEU   6           HA       LEU   6  -0.145   6.589  -4.566
   31    HB2  LEU   6           2HB      LEU   6  -2.932   7.020  -3.566
   32    HB3  LEU   6           1HB      LEU   6  -2.097   8.190  -4.555
   33    HG   LEU   6           HG       LEU   6  -2.896   5.373  -5.332
   34   HD11  LEU   6          1HD1      LEU   6  -4.391   6.480  -6.912
   35   HD12  LEU   6          2HD1      LEU   6  -3.890   8.051  -6.285
   36   HD13  LEU   6          3HD1      LEU   6  -4.762   6.925  -5.245
   37   HD21  LEU   6          3HD2      LEU   6  -1.464   7.479  -6.962
   38   HD22  LEU   6          1HD2      LEU   6  -2.106   5.962  -7.592
   39   HD23  LEU   6          2HD2      LEU   6  -0.794   5.937  -6.422
   40    H    ASP   7           H        ASP   7  -1.214   6.715  -1.322
   41    HA   ASP   7           HA       ASP   7  -0.099   9.398  -0.921
   42    HB2  ASP   7           2HB      ASP   7  -2.321   8.973   0.068
   43    HB3  ASP   7           1HB      ASP   7  -1.632   7.646   0.999
   44    H    ASN   8           H        ASN   8   2.054   9.213  -0.822
   45    HA   ASN   8           HA       ASN   8   4.114   8.905   0.117
   46    HB2  ASN   8           2HB      ASN   8   2.425   8.072   2.469
   47    HB3  ASN   8           1HB      ASN   8   4.183   8.150   2.494
   48   HD21  ASN   8          1HD2      ASN   8   3.882   9.669   4.197
   49   HD22  ASN   8          2HD2      ASN   8   3.536  11.333   3.876
   50    H    ASN   9           H        ASN   9   2.817   6.821  -1.316
   51    HA   ASN   9           HA       ASN   9   2.999   4.636  -1.979
   52    HB2  ASN   9           2HB      ASN   9   5.456   5.308  -1.995
   53    HB3  ASN   9           1HB      ASN   9   5.593   4.586  -0.396
   54   HD21  ASN   9          1HD2      ASN   9   6.939   2.973  -0.896
   55   HD22  ASN   9          2HD2      ASN   9   6.589   1.643  -1.925
   56    H    GLY  10           H        GLY  10   1.530   5.209   0.403
   57    HA2  GLY  10           2HA      GLY  10   0.287   3.936   1.868
   58    HA3  GLY  10           1HA      GLY  10   1.256   2.537   1.428
   59    H    GLY  11           H        GLY  11   3.286   5.010   2.180
   60    HA2  GLY  11           2HA      GLY  11   4.509   5.558   4.046
   61    HA3  GLY  11           1HA      GLY  11   3.422   4.573   5.025
   62    H    CYS  12           H        CYS  12   4.641   3.099   2.160
   63    HA   CYS  12           HA       CYS  12   6.389   1.458   3.821
   64    HB2  CYS  12           2HB      CYS  12   4.914   0.871   1.260
   65    HB3  CYS  12           1HB      CYS  12   6.029  -0.250   2.027
   66    H    SER  13           H        SER  13   8.442   1.000   3.152
   67    HA   SER  13           HA       SER  13   9.586   2.875   1.269
   68    HB2  SER  13           2HB      SER  13  10.612   2.536   3.506
   69    HB3  SER  13           1HB      SER  13  10.903   0.850   3.100
   70    HG   SER  13           HG       SER  13  12.258   1.555   1.421
   71    H    HIS  14           H        HIS  14   8.318  -0.192   1.171
   72    HA   HIS  14           HA       HIS  14   9.987  -0.917  -1.125
   73    HB2  HIS  14           2HB      HIS  14   8.493  -2.737   0.772
   74    HB3  HIS  14           1HB      HIS  14   9.199  -3.286  -0.734
   75    HD1  HIS  14           1HD      HIS  14   9.967  -2.946   2.773
   76    HD2  HIS  14           2HD      HIS  14  12.122  -2.811  -0.781
   77    HE1  HIS  14           1HE      HIS  14  12.332  -3.375   3.405
   78    HE2  HIS  14           2HE      HIS  14  13.626  -2.975   1.299
   79    H    VAL  15           H        VAL  15   8.339  -2.879  -2.236
   80    HA   VAL  15           HA       VAL  15   6.658  -1.394  -3.884
   81    HB   VAL  15           HB       VAL  15   6.515  -4.347  -3.270
   82   HG11  VAL  15          1HG1      VAL  15   5.558  -4.572  -5.523
   83   HG12  VAL  15          2HG1      VAL  15   5.552  -2.812  -5.674
   84   HG13  VAL  15          3HG1      VAL  15   4.549  -3.595  -4.454
   85   HG21  VAL  15          3HG2      VAL  15   7.971  -4.640  -5.251
   86   HG22  VAL  15          1HG2      VAL  15   8.765  -3.760  -3.943
   87   HG23  VAL  15          2HG2      VAL  15   8.145  -2.887  -5.341
   88    H    CYS  16           H        CYS  16   4.766  -0.461  -3.355
   89    HA   CYS  16           HA       CYS  16   3.123  -1.735  -1.303
   90    HB2  CYS  16           2HB      CYS  16   3.597   0.767  -1.117
   91    HB3  CYS  16           1HB      CYS  16   2.668   0.956  -2.596
   92    H    ASN  17           H        ASN  17   1.379  -2.677  -1.784
   93    HA   ASN  17           HA       ASN  17   0.385  -2.770  -4.556
   94    HB2  ASN  17           2HB      ASN  17   1.490  -4.857  -3.883
   95    HB3  ASN  17           1HB      ASN  17   0.497  -4.963  -2.442
   96   HD21  ASN  17          1HD2      ASN  17  -0.340  -6.975  -3.008
   97   HD22  ASN  17          2HD2      ASN  17  -1.462  -7.177  -4.296
   98    H    ASP  18           H        ASP  18  -1.467  -1.674  -4.543
   99    HA   ASP  18           HA       ASP  18  -2.941  -1.318  -2.106
  100    HB2  ASP  18           2HB      ASP  18  -2.871   0.621  -3.446
  101    HB3  ASP  18           1HB      ASP  18  -3.371  -0.262  -4.886
  102    H    LEU  19           H        LEU  19  -4.354  -2.608  -1.376
  103    HA   LEU  19           HA       LEU  19  -5.799  -4.404  -3.178
  104    HB2  LEU  19           2HB      LEU  19  -5.709  -4.429  -0.158
  105    HB3  LEU  19           1HB      LEU  19  -6.392  -5.644  -1.190
  106    HG   LEU  19           HG       LEU  19  -3.449  -5.035  -0.960
  107   HD11  LEU  19          1HD1      LEU  19  -5.096  -7.356   0.020
  108   HD12  LEU  19          2HD1      LEU  19  -4.301  -6.133   1.014
  109   HD13  LEU  19          3HD1      LEU  19  -3.338  -7.265   0.064
  110   HD21  LEU  19          3HD2      LEU  19  -3.139  -7.019  -2.357
  111   HD22  LEU  19          1HD2      LEU  19  -4.050  -5.776  -3.212
  112   HD23  LEU  19          2HD2      LEU  19  -4.888  -7.172  -2.534
  113    H    LYS  20           H        LYS  20  -8.171  -4.680  -2.502
  114    HA   LYS  20           HA       LYS  20  -9.399  -2.121  -2.571
  115    HB2  LYS  20           2HB      LYS  20 -10.690  -4.792  -1.944
  116    HB3  LYS  20           1HB      LYS  20 -11.559  -3.305  -2.282
  117    HG2  LYS  20           2HG      LYS  20  -9.773  -4.790  -4.204
  118    HG3  LYS  20           1HG      LYS  20 -11.535  -4.744  -4.229
  119    HD2  LYS  20           2HD      LYS  20 -11.476  -2.347  -4.655
  120    HD3  LYS  20           1HD      LYS  20  -9.716  -2.360  -4.560
  121    HE2  LYS  20           2HE      LYS  20 -10.379  -2.345  -6.860
  122    HE3  LYS  20           1HE      LYS  20  -9.654  -3.901  -6.477
  123    HZ1  LYS  20           3HZ      LYS  20 -11.944  -4.803  -6.259
  124    HZ2  LYS  20           1HZ      LYS  20 -11.620  -4.210  -7.807
  125    HZ3  LYS  20           2HZ      LYS  20 -12.544  -3.309  -6.731
  126    H    ILE  21           H        ILE  21  -9.056  -4.478  -0.026
  127    HA   ILE  21           HA       ILE  21  -9.812  -2.377   1.861
  128    HB   ILE  21           HB       ILE  21  -9.917  -5.388   2.253
  129   HG12  ILE  21          2HG1      ILE  21 -11.763  -4.603   0.870
  130   HG13  ILE  21          1HG1      ILE  21 -12.345  -5.048   2.471
  131   HG21  ILE  21          1HG2      ILE  21 -10.652  -3.185   4.175
  132   HG22  ILE  21          2HG2      ILE  21  -9.283  -4.288   4.327
  133   HG23  ILE  21          3HG2      ILE  21 -10.935  -4.905   4.439
  134   HD11  ILE  21          3HD1      ILE  21 -13.430  -3.023   1.684
  135   HD12  ILE  21          1HD1      ILE  21 -11.863  -2.238   1.489
  136   HD13  ILE  21          2HD1      ILE  21 -12.433  -2.684   3.096
  137    H    GLY  22           H        GLY  22  -8.151  -1.451   2.564
  138    HA2  GLY  22           2HA      GLY  22  -6.141  -1.135   3.622
  139    HA3  GLY  22           1HA      GLY  22  -5.942  -2.886   3.698
  140    H    TYR  23           H        TYR  23  -3.890  -2.919   2.998
  141    HA   TYR  23           HA       TYR  23  -3.471  -2.920   0.212
  142    HB2  TYR  23           2HB      TYR  23  -1.598  -1.294   0.180
  143    HB3  TYR  23           1HB      TYR  23  -3.114  -0.511   0.585
  144    HD1  TYR  23           2HD      TYR  23  -3.542  -0.209   3.176
  145    HD2  TYR  23           1HD      TYR  23   0.284  -0.841   1.456
  146    HE1  TYR  23           2HE      TYR  23  -2.510   0.798   5.142
  147    HE2  TYR  23           1HE      TYR  23   1.340   0.176   3.427
  148    HH   TYR  23           HH       TYR  23   0.751   1.742   5.152
  149    H    GLU  24           H        GLU  24  -1.035  -3.453  -0.112
  150    HA   GLU  24           HA       GLU  24  -0.104  -5.199   2.048
  151    HB2  GLU  24           2HB      GLU  24  -1.393  -6.541   0.509
  152    HB3  GLU  24           1HB      GLU  24  -0.575  -5.839  -0.869
  153    HG2  GLU  24           2HG      GLU  24   1.506  -6.897  -0.108
  154    HG3  GLU  24           1HG      GLU  24   0.604  -7.686   1.195
  155    H    CYS  25           H        CYS  25   2.066  -4.758   2.371
  156    HA   CYS  25           HA       CYS  25   3.433  -3.541   0.109
  157    HB2  CYS  25           2HB      CYS  25   4.040  -3.284   3.059
  158    HB3  CYS  25           1HB      CYS  25   5.044  -2.619   1.772
  159    H    LEU  26           H        LEU  26   5.021  -4.501  -0.791
  160    HA   LEU  26           HA       LEU  26   5.865  -7.077   0.314
  161    HB2  LEU  26           2HB      LEU  26   6.035  -6.085  -2.550
  162    HB3  LEU  26           1HB      LEU  26   6.580  -7.641  -1.989
  163    HG   LEU  26           HG       LEU  26   4.151  -8.126  -1.398
  164   HD11  LEU  26          1HD1      LEU  26   3.291  -5.858  -1.431
  165   HD12  LEU  26          2HD1      LEU  26   2.443  -6.876  -2.595
  166   HD13  LEU  26          3HD1      LEU  26   3.664  -5.729  -3.150
  167   HD21  LEU  26          3HD2      LEU  26   5.241  -9.120  -3.301
  168   HD22  LEU  26          1HD2      LEU  26   4.909  -7.687  -4.274
  169   HD23  LEU  26          2HD2      LEU  26   3.579  -8.695  -3.710
  170    HN1  NH2  27           1H       LEU  26   7.538  -6.543   1.546
  171    HN2  NH2  27           2H       LEU  26   8.936  -5.675   1.022
  Start of MODEL    4
    1    H1   GLY   1           1HT      GLY   1 -13.082   4.036  -0.426
    2    H2   GLY   1           2HT      GLY   1 -13.985   2.785  -1.119
    3    H3   GLY   1           3HT      GLY   1 -13.139   3.865  -2.094
    4    HA2  GLY   1           1HA      GLY   1 -11.881   1.968  -0.230
    5    HA3  GLY   1           2HA      GLY   1 -11.998   1.779  -1.971
    6    H    THR   2           H        THR   2 -10.454   3.405   0.647
    7    HA   THR   2           HA       THR   2  -9.090   5.418  -0.710
    8    HB   THR   2           HB       THR   2  -8.282   3.956   1.809
    9    HG1  THR   2           1HG      THR   2 -10.001   6.205   1.516
   10   HG21  THR   2          3HG2      THR   2  -7.860   6.816   0.905
   11   HG22  THR   2          1HG2      THR   2  -6.626   5.557   0.912
   12   HG23  THR   2          2HG2      THR   2  -7.314   6.123   2.432
   13    H    ASN   3           H        ASN   3  -7.144   5.398  -1.796
   14    HA   ASN   3           HA       ASN   3  -5.717   2.847  -1.965
   15    HB2  ASN   3           2HB      ASN   3  -6.453   3.818  -4.144
   16    HB3  ASN   3           1HB      ASN   3  -5.517   5.263  -3.796
   17   HD21  ASN   3          1HD2      ASN   3  -5.316   3.361  -6.012
   18   HD22  ASN   3          2HD2      ASN   3  -3.689   2.795  -6.003
   19    H    GLU   4           H        GLU   4  -4.511   2.896  -0.229
   20    HA   GLU   4           HA       GLU   4  -3.333   5.133   0.931
   21    HB2  GLU   4           2HB      GLU   4  -2.654   2.208   1.181
   22    HB3  GLU   4           1HB      GLU   4  -1.987   3.469   2.196
   23    HG2  GLU   4           2HG      GLU   4  -3.723   2.352   3.397
   24    HG3  GLU   4           1HG      GLU   4  -4.277   3.970   3.004
   25    H    CYS   5           H        CYS   5  -2.247   2.976  -1.573
   26    HA   CYS   5           HA       CYS   5   0.520   3.425  -1.331
   27    HB2  CYS   5           2HB      CYS   5  -1.103   2.544  -3.693
   28    HB3  CYS   5           1HB      CYS   5   0.650   2.471  -3.584
   29    H    LEU   6           H        LEU   6  -1.973   5.119  -2.957
   30    HA   LEU   6           HA       LEU   6  -0.405   6.748  -4.635
   31    HB2  LEU   6           2HB      LEU   6  -3.065   7.207  -3.360
   32    HB3  LEU   6           1HB      LEU   6  -2.315   8.375  -4.421
   33    HG   LEU   6           HG       LEU   6  -3.190   5.560  -5.141
   34   HD11  LEU   6          1HD1      LEU   6  -4.834   6.660  -6.564
   35   HD12  LEU   6          2HD1      LEU   6  -4.288   8.233  -5.986
   36   HD13  LEU   6          3HD1      LEU   6  -5.050   7.100  -4.871
   37   HD21  LEU   6          3HD2      LEU   6  -1.223   6.123  -6.432
   38   HD22  LEU   6          1HD2      LEU   6  -1.919   7.688  -6.865
   39   HD23  LEU   6          2HD2      LEU   6  -2.648   6.201  -7.460
   40    H    ASP   7           H        ASP   7  -1.044   6.926  -1.290
   41    HA   ASP   7           HA       ASP   7   0.212   9.585  -1.113
   42    HB2  ASP   7           2HB      ASP   7  -2.018   9.325  -0.030
   43    HB3  ASP   7           1HB      ASP   7  -1.321   8.112   1.039
   44    H    ASN   8           H        ASN   8   2.317   9.341  -0.957
   45    HA   ASN   8           HA       ASN   8   4.357   8.830  -0.199
   46    HB2  ASN   8           2HB      ASN   8   2.826   8.327   2.338
   47    HB3  ASN   8           1HB      ASN   8   4.582   8.216   2.195
   48   HD21  ASN   8          1HD2      ASN   8   1.823  10.381   2.246
   49   HD22  ASN   8          2HD2      ASN   8   2.768  11.823   2.347
   50    H    ASN   9           H        ASN   9   3.014   6.852  -1.526
   51    HA   ASN   9           HA       ASN   9   3.287   4.709  -2.252
   52    HB2  ASN   9           2HB      ASN   9   5.716   5.424  -2.142
   53    HB3  ASN   9           1HB      ASN   9   5.794   4.699  -0.542
   54   HD21  ASN   9          1HD2      ASN   9   7.388   3.255  -1.181
   55   HD22  ASN   9          2HD2      ASN   9   7.067   1.912  -2.201
   56    H    GLY  10           H        GLY  10   1.690   5.177   0.043
   57    HA2  GLY  10           2HA      GLY  10   0.345   3.865   1.366
   58    HA3  GLY  10           1HA      GLY  10   1.204   2.470   0.750
   59    H    GLY  11           H        GLY  11   3.290   4.745   2.104
   60    HA2  GLY  11           2HA      GLY  11   4.369   4.837   4.157
   61    HA3  GLY  11           1HA      GLY  11   3.144   3.747   4.809
   62    H    CYS  12           H        CYS  12   4.387   2.626   1.929
   63    HA   CYS  12           HA       CYS  12   5.878   0.595   3.307
   64    HB2  CYS  12           2HB      CYS  12   5.022   0.863   0.425
   65    HB3  CYS  12           1HB      CYS  12   5.853  -0.530   1.107
   66    H    SER  13           H        SER  13   8.052   0.477   3.231
   67    HA   SER  13           HA       SER  13   9.545   2.484   1.884
   68    HB2  SER  13           2HB      SER  13  11.437   0.986   2.875
   69    HB3  SER  13           1HB      SER  13  10.418   1.912   3.980
   70    HG   SER  13           HG       SER  13  10.150   0.084   4.851
   71    H    HIS  14           H        HIS  14   8.468  -0.715   1.385
   72    HA   HIS  14           HA       HIS  14  10.093  -1.009  -1.042
   73    HB2  HIS  14           2HB      HIS  14   8.314  -2.984   0.410
   74    HB3  HIS  14           1HB      HIS  14   9.015  -3.314  -1.153
   75    HD1  HIS  14           1HD      HIS  14  11.300  -4.286  -1.188
   76    HD2  HIS  14           2HD      HIS  14  10.286  -2.714   2.509
   77    HE1  HIS  14           1HE      HIS  14  13.162  -4.965   0.353
   78    HE2  HIS  14           2HE      HIS  14  12.423  -4.159   2.632
   79    H    VAL  15           H        VAL  15   8.423  -2.419  -2.657
   80    HA   VAL  15           HA       VAL  15   6.722  -0.476  -3.782
   81    HB   VAL  15           HB       VAL  15   6.522  -3.492  -4.145
   82   HG11  VAL  15          1HG1      VAL  15   4.564  -2.334  -4.999
   83   HG12  VAL  15          2HG1      VAL  15   5.529  -2.976  -6.328
   84   HG13  VAL  15          3HG1      VAL  15   5.591  -1.256  -5.945
   85   HG21  VAL  15          3HG2      VAL  15   7.942  -3.175  -6.142
   86   HG22  VAL  15          1HG2      VAL  15   8.780  -2.761  -4.647
   87   HG23  VAL  15          2HG2      VAL  15   8.161  -1.484  -5.692
   88    H    CYS  16           H        CYS  16   4.662   0.095  -3.319
   89    HA   CYS  16           HA       CYS  16   3.289  -1.266  -1.153
   90    HB2  CYS  16           2HB      CYS  16   3.380   1.251  -1.293
   91    HB3  CYS  16           1HB      CYS  16   2.440   1.127  -2.777
   92    H    ASN  17           H        ASN  17   1.358  -2.325  -1.422
   93    HA   ASN  17           HA       ASN  17   0.375  -2.576  -4.166
   94    HB2  ASN  17           2HB      ASN  17   1.539  -4.668  -3.490
   95    HB3  ASN  17           1HB      ASN  17   0.445  -4.798  -2.114
   96   HD21  ASN  17          1HD2      ASN  17  -0.492  -6.734  -2.776
   97   HD22  ASN  17          2HD2      ASN  17  -1.511  -6.837  -4.155
   98    H    ASP  18           H        ASP  18  -1.496  -1.638  -4.203
   99    HA   ASP  18           HA       ASP  18  -3.010  -1.291  -1.797
  100    HB2  ASP  18           2HB      ASP  18  -3.079   0.555  -3.336
  101    HB3  ASP  18           1HB      ASP  18  -3.616  -0.488  -4.648
  102    H    LEU  19           H        LEU  19  -4.582  -2.436  -1.080
  103    HA   LEU  19           HA       LEU  19  -5.609  -4.621  -2.739
  104    HB2  LEU  19           2HB      LEU  19  -5.792  -4.292   0.250
  105    HB3  LEU  19           1HB      LEU  19  -6.239  -5.686  -0.672
  106    HG   LEU  19           HG       LEU  19  -3.407  -4.718  -0.326
  107   HD11  LEU  19          1HD1      LEU  19  -3.146  -6.743   1.016
  108   HD12  LEU  19          2HD1      LEU  19  -4.875  -7.063   0.848
  109   HD13  LEU  19          3HD1      LEU  19  -4.322  -5.632   1.716
  110   HD21  LEU  19          3HD2      LEU  19  -3.754  -5.804  -2.480
  111   HD22  LEU  19          1HD2      LEU  19  -4.507  -7.179  -1.672
  112   HD23  LEU  19          2HD2      LEU  19  -2.802  -6.821  -1.401
  113    H    LYS  20           H        LYS  20  -7.965  -5.042  -2.297
  114    HA   LYS  20           HA       LYS  20  -9.415  -2.596  -2.592
  115    HB2  LYS  20           2HB      LYS  20 -10.139  -4.816  -3.591
  116    HB3  LYS  20           1HB      LYS  20 -10.561  -5.336  -1.966
  117    HG2  LYS  20           2HG      LYS  20 -12.579  -4.629  -3.015
  118    HG3  LYS  20           1HG      LYS  20 -12.131  -3.384  -1.846
  119    HD2  LYS  20           2HD      LYS  20 -11.104  -2.077  -3.683
  120    HD3  LYS  20           1HD      LYS  20 -11.661  -3.295  -4.825
  121    HE2  LYS  20           2HE      LYS  20 -13.217  -1.478  -4.888
  122    HE3  LYS  20           1HE      LYS  20 -13.997  -2.825  -4.064
  123    HZ1  LYS  20           3HZ      LYS  20 -14.387  -0.702  -2.949
  124    HZ2  LYS  20           1HZ      LYS  20 -12.743  -0.484  -2.738
  125    HZ3  LYS  20           2HZ      LYS  20 -13.534  -1.729  -1.928
  126    H    ILE  21           H        ILE  21  -9.041  -5.010  -0.114
  127    HA   ILE  21           HA       ILE  21 -10.198  -3.149   1.791
  128    HB   ILE  21           HB       ILE  21 -11.400  -5.248   1.789
  129   HG12  ILE  21          2HG1      ILE  21 -11.111  -6.007   4.151
  130   HG13  ILE  21          1HG1      ILE  21  -9.640  -5.047   4.237
  131   HG21  ILE  21          1HG2      ILE  21  -9.808  -6.738   0.811
  132   HG22  ILE  21          2HG2      ILE  21 -10.393  -7.417   2.330
  133   HG23  ILE  21          3HG2      ILE  21  -8.798  -6.669   2.255
  134   HD11  ILE  21          3HD1      ILE  21 -10.932  -3.018   3.842
  135   HD12  ILE  21          1HD1      ILE  21 -11.520  -3.893   5.253
  136   HD13  ILE  21          2HD1      ILE  21 -12.409  -3.976   3.732
  137    H    GLY  22           H        GLY  22  -8.416  -1.891   2.042
  138    HA2  GLY  22           2HA      GLY  22  -6.688  -1.416   3.619
  139    HA3  GLY  22           1HA      GLY  22  -6.306  -3.129   3.634
  140    H    TYR  23           H        TYR  23  -4.238  -3.129   3.099
  141    HA   TYR  23           HA       TYR  23  -3.394  -2.750   0.430
  142    HB2  TYR  23           2HB      TYR  23  -1.694  -0.973   0.901
  143    HB3  TYR  23           1HB      TYR  23  -3.332  -0.359   1.096
  144    HD1  TYR  23           2HD      TYR  23  -4.244  -0.038   3.400
  145    HD2  TYR  23           1HD      TYR  23  -0.148  -0.973   2.756
  146    HE1  TYR  23           2HE      TYR  23  -3.728   0.698   5.670
  147    HE2  TYR  23           1HE      TYR  23   0.370  -0.241   5.053
  148    HH   TYR  23           HH       TYR  23  -2.058   0.258   7.340
  149    H    GLU  24           H        GLU  24  -0.818  -3.069   0.513
  150    HA   GLU  24           HA       GLU  24   0.182  -4.172   2.950
  151    HB2  GLU  24           2HB      GLU  24   0.700  -6.379   2.112
  152    HB3  GLU  24           1HB      GLU  24  -1.027  -6.123   1.937
  153    HG2  GLU  24           2HG      GLU  24  -0.732  -5.678  -0.434
  154    HG3  GLU  24           1HG      GLU  24   1.012  -5.876  -0.260
  155    H    CYS  25           H        CYS  25   2.469  -4.619   2.730
  156    HA   CYS  25           HA       CYS  25   3.694  -3.039   0.589
  157    HB2  CYS  25           2HB      CYS  25   4.824  -3.966   3.240
  158    HB3  CYS  25           1HB      CYS  25   5.646  -2.944   2.067
  159    H    LEU  26           H        LEU  26   5.105  -4.021  -0.798
  160    HA   LEU  26           HA       LEU  26   5.597  -6.883  -0.348
  161    HB2  LEU  26           2HB      LEU  26   5.158  -5.449  -2.966
  162    HB3  LEU  26           1HB      LEU  26   5.647  -7.123  -2.807
  163    HG   LEU  26           HG       LEU  26   3.027  -5.959  -1.891
  164   HD11  LEU  26          1HD1      LEU  26   2.081  -7.257  -3.728
  165   HD12  LEU  26          2HD1      LEU  26   3.698  -7.778  -4.201
  166   HD13  LEU  26          3HD1      LEU  26   3.248  -6.077  -4.323
  167   HD21  LEU  26          3HD2      LEU  26   4.020  -8.813  -1.917
  168   HD22  LEU  26          1HD2      LEU  26   2.393  -8.287  -1.476
  169   HD23  LEU  26          2HD2      LEU  26   3.769  -7.815  -0.484
  170    HN1  NH2  27           1H       LEU  26   6.917  -4.950  -2.927
  171    HN2  NH2  27           2H       LEU  26   8.553  -5.014  -2.374
  Start of MODEL    5
    1    H1   GLY   1           1HT      GLY   1 -10.839   1.588  -4.931
    2    H2   GLY   1           2HT      GLY   1 -12.045   2.754  -5.015
    3    H3   GLY   1           3HT      GLY   1 -12.453   1.120  -4.771
    4    HA2  GLY   1           1HA      GLY   1 -12.622   2.359  -2.727
    5    HA3  GLY   1           2HA      GLY   1 -11.354   1.132  -2.681
    6    H    THR   2           H        THR   2 -10.530   2.486  -0.938
    7    HA   THR   2           HA       THR   2  -9.243   4.929  -1.845
    8    HB   THR   2           HB       THR   2  -9.291   3.694   0.927
    9    HG1  THR   2           1HG      THR   2 -11.068   5.288  -0.517
   10   HG21  THR   2          3HG2      THR   2  -8.654   6.498  -0.030
   11   HG22  THR   2          1HG2      THR   2  -7.480   5.321   0.555
   12   HG23  THR   2          2HG2      THR   2  -8.697   5.974   1.653
   13    H    ASN   3           H        ASN   3  -7.227   4.868  -2.523
   14    HA   ASN   3           HA       ASN   3  -5.631   2.445  -2.173
   15    HB2  ASN   3           2HB      ASN   3  -5.981   3.403  -4.461
   16    HB3  ASN   3           1HB      ASN   3  -5.188   4.868  -3.933
   17   HD21  ASN   3          1HD2      ASN   3  -4.496   3.081  -6.099
   18   HD22  ASN   3          2HD2      ASN   3  -2.883   2.555  -5.802
   19    H    GLU   4           H        GLU   4  -4.765   2.616  -0.154
   20    HA   GLU   4           HA       GLU   4  -3.848   4.980   1.065
   21    HB2  GLU   4           2HB      GLU   4  -3.128   2.102   1.618
   22    HB3  GLU   4           1HB      GLU   4  -2.649   3.442   2.631
   23    HG2  GLU   4           2HG      GLU   4  -4.514   2.269   3.612
   24    HG3  GLU   4           1HG      GLU   4  -5.008   3.885   3.146
   25    H    CYS   5           H        CYS   5  -2.384   2.818  -1.154
   26    HA   CYS   5           HA       CYS   5   0.335   3.360  -0.548
   27    HB2  CYS   5           2HB      CYS   5  -0.978   2.208  -2.975
   28    HB3  CYS   5           1HB      CYS   5   0.752   2.281  -2.700
   29    H    LEU   6           H        LEU   6  -2.012   4.946  -2.331
   30    HA   LEU   6           HA       LEU   6  -0.437   6.431  -4.143
   31    HB2  LEU   6           2HB      LEU   6  -3.073   7.054  -2.889
   32    HB3  LEU   6           1HB      LEU   6  -2.295   8.178  -3.990
   33    HG   LEU   6           HG       LEU   6  -3.246   5.384  -4.588
   34   HD11  LEU   6          1HD1      LEU   6  -5.027   7.030  -4.325
   35   HD12  LEU   6          2HD1      LEU   6  -4.868   6.514  -6.003
   36   HD13  LEU   6          3HD1      LEU   6  -4.232   8.080  -5.498
   37   HD21  LEU   6          3HD2      LEU   6  -1.929   7.416  -6.396
   38   HD22  LEU   6          1HD2      LEU   6  -2.685   5.913  -6.922
   39   HD23  LEU   6          2HD2      LEU   6  -1.258   5.857  -5.902
   40    H    ASP   7           H        ASP   7  -1.135   7.053  -0.763
   41    HA   ASP   7           HA       ASP   7   0.576   9.421  -1.024
   42    HB2  ASP   7           2HB      ASP   7  -1.573  10.023  -0.072
   43    HB3  ASP   7           1HB      ASP   7  -1.408   8.777   1.161
   44    H    ASN   8           H        ASN   8   2.529   9.232  -0.492
   45    HA   ASN   8           HA       ASN   8   4.451   8.774   0.571
   46    HB2  ASN   8           2HB      ASN   8   3.034   9.390   2.544
   47    HB3  ASN   8           1HB      ASN   8   2.818   7.679   2.853
   48   HD21  ASN   8          1HD2      ASN   8   5.802   9.177   1.696
   49   HD22  ASN   8          2HD2      ASN   8   6.725   8.821   3.103
   50    H    ASN   9           H        ASN   9   2.861   6.841  -0.872
   51    HA   ASN   9           HA       ASN   9   2.896   4.674  -1.663
   52    HB2  ASN   9           2HB      ASN   9   5.345   5.317  -1.926
   53    HB3  ASN   9           1HB      ASN   9   5.651   4.523  -0.388
   54   HD21  ASN   9          1HD2      ASN   9   6.912   2.946  -1.103
   55   HD22  ASN   9          2HD2      ASN   9   6.432   1.666  -2.150
   56    H    GLY  10           H        GLY  10   1.653   5.132   0.818
   57    HA2  GLY  10           2HA      GLY  10   0.571   3.845   2.385
   58    HA3  GLY  10           1HA      GLY  10   1.473   2.449   1.813
   59    H    GLY  11           H        GLY  11   3.701   4.750   2.403
   60    HA2  GLY  11           2HA      GLY  11   4.944   5.360   4.285
   61    HA3  GLY  11           1HA      GLY  11   4.012   4.215   5.249
   62    H    CYS  12           H        CYS  12   4.936   2.885   2.305
   63    HA   CYS  12           HA       CYS  12   7.006   1.345   3.671
   64    HB2  CYS  12           2HB      CYS  12   5.187   0.684   1.359
   65    HB3  CYS  12           1HB      CYS  12   6.426  -0.395   1.987
   66    H    SER  13           H        SER  13   8.931   0.933   2.671
   67    HA   SER  13           HA       SER  13   9.745   2.873   0.701
   68    HB2  SER  13           2HB      SER  13  11.154   2.403   2.718
   69    HB3  SER  13           1HB      SER  13  11.360   0.750   2.151
   70    HG   SER  13           HG       SER  13  12.105   3.005   0.616
   71    H    HIS  14           H        HIS  14   8.822  -0.439   0.877
   72    HA   HIS  14           HA       HIS  14  10.020  -1.033  -1.721
   73    HB2  HIS  14           2HB      HIS  14   8.531  -2.825   0.211
   74    HB3  HIS  14           1HB      HIS  14   9.096  -3.353  -1.358
   75    HD1  HIS  14           1HD      HIS  14  11.694  -3.574  -1.656
   76    HD2  HIS  14           2HD      HIS  14  10.433  -2.781   2.210
   77    HE1  HIS  14           1HE      HIS  14  13.671  -4.058  -0.184
   78    HE2  HIS  14           2HE      HIS  14  12.933  -3.375   2.118
   79    H    VAL  15           H        VAL  15   8.229  -2.721  -2.878
   80    HA   VAL  15           HA       VAL  15   6.422  -0.966  -4.120
   81    HB   VAL  15           HB       VAL  15   6.413  -4.003  -4.074
   82   HG11  VAL  15          1HG1      VAL  15   4.260  -3.135  -4.829
   83   HG12  VAL  15          2HG1      VAL  15   5.146  -3.871  -6.167
   84   HG13  VAL  15          3HG1      VAL  15   5.083  -2.115  -6.010
   85   HG21  VAL  15          3HG2      VAL  15   7.577  -3.835  -6.215
   86   HG22  VAL  15          1HG2      VAL  15   8.505  -3.096  -4.910
   87   HG23  VAL  15          2HG2      VAL  15   7.620  -2.081  -6.049
   88    H    CYS  16           H        CYS  16   4.374  -0.379  -3.623
   89    HA   CYS  16           HA       CYS  16   3.043  -1.829  -1.441
   90    HB2  CYS  16           2HB      CYS  16   3.676   0.624  -1.041
   91    HB3  CYS  16           1HB      CYS  16   2.537   1.019  -2.317
   92    H    ASN  17           H        ASN  17   1.014  -2.521  -1.832
   93    HA   ASN  17           HA       ASN  17  -0.178  -1.864  -4.414
   94    HB2  ASN  17           2HB      ASN  17   0.784  -4.062  -4.781
   95    HB3  ASN  17           1HB      ASN  17   0.068  -4.670  -3.293
   96   HD21  ASN  17          1HD2      ASN  17  -1.984  -5.497  -3.364
   97   HD22  ASN  17          2HD2      ASN  17  -2.980  -5.450  -4.769
   98    H    ASP  18           H        ASP  18  -2.160  -1.296  -4.321
   99    HA   ASP  18           HA       ASP  18  -3.439  -1.061  -1.796
  100    HB2  ASP  18           2HB      ASP  18  -3.749   0.742  -3.282
  101    HB3  ASP  18           1HB      ASP  18  -4.266  -0.325  -4.584
  102    H    LEU  19           H        LEU  19  -4.895  -2.271  -0.915
  103    HA   LEU  19           HA       LEU  19  -6.159  -4.355  -2.520
  104    HB2  LEU  19           2HB      LEU  19  -5.795  -4.235   0.467
  105    HB3  LEU  19           1HB      LEU  19  -6.565  -5.521  -0.407
  106    HG   LEU  19           HG       LEU  19  -3.639  -4.816  -0.605
  107   HD11  LEU  19          1HD1      LEU  19  -3.294  -6.972   0.493
  108   HD12  LEU  19          2HD1      LEU  19  -5.038  -7.162   0.660
  109   HD13  LEU  19          3HD1      LEU  19  -4.207  -5.860   1.512
  110   HD21  LEU  19          3HD2      LEU  19  -4.472  -5.653  -2.720
  111   HD22  LEU  19          1HD2      LEU  19  -5.239  -7.018  -1.905
  112   HD23  LEU  19          2HD2      LEU  19  -3.482  -6.875  -1.930
  113    H    LYS  20           H        LYS  20  -8.393  -4.816  -1.715
  114    HA   LYS  20           HA       LYS  20  -9.822  -2.364  -1.817
  115    HB2  LYS  20           2HB      LYS  20 -10.709  -5.234  -1.600
  116    HB3  LYS  20           1HB      LYS  20 -11.875  -3.940  -1.382
  117    HG2  LYS  20           2HG      LYS  20 -11.875  -4.808  -3.692
  118    HG3  LYS  20           1HG      LYS  20 -11.438  -3.105  -3.626
  119    HD2  LYS  20           2HD      LYS  20  -9.031  -3.805  -3.772
  120    HD3  LYS  20           1HD      LYS  20  -9.584  -5.460  -4.014
  121    HE2  LYS  20           2HE      LYS  20 -10.717  -4.823  -6.055
  122    HE3  LYS  20           1HE      LYS  20 -10.327  -3.128  -5.773
  123    HZ1  LYS  20           3HZ      LYS  20  -8.359  -5.291  -6.332
  124    HZ2  LYS  20           1HZ      LYS  20  -7.977  -3.693  -5.971
  125    HZ3  LYS  20           2HZ      LYS  20  -8.819  -4.041  -7.369
  126    H    ILE  21           H        ILE  21  -9.096  -4.608   0.717
  127    HA   ILE  21           HA       ILE  21  -9.892  -2.516   2.598
  128    HB   ILE  21           HB       ILE  21  -9.591  -5.496   3.083
  129   HG12  ILE  21          2HG1      ILE  21 -11.676  -5.014   1.926
  130   HG13  ILE  21          1HG1      ILE  21 -11.994  -5.464   3.599
  131   HG21  ILE  21          1HG2      ILE  21 -10.375  -5.050   5.357
  132   HG22  ILE  21          2HG2      ILE  21 -10.345  -3.317   5.017
  133   HG23  ILE  21          3HG2      ILE  21  -8.843  -4.244   5.010
  134   HD11  ILE  21          3HD1      ILE  21 -12.044  -2.675   2.456
  135   HD12  ILE  21          1HD1      ILE  21 -12.299  -3.093   4.152
  136   HD13  ILE  21          2HD1      ILE  21 -13.436  -3.651   2.927
  137    H    GLY  22           H        GLY  22  -8.198  -1.456   3.300
  138    HA2  GLY  22           2HA      GLY  22  -6.087  -1.001   4.033
  139    HA3  GLY  22           1HA      GLY  22  -5.812  -2.736   4.119
  140    H    TYR  23           H        TYR  23  -3.817  -2.681   3.281
  141    HA   TYR  23           HA       TYR  23  -3.563  -2.682   0.444
  142    HB2  TYR  23           2HB      TYR  23  -1.812  -0.953   0.326
  143    HB3  TYR  23           1HB      TYR  23  -3.308  -0.247   0.915
  144    HD1  TYR  23           2HD      TYR  23  -3.511   0.201   3.431
  145    HD2  TYR  23           1HD      TYR  23   0.177  -0.792   1.572
  146    HE1  TYR  23           2HE      TYR  23  -2.295   1.128   5.357
  147    HE2  TYR  23           1HE      TYR  23   1.397   0.125   3.488
  148    HH   TYR  23           HH       TYR  23   1.067   1.696   5.252
  149    H    GLU  24           H        GLU  24  -1.119  -3.230  -0.004
  150    HA   GLU  24           HA       GLU  24   0.006  -4.647   2.294
  151    HB2  GLU  24           2HB      GLU  24   0.475  -6.599   0.939
  152    HB3  GLU  24           1HB      GLU  24  -1.246  -6.263   0.882
  153    HG2  GLU  24           2HG      GLU  24  -0.910  -5.180  -1.332
  154    HG3  GLU  24           1HG      GLU  24   0.783  -5.641  -1.250
  155    H    CYS  25           H        CYS  25   2.261  -4.785   2.262
  156    HA   CYS  25           HA       CYS  25   3.551  -3.253   0.139
  157    HB2  CYS  25           2HB      CYS  25   4.350  -3.496   3.039
  158    HB3  CYS  25           1HB      CYS  25   5.261  -2.627   1.809
  159    H    LEU  26           H        LEU  26   4.888  -4.311  -1.025
  160    HA   LEU  26           HA       LEU  26   5.494  -7.086  -0.372
  161    HB2  LEU  26           2HB      LEU  26   5.814  -5.550  -2.945
  162    HB3  LEU  26           1HB      LEU  26   5.982  -7.281  -2.747
  163    HG   LEU  26           HG       LEU  26   3.404  -5.742  -2.365
  164   HD11  LEU  26          1HD1      LEU  26   2.697  -6.805  -4.438
  165   HD12  LEU  26          2HD1      LEU  26   4.303  -7.509  -4.628
  166   HD13  LEU  26          3HD1      LEU  26   4.095  -5.760  -4.691
  167   HD21  LEU  26          3HD2      LEU  26   3.973  -8.702  -2.398
  168   HD22  LEU  26          1HD2      LEU  26   2.379  -7.951  -2.288
  169   HD23  LEU  26          2HD2      LEU  26   3.546  -7.739  -0.983
  170    HN1  NH2  27           1H       LEU  26   7.218  -6.876   0.989
  171    HN2  NH2  27           2H       LEU  26   8.747  -6.205   0.537
  Start of MODEL    6
    1    H1   GLY   1           1HT      GLY   1 -10.437   5.773  -4.909
    2    H2   GLY   1           2HT      GLY   1 -11.528   6.684  -4.020
    3    H3   GLY   1           3HT      GLY   1 -12.081   5.753  -5.330
    4    HA2  GLY   1           1HA      GLY   1 -12.593   4.738  -3.202
    5    HA3  GLY   1           2HA      GLY   1 -11.470   3.752  -4.126
    6    H    THR   2           H        THR   2 -11.064   2.987  -1.835
    7    HA   THR   2           HA       THR   2  -9.536   4.804  -0.163
    8    HB   THR   2           HB       THR   2 -10.186   1.878   0.260
    9    HG1  THR   2           1HG      THR   2 -11.671   4.233   0.802
   10   HG21  THR   2          3HG2      THR   2  -9.947   2.459   2.649
   11   HG22  THR   2          1HG2      THR   2  -9.541   4.114   2.197
   12   HG23  THR   2          2HG2      THR   2  -8.463   2.791   1.757
   13    H    ASN   3           H        ASN   3  -7.683   5.010  -1.636
   14    HA   ASN   3           HA       ASN   3  -6.119   2.530  -1.872
   15    HB2  ASN   3           2HB      ASN   3  -6.719   3.607  -4.050
   16    HB3  ASN   3           1HB      ASN   3  -5.823   5.035  -3.555
   17   HD21  ASN   3          1HD2      ASN   3  -5.434   3.227  -5.839
   18   HD22  ASN   3          2HD2      ASN   3  -3.809   2.664  -5.707
   19    H    GLU   4           H        GLU   4  -5.119   2.515   0.007
   20    HA   GLU   4           HA       GLU   4  -3.984   4.713   1.294
   21    HB2  GLU   4           2HB      GLU   4  -3.377   1.768   1.665
   22    HB3  GLU   4           1HB      GLU   4  -2.975   3.048   2.790
   23    HG2  GLU   4           2HG      GLU   4  -4.852   2.109   3.769
   24    HG3  GLU   4           1HG      GLU   4  -5.546   3.452   2.878
   25    H    CYS   5           H        CYS   5  -2.765   2.536  -1.149
   26    HA   CYS   5           HA       CYS   5  -0.007   2.985  -0.616
   27    HB2  CYS   5           2HB      CYS   5  -1.400   1.873  -3.021
   28    HB3  CYS   5           1HB      CYS   5   0.342   2.031  -2.898
   29    H    LEU   6           H        LEU   6  -2.329   4.682  -2.452
   30    HA   LEU   6           HA       LEU   6  -0.461   6.182  -3.986
   31    HB2  LEU   6           2HB      LEU   6  -3.281   6.724  -3.206
   32    HB3  LEU   6           1HB      LEU   6  -2.347   7.859  -4.157
   33    HG   LEU   6           HG       LEU   6  -3.173   5.045  -4.903
   34   HD11  LEU   6          1HD1      LEU   6  -4.451   6.137  -6.670
   35   HD12  LEU   6          2HD1      LEU   6  -3.957   7.712  -6.048
   36   HD13  LEU   6          3HD1      LEU   6  -4.966   6.653  -5.064
   37   HD21  LEU   6          3HD2      LEU   6  -0.963   5.437  -5.819
   38   HD22  LEU   6          1HD2      LEU   6  -1.478   6.999  -6.462
   39   HD23  LEU   6          2HD2      LEU   6  -2.161   5.507  -7.104
   40    H    ASP   7           H        ASP   7  -1.628   6.492  -0.827
   41    HA   ASP   7           HA       ASP   7  -0.447   9.137  -0.462
   42    HB2  ASP   7           2HB      ASP   7  -2.573   8.720   0.682
   43    HB3  ASP   7           1HB      ASP   7  -1.862   7.353   1.533
   44    H    ASN   8           H        ASN   8   1.645   9.163  -0.303
   45    HA   ASN   8           HA       ASN   8   3.789   8.791   0.354
   46    HB2  ASN   8           2HB      ASN   8   2.382   7.722   2.786
   47    HB3  ASN   8           1HB      ASN   8   4.133   7.835   2.630
   48   HD21  ASN   8          1HD2      ASN   8   1.140   9.627   3.008
   49   HD22  ASN   8          2HD2      ASN   8   1.903  11.135   3.358
   50    H    ASN   9           H        ASN   9   2.421   6.732  -1.109
   51    HA   ASN   9           HA       ASN   9   2.741   4.638  -1.989
   52    HB2  ASN   9           2HB      ASN   9   5.151   5.437  -2.111
   53    HB3  ASN   9           1HB      ASN   9   5.429   4.663  -0.556
   54   HD21  ASN   9          1HD2      ASN   9   6.806   3.146  -1.155
   55   HD22  ASN   9          2HD2      ASN   9   6.499   1.842  -2.232
   56    H    GLY  10           H        GLY  10   1.361   4.934   0.442
   57    HA2  GLY  10           2HA      GLY  10   0.275   3.500   1.885
   58    HA3  GLY  10           1HA      GLY  10   1.316   2.200   1.322
   59    H    GLY  11           H        GLY  11   3.148   4.834   2.159
   60    HA2  GLY  11           2HA      GLY  11   4.325   5.423   4.062
   61    HA3  GLY  11           1HA      GLY  11   3.449   4.186   4.968
   62    H    CYS  12           H        CYS  12   4.389   2.773   2.195
   63    HA   CYS  12           HA       CYS  12   6.523   1.393   3.560
   64    HB2  CYS  12           2HB      CYS  12   4.907   0.780   1.095
   65    HB3  CYS  12           1HB      CYS  12   6.159  -0.275   1.729
   66    H    SER  13           H        SER  13   8.566   1.187   2.703
   67    HA   SER  13           HA       SER  13   9.312   3.186   0.781
   68    HB2  SER  13           2HB      SER  13  11.608   2.337   1.439
   69    HB3  SER  13           1HB      SER  13  10.651   3.048   2.744
   70    HG   SER  13           HG       SER  13  11.625   1.061   3.317
   71    H    HIS  14           H        HIS  14   8.430  -0.066   0.858
   72    HA   HIS  14           HA       HIS  14   9.861  -0.640  -1.620
   73    HB2  HIS  14           2HB      HIS  14   8.600  -2.545   0.362
   74    HB3  HIS  14           1HB      HIS  14   9.255  -3.043  -1.182
   75    HD1  HIS  14           1HD      HIS  14  11.794  -3.285  -1.379
   76    HD2  HIS  14           2HD      HIS  14  10.554  -1.750   2.283
   77    HE1  HIS  14           1HE      HIS  14  13.796  -3.370   0.102
   78    HE2  HIS  14           2HE      HIS  14  13.043  -2.399   2.298
   79    H    VAL  15           H        VAL  15   8.263  -2.642  -2.658
   80    HA   VAL  15           HA       VAL  15   6.360  -1.190  -4.099
   81    HB   VAL  15           HB       VAL  15   6.449  -4.189  -3.692
   82   HG11  VAL  15          1HG1      VAL  15   4.339  -3.475  -4.662
   83   HG12  VAL  15          2HG1      VAL  15   5.309  -4.322  -5.867
   84   HG13  VAL  15          3HG1      VAL  15   5.196  -2.562  -5.904
   85   HG21  VAL  15          3HG2      VAL  15   7.774  -2.489  -5.797
   86   HG22  VAL  15          1HG2      VAL  15   7.750  -4.250  -5.771
   87   HG23  VAL  15          2HG2      VAL  15   8.583  -3.363  -4.497
   88    H    CYS  16           H        CYS  16   4.453  -0.439  -3.426
   89    HA   CYS  16           HA       CYS  16   3.068  -1.835  -1.268
   90    HB2  CYS  16           2HB      CYS  16   3.462   0.735  -1.198
   91    HB3  CYS  16           1HB      CYS  16   2.278   0.766  -2.507
   92    H    ASN  17           H        ASN  17   1.517  -3.010  -1.751
   93    HA   ASN  17           HA       ASN  17   0.286  -2.959  -4.418
   94    HB2  ASN  17           2HB      ASN  17   1.489  -5.031  -4.022
   95    HB3  ASN  17           1HB      ASN  17   0.688  -5.256  -2.479
   96   HD21  ASN  17          1HD2      ASN  17  -0.115  -7.251  -3.064
   97   HD22  ASN  17          2HD2      ASN  17  -1.360  -7.459  -4.234
   98    H    ASP  18           H        ASP  18  -1.419  -1.821  -4.181
   99    HA   ASP  18           HA       ASP  18  -2.848  -1.541  -1.764
  100    HB2  ASP  18           2HB      ASP  18  -2.848   0.361  -3.085
  101    HB3  ASP  18           1HB      ASP  18  -3.276  -0.526  -4.539
  102    H    LEU  19           H        LEU  19  -4.027  -2.976  -0.941
  103    HA   LEU  19           HA       LEU  19  -5.673  -4.849  -2.461
  104    HB2  LEU  19           2HB      LEU  19  -5.683  -4.330   0.514
  105    HB3  LEU  19           1HB      LEU  19  -6.191  -5.753  -0.314
  106    HG   LEU  19           HG       LEU  19  -3.303  -4.911  -0.130
  107   HD11  LEU  19          1HD1      LEU  19  -3.063  -6.776   1.403
  108   HD12  LEU  19          2HD1      LEU  19  -4.797  -7.073   1.317
  109   HD13  LEU  19          3HD1      LEU  19  -4.194  -5.575   2.029
  110   HD21  LEU  19          3HD2      LEU  19  -3.786  -6.191  -2.144
  111   HD22  LEU  19          1HD2      LEU  19  -4.577  -7.437  -1.177
  112   HD23  LEU  19          2HD2      LEU  19  -2.846  -7.150  -1.001
  113    H    LYS  20           H        LYS  20  -8.155  -4.778  -1.774
  114    HA   LYS  20           HA       LYS  20  -9.075  -2.160  -2.276
  115    HB2  LYS  20           2HB      LYS  20 -10.494  -4.216  -2.662
  116    HB3  LYS  20           1HB      LYS  20 -10.701  -4.333  -0.919
  117    HG2  LYS  20           2HG      LYS  20 -11.765  -2.117  -0.896
  118    HG3  LYS  20           1HG      LYS  20 -11.586  -2.023  -2.643
  119    HD2  LYS  20           2HD      LYS  20 -13.849  -2.666  -2.114
  120    HD3  LYS  20           1HD      LYS  20 -13.023  -4.041  -2.847
  121    HE2  LYS  20           2HE      LYS  20 -12.705  -5.053  -0.675
  122    HE3  LYS  20           1HE      LYS  20 -13.375  -3.632   0.119
  123    HZ1  LYS  20           3HZ      LYS  20 -14.960  -5.438  -0.025
  124    HZ2  LYS  20           1HZ      LYS  20 -14.890  -5.446  -1.701
  125    HZ3  LYS  20           2HZ      LYS  20 -15.516  -4.113  -0.873
  126    H    ILE  21           H        ILE  21  -9.060  -4.013   0.689
  127    HA   ILE  21           HA       ILE  21  -9.214  -1.485   2.138
  128    HB   ILE  21           HB       ILE  21 -11.182  -2.806   2.659
  129   HG12  ILE  21          2HG1      ILE  21 -10.942  -3.125   5.130
  130   HG13  ILE  21          1HG1      ILE  21  -9.209  -2.887   4.945
  131   HG21  ILE  21          1HG2      ILE  21 -11.111  -5.031   3.681
  132   HG22  ILE  21          2HG2      ILE  21  -9.371  -5.083   3.401
  133   HG23  ILE  21          3HG2      ILE  21 -10.482  -5.007   2.033
  134   HD11  ILE  21          3HD1      ILE  21  -9.604  -0.625   4.118
  135   HD12  ILE  21          1HD1      ILE  21 -10.312  -0.864   5.713
  136   HD13  ILE  21          2HD1      ILE  21 -11.343  -0.867   4.283
  137    H    GLY  22           H        GLY  22  -7.359  -0.908   3.066
  138    HA2  GLY  22           2HA      GLY  22  -5.403  -1.219   4.210
  139    HA3  GLY  22           1HA      GLY  22  -5.621  -2.968   4.082
  140    H    TYR  23           H        TYR  23  -3.371  -3.033   3.437
  141    HA   TYR  23           HA       TYR  23  -3.093  -2.939   0.627
  142    HB2  TYR  23           2HB      TYR  23  -1.148  -1.360   0.648
  143    HB3  TYR  23           1HB      TYR  23  -2.660  -0.579   1.087
  144    HD1  TYR  23           1HD      TYR  23  -3.082   0.004   3.515
  145    HD2  TYR  23           2HD      TYR  23   0.687  -1.414   2.159
  146    HE1  TYR  23           1HE      TYR  23  -2.035   0.825   5.585
  147    HE2  TYR  23           2HE      TYR  23   1.736  -0.600   4.212
  148    HH   TYR  23           HH       TYR  23   0.014   0.216   6.921
  149    H    GLU  24           H        GLU  24  -0.898  -3.728   0.039
  150    HA   GLU  24           HA       GLU  24   0.287  -5.475   2.080
  151    HB2  GLU  24           2HB      GLU  24  -0.967  -6.764   0.450
  152    HB3  GLU  24           1HB      GLU  24  -0.234  -5.896  -0.882
  153    HG2  GLU  24           2HG      GLU  24   0.822  -8.041  -0.769
  154    HG3  GLU  24           1HG      GLU  24   1.949  -6.846  -0.170
  155    H    CYS  25           H        CYS  25   2.597  -5.472   2.013
  156    HA   CYS  25           HA       CYS  25   3.777  -3.755  -0.014
  157    HB2  CYS  25           2HB      CYS  25   4.361  -3.545   2.941
  158    HB3  CYS  25           1HB      CYS  25   5.338  -2.785   1.685
  159    H    LEU  26           H        LEU  26   5.343  -4.537  -0.998
  160    HA   LEU  26           HA       LEU  26   6.584  -6.973   0.052
  161    HB2  LEU  26           2HB      LEU  26   6.156  -6.243  -2.861
  162    HB3  LEU  26           1HB      LEU  26   6.866  -7.718  -2.256
  163    HG   LEU  26           HG       LEU  26   4.736  -8.331  -2.962
  164   HD11  LEU  26          1HD1      LEU  26   4.514  -7.957  -0.018
  165   HD12  LEU  26          2HD1      LEU  26   5.248  -9.312  -0.875
  166   HD13  LEU  26          3HD1      LEU  26   3.513  -9.018  -1.012
  167   HD21  LEU  26          3HD2      LEU  26   3.755  -6.132  -3.267
  168   HD22  LEU  26          1HD2      LEU  26   3.584  -5.949  -1.522
  169   HD23  LEU  26          2HD2      LEU  26   2.654  -7.183  -2.377
  170    HN1  NH2  27           1H       LEU  26   8.395  -6.157   0.889
  171    HN2  NH2  27           2H       LEU  26   9.567  -5.219   0.035
  Start of MODEL    7
    1    H1   GLY   1           1HT      GLY   1 -11.766   4.806  -4.697
    2    H2   GLY   1           2HT      GLY   1 -12.859   3.559  -4.924
    3    H3   GLY   1           3HT      GLY   1 -11.216   3.220  -4.669
    4    HA2  GLY   1           1HA      GLY   1 -13.045   4.438  -2.695
    5    HA3  GLY   1           2HA      GLY   1 -12.425   2.789  -2.665
    6    H    THR   2           H        THR   2 -11.149   2.842  -0.872
    7    HA   THR   2           HA       THR   2  -9.341   5.059  -0.529
    8    HB   THR   2           HB       THR   2 -10.455   4.362   1.487
    9    HG1  THR   2           1HG      THR   2  -7.954   3.219   2.008
   10   HG21  THR   2          3HG2      THR   2 -10.149   2.113   2.493
   11   HG22  THR   2          1HG2      THR   2  -9.301   1.602   1.036
   12   HG23  THR   2          2HG2      THR   2 -11.009   2.043   0.958
   13    H    ASN   3           H        ASN   3  -7.577   5.037  -1.721
   14    HA   ASN   3           HA       ASN   3  -6.063   2.539  -1.991
   15    HB2  ASN   3           2HB      ASN   3  -6.698   3.657  -4.133
   16    HB3  ASN   3           1HB      ASN   3  -5.844   5.098  -3.609
   17   HD21  ASN   3          1HD2      ASN   3  -5.418   3.464  -5.971
   18   HD22  ASN   3          2HD2      ASN   3  -3.779   2.914  -5.873
   19    H    GLU   4           H        GLU   4  -4.817   2.442  -0.323
   20    HA   GLU   4           HA       GLU   4  -3.853   4.631   1.154
   21    HB2  GLU   4           2HB      GLU   4  -3.095   1.715   1.169
   22    HB3  GLU   4           1HB      GLU   4  -2.558   2.879   2.358
   23    HG2  GLU   4           2HG      GLU   4  -4.352   1.587   3.294
   24    HG3  GLU   4           1HG      GLU   4  -4.918   3.224   3.030
   25    H    CYS   5           H        CYS   5  -2.554   2.674  -1.409
   26    HA   CYS   5           HA       CYS   5   0.184   3.274  -1.032
   27    HB2  CYS   5           2HB      CYS   5  -1.318   2.319  -3.437
   28    HB3  CYS   5           1HB      CYS   5   0.432   2.418  -3.327
   29    H    LEU   6           H        LEU   6  -2.368   4.886  -2.560
   30    HA   LEU   6           HA       LEU   6  -1.002   6.690  -4.233
   31    HB2  LEU   6           2HB      LEU   6  -3.541   6.967  -2.706
   32    HB3  LEU   6           1HB      LEU   6  -2.893   8.306  -3.619
   33    HG   LEU   6           HG       LEU   6  -3.798   5.631  -4.708
   34   HD11  LEU   6          1HD1      LEU   6  -4.959   8.402  -4.998
   35   HD12  LEU   6          2HD1      LEU   6  -5.606   7.131  -3.969
   36   HD13  LEU   6          3HD1      LEU   6  -5.591   6.923  -5.724
   37   HD21  LEU   6          3HD2      LEU   6  -3.453   6.661  -6.918
   38   HD22  LEU   6          1HD2      LEU   6  -1.941   6.502  -6.026
   39   HD23  LEU   6          2HD2      LEU   6  -2.736   8.068  -6.136
   40    H    ASP   7           H        ASP   7  -1.306   6.660  -0.790
   41    HA   ASP   7           HA       ASP   7  -0.042   9.310  -0.746
   42    HB2  ASP   7           2HB      ASP   7  -2.229   9.176   0.406
   43    HB3  ASP   7           1HB      ASP   7  -1.537   7.996   1.512
   44    H    ASN   8           H        ASN   8   2.028   9.232  -0.478
   45    HA   ASN   8           HA       ASN   8   4.105   8.798   0.306
   46    HB2  ASN   8           2HB      ASN   8   2.526   7.938   2.715
   47    HB3  ASN   8           1HB      ASN   8   4.282   7.818   2.632
   48   HD21  ASN   8          1HD2      ASN   8   1.541  10.018   2.753
   49   HD22  ASN   8          2HD2      ASN   8   2.473  11.407   3.130
   50    H    ASN   9           H        ASN   9   2.690   6.861  -1.187
   51    HA   ASN   9           HA       ASN   9   2.921   4.757  -2.084
   52    HB2  ASN   9           2HB      ASN   9   5.367   5.483  -2.061
   53    HB3  ASN   9           1HB      ASN   9   5.523   4.637  -0.530
   54   HD21  ASN   9          1HD2      ASN   9   7.045   3.266  -1.342
   55   HD22  ASN   9          2HD2      ASN   9   6.666   1.969  -2.418
   56    H    GLY  10           H        GLY  10   1.530   5.147   0.364
   57    HA2  GLY  10           2HA      GLY  10   0.304   3.806   1.758
   58    HA3  GLY  10           1HA      GLY  10   1.193   2.419   1.147
   59    H    GLY  11           H        GLY  11   3.448   4.632   2.084
   60    HA2  GLY  11           2HA      GLY  11   4.601   4.949   4.082
   61    HA3  GLY  11           1HA      GLY  11   3.506   3.815   4.874
   62    H    CYS  12           H        CYS  12   4.351   2.452   2.012
   63    HA   CYS  12           HA       CYS  12   6.171   0.608   3.303
   64    HB2  CYS  12           2HB      CYS  12   5.092   0.636   0.465
   65    HB3  CYS  12           1HB      CYS  12   5.910  -0.705   1.249
   66    H    SER  13           H        SER  13   8.353   0.659   2.967
   67    HA   SER  13           HA       SER  13   9.397   2.750   1.275
   68    HB2  SER  13           2HB      SER  13  10.852   0.693   2.942
   69    HB3  SER  13           1HB      SER  13  11.552   2.154   2.238
   70    HG   SER  13           HG       SER  13   9.884   1.844   4.442
   71    H    HIS  14           H        HIS  14   8.646  -0.525   1.134
   72    HA   HIS  14           HA       HIS  14  10.191  -0.945  -1.305
   73    HB2  HIS  14           2HB      HIS  14   8.525  -2.847   0.377
   74    HB3  HIS  14           1HB      HIS  14   9.184  -3.295  -1.181
   75    HD1  HIS  14           1HD      HIS  14   9.936  -3.562   2.320
   76    HD2  HIS  14           2HD      HIS  14  12.182  -3.025  -1.136
   77    HE1  HIS  14           1HE      HIS  14  12.248  -4.280   2.900
   78    HE2  HIS  14           2HE      HIS  14  13.619  -3.746   0.894
   79    H    VAL  15           H        VAL  15   8.330  -2.586  -2.700
   80    HA   VAL  15           HA       VAL  15   6.652  -0.601  -3.819
   81    HB   VAL  15           HB       VAL  15   6.637  -3.631  -4.169
   82   HG11  VAL  15          1HG1      VAL  15   4.440  -2.705  -4.788
   83   HG12  VAL  15          2HG1      VAL  15   5.320  -3.280  -6.203
   84   HG13  VAL  15          3HG1      VAL  15   5.233  -1.552  -5.863
   85   HG21  VAL  15          3HG2      VAL  15   7.743  -1.441  -5.917
   86   HG22  VAL  15          1HG2      VAL  15   7.777  -3.165  -6.277
   87   HG23  VAL  15          2HG2      VAL  15   8.688  -2.528  -4.904
   88    H    CYS  16           H        CYS  16   4.418  -0.319  -3.646
   89    HA   CYS  16           HA       CYS  16   3.207  -1.499  -1.249
   90    HB2  CYS  16           2HB      CYS  16   3.396   1.048  -1.432
   91    HB3  CYS  16           1HB      CYS  16   2.312   0.885  -2.819
   92    H    ASN  17           H        ASN  17   1.432  -2.682  -1.497
   93    HA   ASN  17           HA       ASN  17   0.301  -2.930  -4.199
   94    HB2  ASN  17           2HB      ASN  17   1.516  -4.973  -3.496
   95    HB3  ASN  17           1HB      ASN  17   0.483  -5.077  -2.075
   96   HD21  ASN  17          1HD2      ASN  17  -0.272  -7.109  -2.700
   97   HD22  ASN  17          2HD2      ASN  17  -1.380  -7.316  -4.000
   98    H    ASP  18           H        ASP  18  -1.538  -1.953  -4.225
   99    HA   ASP  18           HA       ASP  18  -2.998  -1.489  -1.805
  100    HB2  ASP  18           2HB      ASP  18  -2.876   0.409  -3.169
  101    HB3  ASP  18           1HB      ASP  18  -3.295  -0.482  -4.619
  102    H    LEU  19           H        LEU  19  -4.066  -3.090  -1.068
  103    HA   LEU  19           HA       LEU  19  -5.753  -4.821  -2.686
  104    HB2  LEU  19           2HB      LEU  19  -5.748  -4.489   0.326
  105    HB3  LEU  19           1HB      LEU  19  -6.321  -5.845  -0.591
  106    HG   LEU  19           HG       LEU  19  -3.408  -5.098  -0.349
  107   HD11  LEU  19          1HD1      LEU  19  -4.976  -7.324   0.929
  108   HD12  LEU  19          2HD1      LEU  19  -4.301  -5.913   1.748
  109   HD13  LEU  19          3HD1      LEU  19  -3.228  -7.108   1.019
  110   HD21  LEU  19          3HD2      LEU  19  -4.733  -7.505  -1.597
  111   HD22  LEU  19          1HD2      LEU  19  -2.997  -7.255  -1.418
  112   HD23  LEU  19          2HD2      LEU  19  -3.933  -6.198  -2.474
  113    H    LYS  20           H        LYS  20  -8.215  -4.838  -1.881
  114    HA   LYS  20           HA       LYS  20  -9.278  -2.284  -2.391
  115    HB2  LYS  20           2HB      LYS  20 -10.605  -4.319  -2.697
  116    HB3  LYS  20           1HB      LYS  20 -10.538  -4.625  -0.968
  117    HG2  LYS  20           2HG      LYS  20 -11.843  -2.557  -0.578
  118    HG3  LYS  20           1HG      LYS  20 -11.959  -2.328  -2.321
  119    HD2  LYS  20           2HD      LYS  20 -13.992  -3.360  -1.496
  120    HD3  LYS  20           1HD      LYS  20 -13.112  -4.507  -2.500
  121    HE2  LYS  20           2HE      LYS  20 -12.172  -5.527  -0.416
  122    HE3  LYS  20           1HE      LYS  20 -13.182  -4.431   0.521
  123    HZ1  LYS  20           3HZ      LYS  20 -14.130  -6.661   0.244
  124    HZ2  LYS  20           1HZ      LYS  20 -14.142  -6.451  -1.409
  125    HZ3  LYS  20           2HZ      LYS  20 -15.147  -5.510  -0.450
  126    H    ILE  21           H        ILE  21  -9.088  -4.047   0.641
  127    HA   ILE  21           HA       ILE  21  -9.223  -1.478   1.953
  128    HB   ILE  21           HB       ILE  21 -10.007  -2.732   4.044
  129   HG12  ILE  21          2HG1      ILE  21 -11.427  -4.805   3.526
  130   HG13  ILE  21          1HG1      ILE  21 -10.547  -4.920   2.014
  131   HG21  ILE  21          1HG2      ILE  21 -11.850  -2.554   1.689
  132   HG22  ILE  21          2HG2      ILE  21 -11.464  -1.279   2.845
  133   HG23  ILE  21          3HG2      ILE  21 -12.363  -2.704   3.368
  134   HD11  ILE  21          3HD1      ILE  21  -8.469  -5.205   3.280
  135   HD12  ILE  21          1HD1      ILE  21  -9.659  -6.445   3.674
  136   HD13  ILE  21          2HD1      ILE  21  -9.387  -5.096   4.779
  137    H    GLY  22           H        GLY  22  -7.703  -0.896   3.297
  138    HA2  GLY  22           2HA      GLY  22  -5.546  -0.824   3.996
  139    HA3  GLY  22           1HA      GLY  22  -5.645  -2.568   4.213
  140    H    TYR  23           H        TYR  23  -3.616  -3.003   3.391
  141    HA   TYR  23           HA       TYR  23  -3.224  -3.220   0.612
  142    HB2  TYR  23           2HB      TYR  23  -1.412  -1.552   0.367
  143    HB3  TYR  23           1HB      TYR  23  -2.905  -0.739   0.833
  144    HD1  TYR  23           1HD      TYR  23  -3.213  -0.179   3.315
  145    HD2  TYR  23           2HD      TYR  23   0.530  -1.275   1.654
  146    HE1  TYR  23           1HE      TYR  23  -2.089   0.773   5.262
  147    HE2  TYR  23           2HE      TYR  23   1.666  -0.330   3.586
  148    HH   TYR  23           HH       TYR  23  -0.043   0.570   6.429
  149    H    GLU  24           H        GLU  24  -0.727  -3.779   0.354
  150    HA   GLU  24           HA       GLU  24   0.445  -4.723   2.832
  151    HB2  GLU  24           2HB      GLU  24   1.017  -6.899   1.810
  152    HB3  GLU  24           1HB      GLU  24  -0.718  -6.683   1.936
  153    HG2  GLU  24           2HG      GLU  24  -0.764  -6.078  -0.467
  154    HG3  GLU  24           1HG      GLU  24   0.968  -6.397  -0.527
  155    H    CYS  25           H        CYS  25   2.740  -4.960   2.657
  156    HA   CYS  25           HA       CYS  25   3.790  -3.221   0.549
  157    HB2  CYS  25           2HB      CYS  25   5.100  -4.089   3.143
  158    HB3  CYS  25           1HB      CYS  25   5.753  -2.942   1.982
  159    H    LEU  26           H        LEU  26   5.111  -4.006  -0.965
  160    HA   LEU  26           HA       LEU  26   5.840  -6.839  -0.793
  161    HB2  LEU  26           2HB      LEU  26   5.459  -5.067  -3.205
  162    HB3  LEU  26           1HB      LEU  26   5.985  -6.734  -3.271
  163    HG   LEU  26           HG       LEU  26   3.279  -5.764  -2.338
  164   HD11  LEU  26          1HD1      LEU  26   4.137  -7.227  -4.829
  165   HD12  LEU  26          2HD1      LEU  26   3.599  -5.550  -4.738
  166   HD13  LEU  26          3HD1      LEU  26   2.474  -6.860  -4.373
  167   HD21  LEU  26          3HD2      LEU  26   4.360  -8.568  -2.662
  168   HD22  LEU  26          1HD2      LEU  26   2.686  -8.146  -2.300
  169   HD23  LEU  26          2HD2      LEU  26   3.954  -7.776  -1.137
  170    HN1  NH2  27           1H       LEU  26   7.792  -6.737   0.138
  171    HN2  NH2  27           2H       LEU  26   9.168  -5.918  -0.512
  Start of MODEL    8
    1    H1   GLY   1           1HT      GLY   1 -11.638   0.882  -5.242
    2    H2   GLY   1           2HT      GLY   1 -10.003   0.976  -4.834
    3    H3   GLY   1           3HT      GLY   1 -10.727   2.287  -5.562
    4    HA2  GLY   1           1HA      GLY   1 -12.114   2.577  -3.596
    5    HA3  GLY   1           2HA      GLY   1 -11.252   1.210  -2.880
    6    H    THR   2           H        THR   2 -10.887   3.123  -1.308
    7    HA   THR   2           HA       THR   2  -9.130   5.136  -2.030
    8    HB   THR   2           HB       THR   2 -10.525   5.241   0.011
    9    HG1  THR   2           1HG      THR   2  -9.170   6.638   0.653
   10   HG21  THR   2          3HG2      THR   2  -8.608   3.214   1.171
   11   HG22  THR   2          1HG2      THR   2 -10.313   2.940   0.811
   12   HG23  THR   2          2HG2      THR   2  -9.848   4.077   2.079
   13    H    ASN   3           H        ASN   3  -7.052   5.212  -2.379
   14    HA   ASN   3           HA       ASN   3  -5.600   2.657  -2.358
   15    HB2  ASN   3           2HB      ASN   3  -6.176   3.874  -4.502
   16    HB3  ASN   3           1HB      ASN   3  -5.060   5.127  -4.001
   17   HD21  ASN   3          1HD2      ASN   3  -2.823   4.720  -4.169
   18   HD22  ASN   3          2HD2      ASN   3  -2.256   3.329  -5.028
   19    H    GLU   4           H        GLU   4  -4.637   2.726  -0.360
   20    HA   GLU   4           HA       GLU   4  -3.534   4.865   1.019
   21    HB2  GLU   4           2HB      GLU   4  -2.770   1.955   1.055
   22    HB3  GLU   4           1HB      GLU   4  -2.120   3.128   2.178
   23    HG2  GLU   4           2HG      GLU   4  -3.907   1.829   3.188
   24    HG3  GLU   4           1HG      GLU   4  -4.339   3.526   3.076
   25    H    CYS   5           H        CYS   5  -2.171   2.937  -1.475
   26    HA   CYS   5           HA       CYS   5   0.542   3.486  -1.228
   27    HB2  CYS   5           2HB      CYS   5  -1.074   3.035  -3.693
   28    HB3  CYS   5           1HB      CYS   5   0.655   2.787  -3.519
   29    H    LEU   6           H        LEU   6  -2.028   5.349  -2.510
   30    HA   LEU   6           HA       LEU   6  -0.593   7.270  -4.063
   31    HB2  LEU   6           2HB      LEU   6  -3.246   7.340  -2.695
   32    HB3  LEU   6           1HB      LEU   6  -2.604   8.768  -3.473
   33    HG   LEU   6           HG       LEU   6  -3.259   6.131  -4.829
   34   HD11  LEU   6          1HD1      LEU   6  -4.683   8.774  -4.893
   35   HD12  LEU   6          2HD1      LEU   6  -5.229   7.330  -4.046
   36   HD13  LEU   6          3HD1      LEU   6  -5.110   7.327  -5.806
   37   HD21  LEU   6          3HD2      LEU   6  -2.424   8.785  -5.978
   38   HD22  LEU   6          1HD2      LEU   6  -2.916   7.366  -6.898
   39   HD23  LEU   6          2HD2      LEU   6  -1.435   7.326  -5.945
   40    H    ASP   7           H        ASP   7  -1.126   6.882  -0.727
   41    HA   ASP   7           HA       ASP   7  -0.066   9.547  -0.126
   42    HB2  ASP   7           2HB      ASP   7  -2.125   8.844   1.047
   43    HB3  ASP   7           1HB      ASP   7  -1.244   7.478   1.723
   44    H    ASN   8           H        ASN   8   2.064   9.278  -0.537
   45    HA   ASN   8           HA       ASN   8   4.255   8.885  -0.077
   46    HB2  ASN   8           2HB      ASN   8   3.350   9.691   2.045
   47    HB3  ASN   8           1HB      ASN   8   3.277   8.040   2.642
   48   HD21  ASN   8          1HD2      ASN   8   5.806   9.571   0.665
   49   HD22  ASN   8          2HD2      ASN   8   7.077   9.345   1.790
   50    H    ASN   9           H        ASN   9   2.852   6.890  -1.199
   51    HA   ASN   9           HA       ASN   9   3.085   4.711  -2.007
   52    HB2  ASN   9           2HB      ASN   9   5.525   5.374  -2.073
   53    HB3  ASN   9           1HB      ASN   9   5.703   4.717  -0.460
   54   HD21  ASN   9          1HD2      ASN   9   7.193   3.211  -1.031
   55   HD22  ASN   9          2HD2      ASN   9   6.829   1.808  -1.956
   56    H    GLY  10           H        GLY  10   1.781   5.272   0.582
   57    HA2  GLY  10           2HA      GLY  10   0.531   3.940   1.972
   58    HA3  GLY  10           1HA      GLY  10   1.359   2.537   1.325
   59    H    GLY  11           H        GLY  11   3.676   4.710   2.240
   60    HA2  GLY  11           2HA      GLY  11   5.074   4.829   4.062
   61    HA3  GLY  11           1HA      GLY  11   3.835   4.016   5.021
   62    H    CYS  12           H        CYS  12   4.817   2.659   2.031
   63    HA   CYS  12           HA       CYS  12   5.990   0.369   3.379
   64    HB2  CYS  12           2HB      CYS  12   5.244   0.851   0.486
   65    HB3  CYS  12           1HB      CYS  12   5.769  -0.684   1.165
   66    H    SER  13           H        SER  13   8.074  -0.283   2.990
   67    HA   SER  13           HA       SER  13   9.958   1.717   2.214
   68    HB2  SER  13           2HB      SER  13  10.316   0.099   4.105
   69    HB3  SER  13           1HB      SER  13  10.382  -1.207   2.929
   70    HG   SER  13           HG       SER  13  12.205   0.791   3.520
   71    H    HIS  14           H        HIS  14   8.402  -1.013   0.784
   72    HA   HIS  14           HA       HIS  14   9.882  -0.555  -1.681
   73    HB2  HIS  14           2HB      HIS  14   8.824  -3.166  -0.575
   74    HB3  HIS  14           1HB      HIS  14   9.219  -2.965  -2.265
   75    HD1  HIS  14           1HD      HIS  14  11.624  -3.267  -2.925
   76    HD2  HIS  14           2HD      HIS  14  11.109  -2.905   1.173
   77    HE1  HIS  14           1HE      HIS  14  13.850  -3.765  -1.936
   78    HE2  HIS  14           2HE      HIS  14  13.583  -3.136   0.465
   79    H    VAL  15           H        VAL  15   8.145  -2.037  -3.377
   80    HA   VAL  15           HA       VAL  15   6.255  -0.082  -3.992
   81    HB   VAL  15           HB       VAL  15   6.275  -3.003  -4.846
   82   HG11  VAL  15          1HG1      VAL  15   4.885  -2.302  -6.740
   83   HG12  VAL  15          2HG1      VAL  15   4.792  -0.674  -6.071
   84   HG13  VAL  15          3HG1      VAL  15   4.062  -2.025  -5.204
   85   HG21  VAL  15          3HG2      VAL  15   8.292  -1.803  -5.490
   86   HG22  VAL  15          1HG2      VAL  15   7.317  -0.533  -6.225
   87   HG23  VAL  15          2HG2      VAL  15   7.303  -2.161  -6.903
   88    H    CYS  16           H        CYS  16   4.257   0.336  -3.376
   89    HA   CYS  16           HA       CYS  16   2.987  -1.299  -1.355
   90    HB2  CYS  16           2HB      CYS  16   3.009   1.145  -1.080
   91    HB3  CYS  16           1HB      CYS  16   2.225   1.310  -2.644
   92    H    ASN  17           H        ASN  17   1.035  -2.253  -1.636
   93    HA   ASN  17           HA       ASN  17  -0.063  -2.473  -4.357
   94    HB2  ASN  17           2HB      ASN  17   1.164  -4.537  -3.801
   95    HB3  ASN  17           1HB      ASN  17   0.279  -4.693  -2.297
   96   HD21  ASN  17          1HD2      ASN  17  -0.531  -6.733  -2.859
   97   HD22  ASN  17          2HD2      ASN  17  -1.730  -6.945  -4.072
   98    H    ASP  18           H        ASP  18  -2.161  -1.884  -4.375
   99    HA   ASP  18           HA       ASP  18  -3.397  -1.231  -1.859
  100    HB2  ASP  18           2HB      ASP  18  -3.737   0.416  -3.503
  101    HB3  ASP  18           1HB      ASP  18  -4.246  -0.757  -4.706
  102    H    LEU  19           H        LEU  19  -4.801  -2.319  -0.806
  103    HA   LEU  19           HA       LEU  19  -6.157  -4.588  -2.102
  104    HB2  LEU  19           2HB      LEU  19  -5.782  -4.083   0.847
  105    HB3  LEU  19           1HB      LEU  19  -6.417  -5.519   0.115
  106    HG   LEU  19           HG       LEU  19  -3.537  -4.622   0.002
  107   HD11  LEU  19          1HD1      LEU  19  -3.137  -6.636   1.329
  108   HD12  LEU  19          2HD1      LEU  19  -4.876  -6.921   1.402
  109   HD13  LEU  19          3HD1      LEU  19  -4.186  -5.486   2.157
  110   HD21  LEU  19          3HD2      LEU  19  -3.101  -6.756  -1.111
  111   HD22  LEU  19          1HD2      LEU  19  -4.175  -5.744  -2.077
  112   HD23  LEU  19          2HD2      LEU  19  -4.831  -7.093  -1.147
  113    H    LYS  20           H        LYS  20  -8.370  -4.837  -1.298
  114    HA   LYS  20           HA       LYS  20  -9.718  -2.295  -1.237
  115    HB2  LYS  20           2HB      LYS  20 -10.637  -4.257  -2.486
  116    HB3  LYS  20           1HB      LYS  20 -10.909  -5.069  -0.949
  117    HG2  LYS  20           2HG      LYS  20 -12.451  -3.317  -0.279
  118    HG3  LYS  20           1HG      LYS  20 -12.169  -2.475  -1.800
  119    HD2  LYS  20           2HD      LYS  20 -13.085  -4.415  -3.007
  120    HD3  LYS  20           1HD      LYS  20 -13.400  -5.209  -1.461
  121    HE2  LYS  20           2HE      LYS  20 -14.573  -2.577  -2.364
  122    HE3  LYS  20           1HE      LYS  20 -15.415  -4.119  -2.353
  123    HZ1  LYS  20           3HZ      LYS  20 -14.344  -2.736   0.053
  124    HZ2  LYS  20           1HZ      LYS  20 -15.213  -4.182   0.054
  125    HZ3  LYS  20           2HZ      LYS  20 -15.946  -2.732  -0.427
  126    H    ILE  21           H        ILE  21  -8.613  -4.579   0.989
  127    HA   ILE  21           HA       ILE  21 -10.058  -3.237   3.133
  128    HB   ILE  21           HB       ILE  21  -9.600  -5.385   4.485
  129   HG12  ILE  21          2HG1      ILE  21  -9.575  -7.461   3.051
  130   HG13  ILE  21          1HG1      ILE  21  -9.200  -6.455   1.670
  131   HG21  ILE  21          1HG2      ILE  21 -11.628  -6.443   3.579
  132   HG22  ILE  21          2HG2      ILE  21 -11.534  -5.367   2.184
  133   HG23  ILE  21          3HG2      ILE  21 -11.804  -4.701   3.794
  134   HD11  ILE  21          3HD1      ILE  21  -7.219  -7.577   2.503
  135   HD12  ILE  21          1HD1      ILE  21  -7.468  -6.876   4.103
  136   HD13  ILE  21          2HD1      ILE  21  -7.073  -5.835   2.737
  137    H    GLY  22           H        GLY  22  -7.987  -2.204   2.180
  138    HA2  GLY  22           2HA      GLY  22  -6.423  -0.991   3.865
  139    HA3  GLY  22           1HA      GLY  22  -5.839  -2.623   4.159
  140    H    TYR  23           H        TYR  23  -3.874  -2.629   3.429
  141    HA   TYR  23           HA       TYR  23  -3.471  -2.542   0.597
  142    HB2  TYR  23           2HB      TYR  23  -1.760  -0.831   0.547
  143    HB3  TYR  23           1HB      TYR  23  -3.202  -0.139   1.271
  144    HD1  TYR  23           1HD      TYR  23  -3.251   0.023   3.865
  145    HD2  TYR  23           2HD      TYR  23   0.282  -0.720   1.625
  146    HE1  TYR  23           1HE      TYR  23  -1.885   0.779   5.768
  147    HE2  TYR  23           2HE      TYR  23   1.640   0.020   3.512
  148    HH   TYR  23           HH       TYR  23   1.437   1.424   5.437
  149    H    GLU  24           H        GLU  24  -0.958  -2.910   0.264
  150    HA   GLU  24           HA       GLU  24   0.122  -4.633   2.354
  151    HB2  GLU  24           2HB      GLU  24  -1.126  -6.064   0.813
  152    HB3  GLU  24           1HB      GLU  24  -0.286  -5.369  -0.557
  153    HG2  GLU  24           2HG      GLU  24   0.668  -7.496  -0.096
  154    HG3  GLU  24           1HG      GLU  24   1.824  -6.258   0.366
  155    H    CYS  25           H        CYS  25   2.387  -4.647   2.315
  156    HA   CYS  25           HA       CYS  25   3.646  -2.838   0.382
  157    HB2  CYS  25           2HB      CYS  25   4.685  -3.767   3.071
  158    HB3  CYS  25           1HB      CYS  25   5.452  -2.610   2.001
  159    H    LEU  26           H        LEU  26   4.786  -3.844  -1.131
  160    HA   LEU  26           HA       LEU  26   5.243  -6.705  -0.860
  161    HB2  LEU  26           2HB      LEU  26   5.681  -4.872  -3.215
  162    HB3  LEU  26           1HB      LEU  26   5.755  -6.621  -3.242
  163    HG   LEU  26           HG       LEU  26   3.275  -4.982  -2.715
  164   HD11  LEU  26          1HD1      LEU  26   4.013  -4.821  -5.015
  165   HD12  LEU  26          2HD1      LEU  26   2.561  -5.822  -4.905
  166   HD13  LEU  26          3HD1      LEU  26   4.141  -6.576  -5.116
  167   HD21  LEU  26          3HD2      LEU  26   3.631  -7.959  -3.038
  168   HD22  LEU  26          1HD2      LEU  26   2.093  -7.112  -2.878
  169   HD23  LEU  26          2HD2      LEU  26   3.238  -7.120  -1.536
  170    HN1  NH2  27           1H       LEU  26   6.879  -6.441   0.700
  171    HN2  NH2  27           2H       LEU  26   8.499  -6.037   0.249
  Start of MODEL    9
    1    H1   GLY   1           1HT      GLY   1 -11.237   3.012  -5.063
    2    H2   GLY   1           2HT      GLY   1 -11.867   4.555  -4.967
    3    H3   GLY   1           3HT      GLY   1 -12.925   3.217  -5.055
    4    HA2  GLY   1           1HA      GLY   1 -12.841   4.044  -2.831
    5    HA3  GLY   1           2HA      GLY   1 -12.082   2.463  -2.924
    6    H    THR   2           H        THR   2 -10.938   3.053  -1.004
    7    HA   THR   2           HA       THR   2  -9.151   5.301  -1.155
    8    HB   THR   2           HB       THR   2 -10.228   5.130   0.931
    9    HG1  THR   2           1HG      THR   2  -7.715   3.993   1.551
   10   HG21  THR   2          3HG2      THR   2 -10.136   3.129   2.383
   11   HG22  THR   2          1HG2      THR   2  -9.267   2.279   1.107
   12   HG23  THR   2          2HG2      THR   2 -10.933   2.793   0.847
   13    H    ASN   3           H        ASN   3  -7.331   5.162  -2.131
   14    HA   ASN   3           HA       ASN   3  -5.821   2.652  -2.179
   15    HB2  ASN   3           2HB      ASN   3  -6.332   3.739  -4.370
   16    HB3  ASN   3           1HB      ASN   3  -5.489   5.180  -3.828
   17   HD21  ASN   3          1HD2      ASN   3  -4.947   3.588  -6.136
   18   HD22  ASN   3          2HD2      ASN   3  -3.329   3.004  -5.990
   19    H    GLU   4           H        GLU   4  -4.691   2.626  -0.333
   20    HA   GLU   4           HA       GLU   4  -3.679   4.907   0.995
   21    HB2  GLU   4           2HB      GLU   4  -2.993   1.982   1.317
   22    HB3  GLU   4           1HB      GLU   4  -2.402   3.249   2.370
   23    HG2  GLU   4           2HG      GLU   4  -4.237   2.072   3.414
   24    HG3  GLU   4           1HG      GLU   4  -4.707   3.730   3.071
   25    H    CYS   5           H        CYS   5  -2.427   2.853  -1.471
   26    HA   CYS   5           HA       CYS   5   0.328   3.310  -1.033
   27    HB2  CYS   5           2HB      CYS   5  -1.149   2.453  -3.498
   28    HB3  CYS   5           1HB      CYS   5   0.598   2.415  -3.307
   29    H    LEU   6           H        LEU   6  -2.107   5.010  -2.720
   30    HA   LEU   6           HA       LEU   6  -0.475   6.770  -4.213
   31    HB2  LEU   6           2HB      LEU   6  -3.211   7.107  -3.072
   32    HB3  LEU   6           1HB      LEU   6  -2.424   8.367  -3.987
   33    HG   LEU   6           HG       LEU   6  -3.239   5.618  -4.971
   34   HD11  LEU   6          1HD1      LEU   6  -5.101   7.159  -4.697
   35   HD12  LEU   6          2HD1      LEU   6  -4.787   6.843  -6.404
   36   HD13  LEU   6          3HD1      LEU   6  -4.261   8.362  -5.677
   37   HD21  LEU   6          3HD2      LEU   6  -1.174   6.273  -6.087
   38   HD22  LEU   6          1HD2      LEU   6  -1.863   7.854  -6.468
   39   HD23  LEU   6          2HD2      LEU   6  -2.532   6.400  -7.199
   40    H    ASP   7           H        ASP   7  -1.318   6.719  -0.892
   41    HA   ASP   7           HA       ASP   7  -0.077   9.352  -0.511
   42    HB2  ASP   7           2HB      ASP   7  -2.319   9.193   0.447
   43    HB3  ASP   7           1HB      ASP   7  -1.821   7.809   1.415
   44    H    ASN   8           H        ASN   8   1.965   9.310  -0.055
   45    HA   ASN   8           HA       ASN   8   3.988   8.903   0.905
   46    HB2  ASN   8           2HB      ASN   8   2.516   9.145   2.923
   47    HB3  ASN   8           1HB      ASN   8   2.468   7.398   3.053
   48   HD21  ASN   8          1HD2      ASN   8   4.439  10.232   3.445
   49   HD22  ASN   8          2HD2      ASN   8   5.753   9.468   4.263
   50    H    ASN   9           H        ASN   9   2.686   7.109  -0.839
   51    HA   ASN   9           HA       ASN   9   2.871   5.081  -1.932
   52    HB2  ASN   9           2HB      ASN   9   5.328   5.863  -1.977
   53    HB3  ASN   9           1HB      ASN   9   5.582   4.832  -0.572
   54   HD21  ASN   9          1HD2      ASN   9   5.885   2.679  -0.876
   55   HD22  ASN   9          2HD2      ASN   9   5.921   1.870  -2.390
   56    H    GLY  10           H        GLY  10   1.537   5.180   0.499
   57    HA2  GLY  10           2HA      GLY  10   0.324   3.643   1.694
   58    HA3  GLY  10           1HA      GLY  10   1.379   2.372   1.097
   59    H    GLY  11           H        GLY  11   3.548   4.466   2.126
   60    HA2  GLY  11           2HA      GLY  11   4.620   4.754   4.188
   61    HA3  GLY  11           1HA      GLY  11   3.504   3.588   4.908
   62    H    CYS  12           H        CYS  12   4.474   2.547   1.926
   63    HA   CYS  12           HA       CYS  12   6.205   0.533   3.112
   64    HB2  CYS  12           2HB      CYS  12   5.028   0.711   0.328
   65    HB3  CYS  12           1HB      CYS  12   5.803  -0.692   1.040
   66    H    SER  13           H        SER  13   8.370   0.739   2.847
   67    HA   SER  13           HA       SER  13   9.553   2.802   1.287
   68    HB2  SER  13           2HB      SER  13  10.896   0.348   2.404
   69    HB3  SER  13           1HB      SER  13  11.586   1.954   2.150
   70    HG   SER  13           HG       SER  13  10.358   2.739   3.823
   71    H    HIS  14           H        HIS  14   8.435  -0.319   0.669
   72    HA   HIS  14           HA       HIS  14   9.970  -0.585  -1.817
   73    HB2  HIS  14           2HB      HIS  14   8.657  -2.757  -0.144
   74    HB3  HIS  14           1HB      HIS  14   9.481  -3.030  -1.661
   75    HD1  HIS  14           1HD      HIS  14  12.034  -3.219  -1.586
   76    HD2  HIS  14           2HD      HIS  14  10.368  -2.124   2.050
   77    HE1  HIS  14           1HE      HIS  14  13.892  -3.368   0.074
   78    HE2  HIS  14           2HE      HIS  14  12.917  -2.281   2.123
   79    H    VAL  15           H        VAL  15   8.282  -2.447  -3.071
   80    HA   VAL  15           HA       VAL  15   6.322  -0.781  -4.181
   81    HB   VAL  15           HB       VAL  15   6.459  -3.818  -4.225
   82   HG11  VAL  15          1HG1      VAL  15   4.214  -3.042  -4.820
   83   HG12  VAL  15          2HG1      VAL  15   5.052  -3.696  -6.227
   84   HG13  VAL  15          3HG1      VAL  15   4.905  -1.954  -6.022
   85   HG21  VAL  15          3HG2      VAL  15   8.432  -2.761  -5.155
   86   HG22  VAL  15          1HG2      VAL  15   7.420  -1.766  -6.194
   87   HG23  VAL  15          2HG2      VAL  15   7.472  -3.514  -6.429
   88    H    CYS  16           H        CYS  16   4.294  -0.299  -3.635
   89    HA   CYS  16           HA       CYS  16   3.146  -1.579  -1.279
   90    HB2  CYS  16           2HB      CYS  16   3.348   0.961  -1.422
   91    HB3  CYS  16           1HB      CYS  16   2.263   0.834  -2.809
   92    H    ASN  17           H        ASN  17   1.345  -2.738  -1.502
   93    HA   ASN  17           HA       ASN  17   0.146  -2.974  -4.183
   94    HB2  ASN  17           2HB      ASN  17   1.314  -5.023  -3.515
   95    HB3  ASN  17           1HB      ASN  17   0.348  -5.113  -2.046
   96   HD21  ASN  17          1HD2      ASN  17  -0.664  -7.104  -2.524
   97   HD22  ASN  17          2HD2      ASN  17  -1.741  -7.285  -3.839
   98    H    ASP  18           H        ASP  18  -1.550  -1.715  -4.044
   99    HA   ASP  18           HA       ASP  18  -3.050  -1.364  -1.632
  100    HB2  ASP  18           2HB      ASP  18  -2.884   0.560  -3.015
  101    HB3  ASP  18           1HB      ASP  18  -3.459  -0.327  -4.421
  102    H    LEU  19           H        LEU  19  -4.466  -2.615  -0.892
  103    HA   LEU  19           HA       LEU  19  -5.895  -4.459  -2.652
  104    HB2  LEU  19           2HB      LEU  19  -5.628  -4.497   0.355
  105    HB3  LEU  19           1HB      LEU  19  -6.331  -5.728  -0.634
  106    HG   LEU  19           HG       LEU  19  -3.403  -5.011  -0.744
  107   HD11  LEU  19          1HD1      LEU  19  -4.791  -7.350   0.551
  108   HD12  LEU  19          2HD1      LEU  19  -3.964  -6.030   1.383
  109   HD13  LEU  19          3HD1      LEU  19  -3.049  -7.151   0.378
  110   HD21  LEU  19          3HD2      LEU  19  -3.205  -7.062  -2.059
  111   HD22  LEU  19          1HD2      LEU  19  -4.264  -5.898  -2.852
  112   HD23  LEU  19          2HD2      LEU  19  -4.953  -7.279  -1.996
  113    H    LYS  20           H        LYS  20  -8.211  -4.877  -1.839
  114    HA   LYS  20           HA       LYS  20  -9.689  -2.488  -2.072
  115    HB2  LYS  20           2HB      LYS  20 -10.637  -5.137  -0.952
  116    HB3  LYS  20           1HB      LYS  20 -11.672  -3.825  -1.484
  117    HG2  LYS  20           2HG      LYS  20 -10.842  -4.068  -3.758
  118    HG3  LYS  20           1HG      LYS  20  -9.776  -5.371  -3.235
  119    HD2  LYS  20           2HD      LYS  20 -11.733  -6.671  -2.528
  120    HD3  LYS  20           1HD      LYS  20 -12.784  -5.369  -3.085
  121    HE2  LYS  20           2HE      LYS  20 -11.941  -5.659  -5.359
  122    HE3  LYS  20           1HE      LYS  20 -10.882  -6.950  -4.800
  123    HZ1  LYS  20           3HZ      LYS  20 -12.818  -8.215  -4.154
  124    HZ2  LYS  20           1HZ      LYS  20 -12.893  -7.821  -5.794
  125    HZ3  LYS  20           2HZ      LYS  20 -13.846  -6.989  -4.675
  126    H    ILE  21           H        ILE  21  -8.982  -4.464   0.725
  127    HA   ILE  21           HA       ILE  21  -9.471  -2.089   2.329
  128    HB   ILE  21           HB       ILE  21  -9.855  -3.541   4.293
  129   HG12  ILE  21          2HG1      ILE  21 -10.002  -5.858   2.357
  130   HG13  ILE  21          1HG1      ILE  21  -8.608  -5.531   3.384
  131   HG21  ILE  21          1HG2      ILE  21 -11.743  -4.078   2.009
  132   HG22  ILE  21          2HG2      ILE  21 -11.778  -2.695   3.102
  133   HG23  ILE  21          3HG2      ILE  21 -12.115  -4.314   3.718
  134   HD11  ILE  21          3HD1      ILE  21 -11.397  -6.126   4.308
  135   HD12  ILE  21          1HD1      ILE  21 -10.009  -5.762   5.334
  136   HD13  ILE  21          2HD1      ILE  21 -10.010  -7.230   4.348
  137    H    GLY  22           H        GLY  22  -7.841  -1.476   3.573
  138    HA2  GLY  22           2HA      GLY  22  -5.665  -1.242   4.200
  139    HA3  GLY  22           1HA      GLY  22  -5.587  -3.000   4.186
  140    H    TYR  23           H        TYR  23  -3.570  -3.086   3.355
  141    HA   TYR  23           HA       TYR  23  -3.190  -3.139   0.581
  142    HB2  TYR  23           2HB      TYR  23  -1.535  -1.310   0.373
  143    HB3  TYR  23           1HB      TYR  23  -3.067  -0.629   0.913
  144    HD1  TYR  23           1HD      TYR  23  -3.334  -0.054   3.372
  145    HD2  TYR  23           2HD      TYR  23   0.433  -1.077   1.685
  146    HE1  TYR  23           1HE      TYR  23  -2.206   0.900   5.327
  147    HE2  TYR  23           2HE      TYR  23   1.566  -0.125   3.638
  148    HH   TYR  23           HH       TYR  23   1.091   1.548   5.393
  149    H    GLU  24           H        GLU  24  -0.796  -3.767   0.276
  150    HA   GLU  24           HA       GLU  24   0.424  -4.560   2.812
  151    HB2  GLU  24           2HB      GLU  24   1.094  -6.707   1.927
  152    HB3  GLU  24           1HB      GLU  24  -0.653  -6.557   1.804
  153    HG2  GLU  24           2HG      GLU  24  -0.455  -6.036  -0.538
  154    HG3  GLU  24           1HG      GLU  24   1.305  -6.129  -0.430
  155    H    CYS  25           H        CYS  25   2.695  -4.669   2.761
  156    HA   CYS  25           HA       CYS  25   3.874  -3.093   0.611
  157    HB2  CYS  25           2HB      CYS  25   4.991  -3.867   3.317
  158    HB3  CYS  25           1HB      CYS  25   5.734  -2.782   2.152
  159    H    LEU  26           H        LEU  26   5.080  -4.121  -0.848
  160    HA   LEU  26           HA       LEU  26   5.597  -6.953  -0.469
  161    HB2  LEU  26           2HB      LEU  26   5.957  -5.195  -2.885
  162    HB3  LEU  26           1HB      LEU  26   6.131  -6.936  -2.864
  163    HG   LEU  26           HG       LEU  26   3.559  -5.415  -2.392
  164   HD11  LEU  26          1HD1      LEU  26   4.481  -7.072  -4.727
  165   HD12  LEU  26          2HD1      LEU  26   4.301  -5.319  -4.698
  166   HD13  LEU  26          3HD1      LEU  26   2.882  -6.354  -4.536
  167   HD21  LEU  26          3HD2      LEU  26   3.615  -7.497  -1.124
  168   HD22  LEU  26          1HD2      LEU  26   4.078  -8.382  -2.580
  169   HD23  LEU  26          2HD2      LEU  26   2.493  -7.614  -2.478
  170    HN1  NH2  27           1H       LEU  26   7.309  -7.013   0.868
  171    HN2  NH2  27           2H       LEU  26   8.879  -6.399   0.506
  Start of MODEL   10
    1    H1   GLY   1           1HT      GLY   1 -11.382   2.780  -5.951
    2    H2   GLY   1           2HT      GLY   1  -9.814   2.775  -5.295
    3    H3   GLY   1           3HT      GLY   1 -10.596   4.221  -5.538
    4    HA2  GLY   1           1HA      GLY   1 -12.218   3.686  -3.869
    5    HA3  GLY   1           2HA      GLY   1 -11.394   2.148  -3.604
    6    H    THR   2           H        THR   2 -10.857   2.672  -1.431
    7    HA   THR   2           HA       THR   2  -9.367   5.045  -0.855
    8    HB   THR   2           HB       THR   2  -9.805   2.582   0.872
    9    HG1  THR   2           1HG      THR   2 -11.481   4.528  -0.034
   10   HG21  THR   2          3HG2      THR   2  -9.551   4.182   2.733
   11   HG22  THR   2          1HG2      THR   2  -9.288   5.488   1.577
   12   HG23  THR   2          2HG2      THR   2  -8.112   4.181   1.714
   13    H    ASN   3           H        ASN   3  -7.511   4.873  -2.150
   14    HA   ASN   3           HA       ASN   3  -5.830   2.507  -1.910
   15    HB2  ASN   3           2HB      ASN   3  -6.079   3.324  -4.184
   16    HB3  ASN   3           1HB      ASN   3  -5.589   4.937  -3.694
   17   HD21  ASN   3          1HD2      ASN   3  -3.989   4.810  -5.322
   18   HD22  ASN   3          2HD2      ASN   3  -2.529   3.920  -5.083
   19    H    GLU   4           H        GLU   4  -4.659   2.445  -0.167
   20    HA   GLU   4           HA       GLU   4  -3.711   4.751   1.164
   21    HB2  GLU   4           2HB      GLU   4  -3.017   1.838   1.495
   22    HB3  GLU   4           1HB      GLU   4  -2.411   3.104   2.539
   23    HG2  GLU   4           2HG      GLU   4  -4.181   2.108   3.708
   24    HG3  GLU   4           1HG      GLU   4  -4.827   3.621   3.099
   25    H    CYS   5           H        CYS   5  -2.478   2.901  -1.450
   26    HA   CYS   5           HA       CYS   5   0.283   3.342  -0.936
   27    HB2  CYS   5           2HB      CYS   5  -1.168   2.503  -3.411
   28    HB3  CYS   5           1HB      CYS   5   0.580   2.569  -3.246
   29    H    LEU   6           H        LEU   6  -2.130   5.172  -2.495
   30    HA   LEU   6           HA       LEU   6  -0.381   6.870  -3.994
   31    HB2  LEU   6           2HB      LEU   6  -2.227   8.418  -4.212
   32    HB3  LEU   6           1HB      LEU   6  -2.676   6.729  -4.532
   33    HG   LEU   6           HG       LEU   6  -3.788   6.780  -2.230
   34   HD11  LEU   6          1HD1      LEU   6  -4.509   8.939  -1.368
   35   HD12  LEU   6          2HD1      LEU   6  -3.534   9.762  -2.584
   36   HD13  LEU   6          3HD1      LEU   6  -2.752   8.796  -1.334
   37   HD21  LEU   6          3HD2      LEU   6  -4.896   8.577  -4.368
   38   HD22  LEU   6          1HD2      LEU   6  -5.817   7.797  -3.086
   39   HD23  LEU   6          2HD2      LEU   6  -5.028   6.821  -4.331
   40    H    ASP   7           H        ASP   7  -1.446   6.766  -0.988
   41    HA   ASP   7           HA       ASP   7  -0.380   9.349  -0.095
   42    HB2  ASP   7           2HB      ASP   7  -2.479   8.536   0.921
   43    HB3  ASP   7           1HB      ASP   7  -1.608   7.152   1.570
   44    H    ASN   8           H        ASN   8   1.750   9.275  -0.297
   45    HA   ASN   8           HA       ASN   8   3.937   8.906   0.157
   46    HB2  ASN   8           2HB      ASN   8   2.741   8.057   2.770
   47    HB3  ASN   8           1HB      ASN   8   4.476   8.171   2.461
   48   HD21  ASN   8          1HD2      ASN   8   2.719   9.659   4.290
   49   HD22  ASN   8          2HD2      ASN   8   2.952  11.331   3.921
   50    H    ASN   9           H        ASN   9   2.589   6.855  -1.117
   51    HA   ASN   9           HA       ASN   9   2.917   4.779  -2.002
   52    HB2  ASN   9           2HB      ASN   9   5.326   5.661  -2.099
   53    HB3  ASN   9           1HB      ASN   9   5.595   4.800  -0.587
   54   HD21  ASN   9          1HD2      ASN   9   6.193   2.721  -0.687
   55   HD22  ASN   9          2HD2      ASN   9   6.253   1.754  -2.092
   56    H    GLY  10           H        GLY  10   1.597   5.114   0.492
   57    HA2  GLY  10           2HA      GLY  10   0.472   3.698   1.897
   58    HA3  GLY  10           1HA      GLY  10   1.405   2.362   1.247
   59    H    GLY  11           H        GLY  11   3.480   4.772   2.152
   60    HA2  GLY  11           2HA      GLY  11   4.834   5.049   3.984
   61    HA3  GLY  11           1HA      GLY  11   3.765   3.984   4.896
   62    H    CYS  12           H        CYS  12   4.511   2.553   1.973
   63    HA   CYS  12           HA       CYS  12   6.251   0.641   3.276
   64    HB2  CYS  12           2HB      CYS  12   5.178   0.698   0.435
   65    HB3  CYS  12           1HB      CYS  12   5.952  -0.668   1.218
   66    H    SER  13           H        SER  13   8.438   0.622   2.927
   67    HA   SER  13           HA       SER  13   9.624   2.729   1.375
   68    HB2  SER  13           2HB      SER  13  10.933   0.354   2.716
   69    HB3  SER  13           1HB      SER  13  11.738   1.828   2.173
   70    HG   SER  13           HG       SER  13   9.807   2.646   3.672
   71    H    HIS  14           H        HIS  14   8.607  -0.448   0.853
   72    HA   HIS  14           HA       HIS  14  10.142  -0.673  -1.623
   73    HB2  HIS  14           2HB      HIS  14   8.717  -2.815   0.000
   74    HB3  HIS  14           1HB      HIS  14   9.493  -3.099  -1.548
   75    HD1  HIS  14           1HD      HIS  14  10.293  -2.417   2.077
   76    HD2  HIS  14           2HD      HIS  14  12.263  -3.326  -1.473
   77    HE1  HIS  14           1HE      HIS  14  12.654  -2.919   2.722
   78    HE2  HIS  14           2HE      HIS  14  13.862  -3.251   0.549
   79    H    VAL  15           H        VAL  15   8.420  -2.429  -2.956
   80    HA   VAL  15           HA       VAL  15   6.604  -0.641  -4.109
   81    HB   VAL  15           HB       VAL  15   6.608  -3.677  -4.226
   82   HG11  VAL  15          1HG1      VAL  15   5.372  -3.441  -6.333
   83   HG12  VAL  15          2HG1      VAL  15   5.331  -1.696  -6.116
   84   HG13  VAL  15          3HG1      VAL  15   4.470  -2.743  -4.988
   85   HG21  VAL  15          3HG2      VAL  15   8.725  -2.728  -4.950
   86   HG22  VAL  15          1HG2      VAL  15   7.882  -1.654  -6.063
   87   HG23  VAL  15          2HG2      VAL  15   7.849  -3.398  -6.324
   88    H    CYS  16           H        CYS  16   4.392  -0.347  -3.854
   89    HA   CYS  16           HA       CYS  16   3.242  -1.532  -1.427
   90    HB2  CYS  16           2HB      CYS  16   3.502   0.996  -1.511
   91    HB3  CYS  16           1HB      CYS  16   2.391   0.966  -2.877
   92    H    ASN  17           H        ASN  17   1.277  -2.538  -1.598
   93    HA   ASN  17           HA       ASN  17   0.060  -2.651  -4.260
   94    HB2  ASN  17           2HB      ASN  17   1.322  -4.730  -3.911
   95    HB3  ASN  17           1HB      ASN  17   0.447  -5.022  -2.413
   96   HD21  ASN  17          1HD2      ASN  17  -1.651  -5.824  -2.524
   97   HD22  ASN  17          2HD2      ASN  17  -2.370  -6.407  -3.970
   98    H    ASP  18           H        ASP  18  -1.617  -1.480  -3.932
   99    HA   ASP  18           HA       ASP  18  -3.101  -1.307  -1.553
  100    HB2  ASP  18           2HB      ASP  18  -3.181   0.527  -3.032
  101    HB3  ASP  18           1HB      ASP  18  -3.697  -0.449  -4.387
  102    H    LEU  19           H        LEU  19  -4.857  -2.279  -0.848
  103    HA   LEU  19           HA       LEU  19  -5.963  -4.464  -2.460
  104    HB2  LEU  19           2HB      LEU  19  -5.689  -4.371   0.544
  105    HB3  LEU  19           1HB      LEU  19  -6.382  -5.651  -0.407
  106    HG   LEU  19           HG       LEU  19  -3.487  -4.885  -0.660
  107   HD11  LEU  19          1HD1      LEU  19  -4.772  -7.063   0.969
  108   HD12  LEU  19          2HD1      LEU  19  -3.957  -5.635   1.608
  109   HD13  LEU  19          3HD1      LEU  19  -3.042  -6.848   0.712
  110   HD21  LEU  19          3HD2      LEU  19  -3.332  -7.089  -1.708
  111   HD22  LEU  19          1HD2      LEU  19  -4.449  -6.042  -2.580
  112   HD23  LEU  19          2HD2      LEU  19  -5.072  -7.305  -1.521
  113    H    LYS  20           H        LYS  20  -8.226  -5.002  -1.629
  114    HA   LYS  20           HA       LYS  20  -9.881  -2.766  -1.967
  115    HB2  LYS  20           2HB      LYS  20 -10.444  -5.248  -2.297
  116    HB3  LYS  20           1HB      LYS  20 -10.692  -5.326  -0.564
  117    HG2  LYS  20           2HG      LYS  20 -12.243  -3.473  -2.363
  118    HG3  LYS  20           1HG      LYS  20 -12.755  -5.113  -2.002
  119    HD2  LYS  20           2HD      LYS  20 -12.956  -4.571   0.349
  120    HD3  LYS  20           1HD      LYS  20 -12.296  -2.959   0.063
  121    HE2  LYS  20           2HE      LYS  20 -14.843  -4.012  -1.163
  122    HE3  LYS  20           1HE      LYS  20 -14.785  -3.019   0.285
  123    HZ1  LYS  20           3HZ      LYS  20 -13.782  -2.193  -2.392
  124    HZ2  LYS  20           1HZ      LYS  20 -13.816  -1.227  -1.014
  125    HZ3  LYS  20           2HZ      LYS  20 -15.246  -1.727  -1.728
  126    H    ILE  21           H        ILE  21  -9.026  -4.530   0.940
  127    HA   ILE  21           HA       ILE  21  -9.689  -2.138   2.458
  128    HB   ILE  21           HB       ILE  21  -9.893  -3.551   4.486
  129   HG12  ILE  21          2HG1      ILE  21  -9.934  -5.951   2.657
  130   HG13  ILE  21          1HG1      ILE  21  -8.491  -5.456   3.541
  131   HG21  ILE  21          1HG2      ILE  21 -11.763  -4.341   2.265
  132   HG22  ILE  21          2HG2      ILE  21 -11.901  -2.919   3.295
  133   HG23  ILE  21          3HG2      ILE  21 -12.080  -4.531   3.989
  134   HD11  ILE  21          3HD1      ILE  21 -11.130  -6.236   4.735
  135   HD12  ILE  21          1HD1      ILE  21  -9.692  -5.700   5.606
  136   HD13  ILE  21          2HD1      ILE  21  -9.649  -7.219   4.695
  137    H    GLY  22           H        GLY  22  -8.120  -1.265   3.525
  138    HA2  GLY  22           2HA      GLY  22  -5.936  -0.714   4.025
  139    HA3  GLY  22           1HA      GLY  22  -5.722  -2.429   4.337
  140    H    TYR  23           H        TYR  23  -3.813  -2.798   3.430
  141    HA   TYR  23           HA       TYR  23  -3.492  -3.007   0.624
  142    HB2  TYR  23           2HB      TYR  23  -1.709  -1.360   0.333
  143    HB3  TYR  23           1HB      TYR  23  -3.138  -0.525   0.930
  144    HD1  TYR  23           2HD      TYR  23  -3.227  -0.045   3.480
  145    HD2  TYR  23           1HD      TYR  23   0.334  -1.136   1.436
  146    HE1  TYR  23           2HE      TYR  23  -1.895   0.869   5.325
  147    HE2  TYR  23           1HE      TYR  23   1.668  -0.230   3.275
  148    HH   TYR  23           HH       TYR  23   1.392   1.435   4.985
  149    H    GLU  24           H        GLU  24  -0.969  -3.543   0.325
  150    HA   GLU  24           HA       GLU  24   0.208  -4.598   2.766
  151    HB2  GLU  24           2HB      GLU  24   0.704  -6.753   1.751
  152    HB3  GLU  24           1HB      GLU  24  -1.029  -6.492   1.701
  153    HG2  GLU  24           2HG      GLU  24  -0.802  -5.825  -0.695
  154    HG3  GLU  24           1HG      GLU  24   0.909  -6.177  -0.570
  155    H    CYS  25           H        CYS  25   2.472  -4.628   2.648
  156    HA   CYS  25           HA       CYS  25   3.578  -3.097   0.434
  157    HB2  CYS  25           2HB      CYS  25   4.939  -4.106   2.952
  158    HB3  CYS  25           1HB      CYS  25   5.622  -2.981   1.786
  159    H    LEU  26           H        LEU  26   5.085  -3.952  -0.989
  160    HA   LEU  26           HA       LEU  26   5.408  -6.872  -0.911
  161    HB2  LEU  26           2HB      LEU  26   5.537  -4.981  -3.259
  162    HB3  LEU  26           1HB      LEU  26   5.748  -6.715  -3.344
  163    HG   LEU  26           HG       LEU  26   3.187  -5.250  -2.665
  164   HD11  LEU  26          1HD1      LEU  26   4.060  -6.817  -5.080
  165   HD12  LEU  26          2HD1      LEU  26   3.778  -5.077  -5.003
  166   HD13  LEU  26          3HD1      LEU  26   2.434  -6.204  -4.808
  167   HD21  LEU  26          3HD2      LEU  26   2.131  -7.426  -2.723
  168   HD22  LEU  26          1HD2      LEU  26   3.371  -7.388  -1.470
  169   HD23  LEU  26          2HD2      LEU  26   3.688  -8.201  -3.008
  170    HN1  NH2  27           1H       LEU  26   7.290  -7.040   0.191
  171    HN2  NH2  27           2H       LEU  26   8.787  -6.327  -0.299
  Start of MODEL   11
    1    H1   GLY   1           1HT      GLY   1  -9.313   8.432   0.083
    2    H2   GLY   1           2HT      GLY   1 -10.888   7.910   0.369
    3    H3   GLY   1           3HT      GLY   1 -10.586   9.022  -0.871
    4    HA2  GLY   1           1HA      GLY   1 -10.954   6.828  -1.762
    5    HA3  GLY   1           2HA      GLY   1  -9.301   7.359  -2.055
    6    H    THR   2           H        THR   2 -10.170   4.632  -2.005
    7    HA   THR   2           HA       THR   2  -9.050   3.755   0.522
    8    HB   THR   2           HB       THR   2 -10.792   2.144  -1.380
    9    HG1  THR   2           1HG      THR   2 -11.692   3.115   1.094
   10   HG21  THR   2          3HG2      THR   2  -9.406   0.818   0.161
   11   HG22  THR   2          1HG2      THR   2 -11.115   0.684   0.591
   12   HG23  THR   2          2HG2      THR   2 -10.024   1.737   1.514
   13    H    ASN   3           H        ASN   3  -7.559   4.606  -1.663
   14    HA   ASN   3           HA       ASN   3  -6.021   2.144  -2.148
   15    HB2  ASN   3           2HB      ASN   3  -6.758   3.239  -4.290
   16    HB3  ASN   3           1HB      ASN   3  -5.864   4.681  -3.824
   17   HD21  ASN   3          1HD2      ASN   3  -5.549   2.873  -6.134
   18   HD22  ASN   3          2HD2      ASN   3  -3.903   2.353  -6.075
   19    H    GLU   4           H        GLU   4  -5.048   2.194  -0.281
   20    HA   GLU   4           HA       GLU   4  -4.071   4.465   0.945
   21    HB2  GLU   4           2HB      GLU   4  -3.399   1.573   1.444
   22    HB3  GLU   4           1HB      GLU   4  -3.013   2.896   2.521
   23    HG2  GLU   4           2HG      GLU   4  -4.910   1.806   3.432
   24    HG3  GLU   4           1HG      GLU   4  -5.487   3.312   2.746
   25    H    CYS   5           H        CYS   5  -2.743   2.417  -1.482
   26    HA   CYS   5           HA       CYS   5   0.013   2.840  -0.854
   27    HB2  CYS   5           2HB      CYS   5  -1.327   1.714  -3.286
   28    HB3  CYS   5           1HB      CYS   5   0.413   1.798  -3.071
   29    H    LEU   6           H        LEU   6  -2.320   4.412  -2.850
   30    HA   LEU   6           HA       LEU   6  -0.476   5.988  -4.345
   31    HB2  LEU   6           2HB      LEU   6  -3.337   6.472  -3.604
   32    HB3  LEU   6           1HB      LEU   6  -2.419   7.594  -4.577
   33    HG   LEU   6           HG       LEU   6  -3.159   4.745  -5.283
   34   HD11  LEU   6          1HD1      LEU   6  -4.506   5.773  -7.037
   35   HD12  LEU   6          2HD1      LEU   6  -4.062   7.372  -6.441
   36   HD13  LEU   6          3HD1      LEU   6  -5.020   6.290  -5.431
   37   HD21  LEU   6          3HD2      LEU   6  -2.179   5.232  -7.496
   38   HD22  LEU   6          1HD2      LEU   6  -0.966   5.258  -6.215
   39   HD23  LEU   6          2HD2      LEU   6  -1.584   6.771  -6.876
   40    H    ASP   7           H        ASP   7  -1.783   6.226  -1.253
   41    HA   ASP   7           HA       ASP   7  -0.813   8.929  -0.759
   42    HB2  ASP   7           2HB      ASP   7  -2.919   8.362   0.253
   43    HB3  ASP   7           1HB      ASP   7  -2.217   6.913   0.971
   44    H    ASN   8           H        ASN   8   1.320   8.952  -0.718
   45    HA   ASN   8           HA       ASN   8   3.479   8.853   0.128
   46    HB2  ASN   8           2HB      ASN   8   2.140   9.337   2.160
   47    HB3  ASN   8           1HB      ASN   8   2.186   7.635   2.574
   48   HD21  ASN   8          1HD2      ASN   8   3.322   7.941   4.500
   49   HD22  ASN   8          2HD2      ASN   8   4.967   8.429   4.568
   50    H    ASN   9           H        ASN   9   2.209   6.625  -1.164
   51    HA   ASN   9           HA       ASN   9   2.588   4.478  -1.921
   52    HB2  ASN   9           2HB      ASN   9   4.953   5.371  -2.183
   53    HB3  ASN   9           1HB      ASN   9   5.326   4.686  -0.606
   54   HD21  ASN   9          1HD2      ASN   9   6.806   3.215  -1.295
   55   HD22  ASN   9          2HD2      ASN   9   6.462   1.857  -2.285
   56    H    GLY  10           H        GLY  10   1.249   4.832   0.491
   57    HA2  GLY  10           2HA      GLY  10   0.281   3.450   2.063
   58    HA3  GLY  10           1HA      GLY  10   1.358   2.167   1.537
   59    H    GLY  11           H        GLY  11   3.134   4.883   2.207
   60    HA2  GLY  11           2HA      GLY  11   4.345   5.566   4.066
   61    HA3  GLY  11           1HA      GLY  11   3.503   4.352   5.029
   62    H    CYS  12           H        CYS  12   4.659   3.155   2.064
   63    HA   CYS  12           HA       CYS  12   6.789   1.855   3.529
   64    HB2  CYS  12           2HB      CYS  12   5.132   0.927   1.201
   65    HB3  CYS  12           1HB      CYS  12   6.500   0.034   1.860
   66    H    SER  13           H        SER  13   8.771   1.698   2.736
   67    HA   SER  13           HA       SER  13   9.622   3.389   0.575
   68    HB2  SER  13           2HB      SER  13  11.198   1.395   2.214
   69    HB3  SER  13           1HB      SER  13  11.809   2.797   1.324
   70    HG   SER  13           HG       SER  13  10.464   4.060   2.712
   71    H    HIS  14           H        HIS  14   8.778   0.134   1.235
   72    HA   HIS  14           HA       HIS  14   9.972  -0.913  -1.215
   73    HB2  HIS  14           2HB      HIS  14   8.158  -2.323   0.764
   74    HB3  HIS  14           1HB      HIS  14   8.941  -3.075  -0.588
   75    HD1  HIS  14           1HD      HIS  14  11.485  -3.645  -0.381
   76    HD2  HIS  14           2HD      HIS  14   9.835  -1.892   2.998
   77    HE1  HIS  14           1HE      HIS  14  13.171  -3.926   1.421
   78    HE2  HIS  14           2HE      HIS  14  12.041  -3.091   3.488
   79    H    VAL  15           H        VAL  15   8.310  -2.397  -2.396
   80    HA   VAL  15           HA       VAL  15   6.463  -0.623  -3.632
   81    HB   VAL  15           HB       VAL  15   6.742  -3.634  -3.931
   82   HG11  VAL  15          1HG1      VAL  15   5.238  -1.663  -5.654
   83   HG12  VAL  15          2HG1      VAL  15   4.519  -2.920  -4.646
   84   HG13  VAL  15          3HG1      VAL  15   5.507  -3.361  -6.041
   85   HG21  VAL  15          3HG2      VAL  15   7.929  -3.094  -5.992
   86   HG22  VAL  15          1HG2      VAL  15   8.733  -2.379  -4.595
   87   HG23  VAL  15          2HG2      VAL  15   7.746  -1.373  -5.653
   88    H    CYS  16           H        CYS  16   4.351  -0.301  -3.297
   89    HA   CYS  16           HA       CYS  16   3.108  -1.854  -1.168
   90    HB2  CYS  16           2HB      CYS  16   3.283   0.678  -0.926
   91    HB3  CYS  16           1HB      CYS  16   2.247   0.753  -2.345
   92    H    ASN  17           H        ASN  17   1.594  -3.116  -1.690
   93    HA   ASN  17           HA       ASN  17   0.464  -3.174  -4.406
   94    HB2  ASN  17           2HB      ASN  17   1.527  -5.288  -3.786
   95    HB3  ASN  17           1HB      ASN  17   0.656  -5.321  -2.262
   96   HD21  ASN  17          1HD2      ASN  17  -0.230  -7.373  -2.705
   97   HD22  ASN  17          2HD2      ASN  17  -1.462  -7.582  -3.889
   98    H    ASP  18           H        ASP  18  -1.445  -2.288  -4.534
   99    HA   ASP  18           HA       ASP  18  -2.871  -1.764  -2.104
  100    HB2  ASP  18           2HB      ASP  18  -2.862   0.072  -3.581
  101    HB3  ASP  18           1HB      ASP  18  -3.375  -0.919  -4.942
  102    H    LEU  19           H        LEU  19  -3.818  -3.416  -1.282
  103    HA   LEU  19           HA       LEU  19  -5.390  -5.282  -2.799
  104    HB2  LEU  19           2HB      LEU  19  -5.694  -4.711   0.148
  105    HB3  LEU  19           1HB      LEU  19  -6.107  -6.145  -0.711
  106    HG   LEU  19           HG       LEU  19  -3.267  -5.277  -0.223
  107   HD11  LEU  19          1HD1      LEU  19  -4.345  -5.980   1.819
  108   HD12  LEU  19          2HD1      LEU  19  -3.215  -7.229   1.283
  109   HD13  LEU  19          3HD1      LEU  19  -4.945  -7.432   1.026
  110   HD21  LEU  19          3HD2      LEU  19  -2.694  -7.481  -1.085
  111   HD22  LEU  19          1HD2      LEU  19  -3.529  -6.522  -2.304
  112   HD23  LEU  19          2HD2      LEU  19  -4.394  -7.796  -1.440
  113    H    LYS  20           H        LYS  20  -7.817  -5.363  -2.436
  114    HA   LYS  20           HA       LYS  20  -8.980  -2.860  -3.076
  115    HB2  LYS  20           2HB      LYS  20  -9.928  -5.234  -3.490
  116    HB3  LYS  20           1HB      LYS  20 -10.452  -5.191  -1.821
  117    HG2  LYS  20           2HG      LYS  20 -12.385  -4.527  -2.822
  118    HG3  LYS  20           1HG      LYS  20 -11.621  -2.954  -2.621
  119    HD2  LYS  20           2HD      LYS  20 -11.440  -4.607  -5.151
  120    HD3  LYS  20           1HD      LYS  20 -12.654  -3.372  -4.887
  121    HE2  LYS  20           2HE      LYS  20  -9.664  -2.883  -4.914
  122    HE3  LYS  20           1HE      LYS  20 -10.735  -2.638  -6.279
  123    HZ1  LYS  20           3HZ      LYS  20 -10.346  -0.558  -5.166
  124    HZ2  LYS  20           1HZ      LYS  20 -10.911  -1.164  -3.695
  125    HZ3  LYS  20           2HZ      LYS  20 -11.954  -1.005  -4.994
  126    H    ILE  21           H        ILE  21  -9.076  -4.787  -0.146
  127    HA   ILE  21           HA       ILE  21  -9.661  -2.347   1.332
  128    HB   ILE  21           HB       ILE  21 -10.292  -3.843   3.245
  129   HG12  ILE  21          2HG1      ILE  21 -10.383  -6.032   1.163
  130   HG13  ILE  21          1HG1      ILE  21  -9.093  -5.873   2.350
  131   HG21  ILE  21          1HG2      ILE  21 -11.918  -4.089   0.729
  132   HG22  ILE  21          2HG2      ILE  21 -11.990  -2.781   1.913
  133   HG23  ILE  21          3HG2      ILE  21 -12.503  -4.410   2.360
  134   HD11  ILE  21          3HD1      ILE  21 -10.707  -6.137   4.120
  135   HD12  ILE  21          1HD1      ILE  21 -10.725  -7.529   3.032
  136   HD13  ILE  21          2HD1      ILE  21 -12.003  -6.302   2.932
  137    H    GLY  22           H        GLY  22  -8.338  -1.741   2.853
  138    HA2  GLY  22           2HA      GLY  22  -6.249  -1.393   3.758
  139    HA3  GLY  22           1HA      GLY  22  -6.089  -3.148   3.780
  140    H    TYR  23           H        TYR  23  -3.910  -2.975   3.205
  141    HA   TYR  23           HA       TYR  23  -3.446  -3.034   0.411
  142    HB2  TYR  23           2HB      TYR  23  -1.677  -1.335   0.351
  143    HB3  TYR  23           1HB      TYR  23  -3.198  -0.602   0.828
  144    HD1  TYR  23           1HD      TYR  23  -3.530  -0.054   3.307
  145    HD2  TYR  23           2HD      TYR  23   0.237  -1.151   1.693
  146    HE1  TYR  23           1HE      TYR  23  -2.408   0.968   5.241
  147    HE2  TYR  23           2HE      TYR  23   1.364  -0.143   3.615
  148    HH   TYR  23           HH       TYR  23   0.895   1.599   5.241
  149    H    GLU  24           H        GLU  24  -0.928  -3.456   0.140
  150    HA   GLU  24           HA       GLU  24   0.074  -5.062   2.361
  151    HB2  GLU  24           2HB      GLU  24  -1.257  -6.582   1.084
  152    HB3  GLU  24           1HB      GLU  24  -0.578  -6.005  -0.424
  153    HG2  GLU  24           2HG      GLU  24   1.570  -6.976   0.176
  154    HG3  GLU  24           1HG      GLU  24   0.890  -7.528   1.707
  155    H    CYS  25           H        CYS  25   2.086  -4.185   2.612
  156    HA   CYS  25           HA       CYS  25   3.534  -3.276   0.281
  157    HB2  CYS  25           2HB      CYS  25   4.271  -3.257   3.204
  158    HB3  CYS  25           1HB      CYS  25   5.280  -2.594   1.920
  159    H    LEU  26           H        LEU  26   5.232  -4.185  -0.625
  160    HA   LEU  26           HA       LEU  26   5.990  -6.874   0.308
  161    HB2  LEU  26           2HB      LEU  26   5.712  -5.858  -2.518
  162    HB3  LEU  26           1HB      LEU  26   6.224  -7.472  -2.064
  163    HG   LEU  26           HG       LEU  26   3.514  -6.286  -1.497
  164   HD11  LEU  26          1HD1      LEU  26   3.892  -6.605  -3.877
  165   HD12  LEU  26          2HD1      LEU  26   2.712  -7.755  -3.253
  166   HD13  LEU  26          3HD1      LEU  26   4.369  -8.278  -3.581
  167   HD21  LEU  26          3HD2      LEU  26   2.897  -8.595  -0.930
  168   HD22  LEU  26          1HD2      LEU  26   4.169  -7.985   0.126
  169   HD23  LEU  26          2HD2      LEU  26   4.570  -9.100  -1.178
  170    HN1  NH2  27           1H       LEU  26   7.377  -5.311  -2.476
  171    HN2  NH2  27           2H       LEU  26   8.920  -4.986  -1.789
  Start of MODEL   12
    1    H1   GLY   1           1HT      GLY   1 -12.778   2.260  -4.661
    2    H2   GLY   1           2HT      GLY   1 -11.275   2.973  -5.026
    3    H3   GLY   1           3HT      GLY   1 -12.462   3.856  -4.210
    4    HA2  GLY   1           1HA      GLY   1 -12.305   2.420  -2.323
    5    HA3  GLY   1           2HA      GLY   1 -11.095   1.463  -3.172
    6    H    THR   2           H        THR   2 -10.369   2.417  -0.805
    7    HA   THR   2           HA       THR   2  -9.092   4.984  -1.001
    8    HB   THR   2           HB       THR   2  -8.693   2.842   1.093
    9    HG1  THR   2           1HG      THR   2 -10.954   4.182   0.376
   10   HG21  THR   2          3HG2      THR   2  -7.262   4.855   1.206
   11   HG22  THR   2          1HG2      THR   2  -8.381   4.757   2.566
   12   HG23  THR   2          2HG2      THR   2  -8.718   5.859   1.239
   13    H    ASN   3           H        ASN   3  -7.171   5.169  -2.056
   14    HA   ASN   3           HA       ASN   3  -5.560   2.765  -2.537
   15    HB2  ASN   3           2HB      ASN   3  -6.336   4.262  -4.440
   16    HB3  ASN   3           1HB      ASN   3  -5.267   5.493  -3.813
   17   HD21  ASN   3          1HD2      ASN   3  -4.572   2.102  -3.939
   18   HD22  ASN   3          2HD2      ASN   3  -3.265   2.176  -5.071
   19    H    GLU   4           H        GLU   4  -4.719   2.771  -0.401
   20    HA   GLU   4           HA       GLU   4  -3.487   4.818   0.993
   21    HB2  GLU   4           2HB      GLU   4  -2.818   1.893   0.931
   22    HB3  GLU   4           1HB      GLU   4  -1.964   3.011   1.969
   23    HG2  GLU   4           2HG      GLU   4  -3.631   1.867   3.233
   24    HG3  GLU   4           1HG      GLU   4  -4.093   3.550   3.082
   25    H    CYS   5           H        CYS   5  -2.146   2.863  -1.529
   26    HA   CYS   5           HA       CYS   5   0.553   3.436  -1.310
   27    HB2  CYS   5           2HB      CYS   5  -1.061   2.873  -3.763
   28    HB3  CYS   5           1HB      CYS   5   0.686   2.799  -3.638
   29    H    LEU   6           H        LEU   6  -1.952   5.378  -2.563
   30    HA   LEU   6           HA       LEU   6  -0.430   7.218  -4.084
   31    HB2  LEU   6           2HB      LEU   6  -3.048   7.480  -2.655
   32    HB3  LEU   6           1HB      LEU   6  -2.350   8.823  -3.545
   33    HG   LEU   6           HG       LEU   6  -3.294   6.154  -4.620
   34   HD11  LEU   6          1HD1      LEU   6  -4.978   7.507  -5.751
   35   HD12  LEU   6          2HD1      LEU   6  -4.336   8.962  -4.991
   36   HD13  LEU   6          3HD1      LEU   6  -5.078   7.706  -4.001
   37   HD21  LEU   6          3HD2      LEU   6  -1.350   6.899  -5.906
   38   HD22  LEU   6          1HD2      LEU   6  -2.062   8.506  -6.082
   39   HD23  LEU   6          2HD2      LEU   6  -2.823   7.113  -6.844
   40    H    ASP   7           H        ASP   7  -1.129   7.022  -0.662
   41    HA   ASP   7           HA       ASP   7   0.130   9.624  -0.220
   42    HB2  ASP   7           2HB      ASP   7  -2.034   9.276   0.897
   43    HB3  ASP   7           1HB      ASP   7  -1.378   7.865   1.722
   44    H    ASN   8           H        ASN   8   2.223   9.405  -0.251
   45    HA   ASN   8           HA       ASN   8   4.342   8.887   0.327
   46    HB2  ASN   8           2HB      ASN   8   3.064   7.956   2.899
   47    HB3  ASN   8           1HB      ASN   8   4.793   8.091   2.590
   48   HD21  ASN   8          1HD2      ASN   8   1.833   9.825   3.212
   49   HD22  ASN   8          2HD2      ASN   8   2.572  11.363   3.438
   50    H    ASN   9           H        ASN   9   2.913   7.044  -1.096
   51    HA   ASN   9           HA       ASN   9   3.091   4.955  -2.056
   52    HB2  ASN   9           2HB      ASN   9   5.581   5.526  -1.864
   53    HB3  ASN   9           1HB      ASN   9   5.597   4.582  -0.382
   54   HD21  ASN   9          1HD2      ASN   9   6.945   3.038  -1.073
   55   HD22  ASN   9          2HD2      ASN   9   6.607   1.872  -2.287
   56    H    GLY  10           H        GLY  10   1.685   5.401   0.452
   57    HA2  GLY  10           2HA      GLY  10   0.312   4.070   1.723
   58    HA3  GLY  10           1HA      GLY  10   1.165   2.654   1.124
   59    H    GLY  11           H        GLY  11   3.552   4.606   2.091
   60    HA2  GLY  11           2HA      GLY  11   4.635   4.864   4.149
   61    HA3  GLY  11           1HA      GLY  11   3.514   3.702   4.865
   62    H    CYS  12           H        CYS  12   4.439   2.641   1.856
   63    HA   CYS  12           HA       CYS  12   6.155   0.619   3.009
   64    HB2  CYS  12           2HB      CYS  12   5.129   0.942   0.178
   65    HB3  CYS  12           1HB      CYS  12   5.862  -0.500   0.866
   66    H    SER  13           H        SER  13   8.330   0.482   2.574
   67    HA   SER  13           HA       SER  13   9.597   2.641   1.136
   68    HB2  SER  13           2HB      SER  13  11.638   1.386   2.004
   69    HB3  SER  13           1HB      SER  13  10.584   2.101   3.233
   70    HG   SER  13           HG       SER  13  11.332  -0.203   3.402
   71    H    HIS  14           H        HIS  14   8.602  -0.550   0.789
   72    HA   HIS  14           HA       HIS  14  10.119  -0.959  -1.691
   73    HB2  HIS  14           2HB      HIS  14   8.465  -2.924  -0.058
   74    HB3  HIS  14           1HB      HIS  14   9.313  -3.327  -1.536
   75    HD1  HIS  14           1HD      HIS  14  11.908  -3.684  -1.352
   76    HD2  HIS  14           2HD      HIS  14  10.052  -2.737   2.255
   77    HE1  HIS  14           1HE      HIS  14  13.554  -4.260   0.434
   78    HE2  HIS  14           2HE      HIS  14  12.363  -3.795   2.606
   79    H    VAL  15           H        VAL  15   8.282  -2.628  -3.007
   80    HA   VAL  15           HA       VAL  15   6.503  -0.795  -4.148
   81    HB   VAL  15           HB       VAL  15   6.461  -3.829  -4.244
   82   HG11  VAL  15          1HG1      VAL  15   4.255  -2.981  -4.827
   83   HG12  VAL  15          2HG1      VAL  15   5.081  -3.562  -6.278
   84   HG13  VAL  15          3HG1      VAL  15   4.978  -1.833  -5.951
   85   HG21  VAL  15          3HG2      VAL  15   7.498  -1.786  -6.192
   86   HG22  VAL  15          1HG2      VAL  15   7.484  -3.531  -6.440
   87   HG23  VAL  15          2HG2      VAL  15   8.477  -2.828  -5.162
   88    H    CYS  16           H        CYS  16   4.471  -0.224  -3.701
   89    HA   CYS  16           HA       CYS  16   3.213  -1.342  -1.321
   90    HB2  CYS  16           2HB      CYS  16   3.346   1.149  -1.542
   91    HB3  CYS  16           1HB      CYS  16   2.396   1.022  -3.020
   92    H    ASN  17           H        ASN  17   1.251  -2.320  -1.373
   93    HA   ASN  17           HA       ASN  17   0.053  -2.893  -3.995
   94    HB2  ASN  17           2HB      ASN  17   1.296  -4.885  -3.278
   95    HB3  ASN  17           1HB      ASN  17   0.473  -4.859  -1.724
   96   HD21  ASN  17          1HD2      ASN  17  -0.262  -6.974  -2.094
   97   HD22  ASN  17          2HD2      ASN  17  -1.550  -7.339  -3.171
   98    H    ASP  18           H        ASP  18  -1.736  -1.792  -3.917
   99    HA   ASP  18           HA       ASP  18  -3.130  -1.418  -1.417
  100    HB2  ASP  18           2HB      ASP  18  -2.989   0.549  -2.706
  101    HB3  ASP  18           1HB      ASP  18  -3.520  -0.273  -4.164
  102    H    LEU  19           H        LEU  19  -4.680  -2.590  -0.767
  103    HA   LEU  19           HA       LEU  19  -5.991  -4.360  -2.674
  104    HB2  LEU  19           2HB      LEU  19  -5.912  -4.534   0.329
  105    HB3  LEU  19           1HB      LEU  19  -6.585  -5.713  -0.763
  106    HG   LEU  19           HG       LEU  19  -3.654  -5.039  -0.531
  107   HD11  LEU  19          1HD1      LEU  19  -3.452  -7.257   0.443
  108   HD12  LEU  19          2HD1      LEU  19  -5.203  -7.457   0.359
  109   HD13  LEU  19          3HD1      LEU  19  -4.506  -6.220   1.405
  110   HD21  LEU  19          3HD2      LEU  19  -4.238  -5.714  -2.793
  111   HD22  LEU  19          1HD2      LEU  19  -5.075  -7.135  -2.169
  112   HD23  LEU  19          2HD2      LEU  19  -3.328  -6.989  -1.985
  113    H    LYS  20           H        LYS  20  -8.288  -4.764  -2.109
  114    HA   LYS  20           HA       LYS  20  -9.743  -2.345  -2.024
  115    HB2  LYS  20           2HB      LYS  20 -10.690  -5.211  -1.712
  116    HB3  LYS  20           1HB      LYS  20 -11.768  -3.833  -1.844
  117    HG2  LYS  20           2HG      LYS  20 -10.996  -3.352  -4.058
  118    HG3  LYS  20           1HG      LYS  20  -9.741  -4.582  -3.941
  119    HD2  LYS  20           2HD      LYS  20 -11.417  -6.324  -3.848
  120    HD3  LYS  20           1HD      LYS  20 -12.704  -5.118  -3.803
  121    HE2  LYS  20           2HE      LYS  20 -12.420  -6.119  -6.040
  122    HE3  LYS  20           1HE      LYS  20 -12.155  -4.380  -6.033
  123    HZ1  LYS  20           3HZ      LYS  20  -9.995  -6.429  -5.999
  124    HZ2  LYS  20           1HZ      LYS  20  -9.774  -4.763  -6.098
  125    HZ3  LYS  20           2HZ      LYS  20 -10.504  -5.593  -7.362
  126    H    ILE  21           H        ILE  21  -9.105  -4.826   0.363
  127    HA   ILE  21           HA       ILE  21  -9.926  -2.842   2.325
  128    HB   ILE  21           HB       ILE  21 -10.035  -4.621   4.030
  129   HG12  ILE  21          2HG1      ILE  21  -9.792  -6.625   1.783
  130   HG13  ILE  21          1HG1      ILE  21  -8.441  -6.194   2.833
  131   HG21  ILE  21          1HG2      ILE  21 -12.099  -5.681   3.253
  132   HG22  ILE  21          2HG2      ILE  21 -11.756  -5.114   1.616
  133   HG23  ILE  21          3HG2      ILE  21 -12.052  -3.951   2.910
  134   HD11  ILE  21          3HD1      ILE  21  -9.486  -8.225   3.589
  135   HD12  ILE  21          1HD1      ILE  21 -11.053  -7.392   3.689
  136   HD13  ILE  21          2HD1      ILE  21  -9.725  -6.897   4.740
  137    H    GLY  22           H        GLY  22  -8.514  -2.017   3.558
  138    HA2  GLY  22           2HA      GLY  22  -6.416  -1.255   4.199
  139    HA3  GLY  22           1HA      GLY  22  -6.030  -2.964   4.351
  140    H    TYR  23           H        TYR  23  -4.057  -3.040   3.545
  141    HA   TYR  23           HA       TYR  23  -3.589  -3.187   0.782
  142    HB2  TYR  23           2HB      TYR  23  -2.069  -1.326   0.456
  143    HB3  TYR  23           1HB      TYR  23  -3.551  -0.641   1.110
  144    HD1  TYR  23           2HD      TYR  23  -3.539  -0.409   3.778
  145    HD2  TYR  23           1HD      TYR  23  -0.066  -0.669   1.341
  146    HE1  TYR  23           2HE      TYR  23  -2.215   0.632   5.560
  147    HE2  TYR  23           1HE      TYR  23   1.260   0.362   3.115
  148    HH   TYR  23           HH       TYR  23   0.852   1.853   5.017
  149    H    GLU  24           H        GLU  24  -0.935  -3.341   0.643
  150    HA   GLU  24           HA       GLU  24   0.271  -4.056   3.137
  151    HB2  GLU  24           2HB      GLU  24   0.898  -6.329   2.472
  152    HB3  GLU  24           1HB      GLU  24  -0.843  -6.161   2.570
  153    HG2  GLU  24           2HG      GLU  24  -0.952  -6.023   0.117
  154    HG3  GLU  24           1HG      GLU  24   0.801  -6.156   0.062
  155    H    CYS  25           H        CYS  25   2.599  -4.638   2.756
  156    HA   CYS  25           HA       CYS  25   3.564  -3.068   0.486
  157    HB2  CYS  25           2HB      CYS  25   4.950  -3.691   3.100
  158    HB3  CYS  25           1HB      CYS  25   5.578  -2.681   1.803
  159    H    LEU  26           H        LEU  26   4.795  -4.031  -0.971
  160    HA   LEU  26           HA       LEU  26   5.473  -6.845  -0.563
  161    HB2  LEU  26           2HB      LEU  26   5.130  -5.252  -3.102
  162    HB3  LEU  26           1HB      LEU  26   5.544  -6.948  -3.020
  163    HG   LEU  26           HG       LEU  26   2.922  -5.748  -2.117
  164   HD11  LEU  26          1HD1      LEU  26   2.014  -6.892  -4.076
  165   HD12  LEU  26          2HD1      LEU  26   3.645  -7.379  -4.545
  166   HD13  LEU  26          3HD1      LEU  26   3.204  -5.672  -4.526
  167   HD21  LEU  26          3HD2      LEU  26   3.510  -7.743  -0.830
  168   HD22  LEU  26          1HD2      LEU  26   3.822  -8.624  -2.327
  169   HD23  LEU  26          2HD2      LEU  26   2.189  -8.082  -1.947
  170    HN1  NH2  27           1H       LEU  26   7.427  -6.610   0.385
  171    HN2  NH2  27           2H       LEU  26   8.803  -5.874  -0.354
  Start of MODEL   13
    1    H1   GLY   1           1HT      GLY   1 -12.960   3.007  -2.937
    2    H2   GLY   1           2HT      GLY   1 -13.304   1.366  -2.599
    3    H3   GLY   1           3HT      GLY   1 -11.846   1.807  -3.332
    4    HA2  GLY   1           1HA      GLY   1 -12.634   2.600  -0.620
    5    HA3  GLY   1           2HA      GLY   1 -11.537   1.281  -1.023
    6    H    THR   2           H        THR   2 -10.398   3.015   0.512
    7    HA   THR   2           HA       THR   2  -9.256   5.268  -0.807
    8    HB   THR   2           HB       THR   2  -8.545   3.866   1.780
    9    HG1  THR   2           1HG      THR   2  -9.766   6.277   2.017
   10   HG21  THR   2          3HG2      THR   2  -7.470   6.003   2.399
   11   HG22  THR   2          1HG2      THR   2  -7.843   6.635   0.795
   12   HG23  THR   2          2HG2      THR   2  -6.717   5.292   0.969
   13    H    ASN   3           H        ASN   3  -7.447   5.214  -2.050
   14    HA   ASN   3           HA       ASN   3  -5.785   2.822  -2.092
   15    HB2  ASN   3           2HB      ASN   3  -6.383   3.985  -4.251
   16    HB3  ASN   3           1HB      ASN   3  -5.529   5.402  -3.672
   17   HD21  ASN   3          1HD2      ASN   3  -5.088   3.814  -6.029
   18   HD22  ASN   3          2HD2      ASN   3  -3.448   3.268  -5.952
   19    H    GLU   4           H        GLU   4  -4.615   2.799  -0.232
   20    HA   GLU   4           HA       GLU   4  -3.511   5.220   0.801
   21    HB2  GLU   4           2HB      GLU   4  -2.911   2.415   1.731
   22    HB3  GLU   4           1HB      GLU   4  -2.659   3.905   2.618
   23    HG2  GLU   4           2HG      GLU   4  -4.563   3.197   3.628
   24    HG3  GLU   4           1HG      GLU   4  -5.282   4.104   2.303
   25    H    CYS   5           H        CYS   5  -2.496   2.980  -1.508
   26    HA   CYS   5           HA       CYS   5   0.311   3.171  -0.897
   27    HB2  CYS   5           2HB      CYS   5  -1.151   1.921  -3.184
   28    HB3  CYS   5           1HB      CYS   5   0.602   1.977  -3.072
   29    H    LEU   6           H        LEU   6  -1.864   4.848  -2.939
   30    HA   LEU   6           HA       LEU   6   0.194   6.090  -4.491
   31    HB2  LEU   6           2HB      LEU   6  -1.483   7.656  -5.250
   32    HB3  LEU   6           1HB      LEU   6  -2.030   5.967  -5.307
   33    HG   LEU   6           HG       LEU   6  -3.467   6.512  -3.289
   34   HD11  LEU   6          1HD1      LEU   6  -4.055   8.837  -2.888
   35   HD12  LEU   6          2HD1      LEU   6  -2.843   9.361  -4.058
   36   HD13  LEU   6          3HD1      LEU   6  -2.340   8.571  -2.562
   37   HD21  LEU   6          3HD2      LEU   6  -3.984   7.992  -5.854
   38   HD22  LEU   6          1HD2      LEU   6  -5.191   7.591  -4.635
   39   HD23  LEU   6          2HD2      LEU   6  -4.371   6.305  -5.519
   40    H    ASP   7           H        ASP   7  -1.238   6.574  -1.702
   41    HA   ASP   7           HA       ASP   7  -0.163   9.244  -1.148
   42    HB2  ASP   7           2HB      ASP   7  -2.405   8.767  -0.321
   43    HB3  ASP   7           1HB      ASP   7  -1.778   7.418   0.622
   44    H    ASN   8           H        ASN   8   1.951   9.192  -0.878
   45    HA   ASN   8           HA       ASN   8   3.996   8.972   0.143
   46    HB2  ASN   8           2HB      ASN   8   2.554   9.599   2.038
   47    HB3  ASN   8           1HB      ASN   8   2.390   7.910   2.473
   48   HD21  ASN   8          1HD2      ASN   8   3.365   8.067   4.443
   49   HD22  ASN   8          2HD2      ASN   8   5.039   8.427   4.691
   50    H    ASN   9           H        ASN   9   2.744   6.850  -1.249
   51    HA   ASN   9           HA       ASN   9   3.050   4.663  -1.977
   52    HB2  ASN   9           2HB      ASN   9   5.475   5.599  -1.956
   53    HB3  ASN   9           1HB      ASN   9   5.649   4.709  -0.447
   54   HD21  ASN   9          1HD2      ASN   9   5.927   2.510  -0.531
   55   HD22  ASN   9          2HD2      ASN   9   6.180   1.613  -1.965
   56    H    GLY  10           H        GLY  10   1.566   5.060   0.395
   57    HA2  GLY  10           2HA      GLY  10   0.491   3.729   1.929
   58    HA3  GLY  10           1HA      GLY  10   1.495   2.386   1.408
   59    H    GLY  11           H        GLY  11   3.521   4.864   2.187
   60    HA2  GLY  11           2HA      GLY  11   4.733   5.420   4.064
   61    HA3  GLY  11           1HA      GLY  11   3.657   4.407   5.025
   62    H    CYS  12           H        CYS  12   4.648   2.742   2.350
   63    HA   CYS  12           HA       CYS  12   6.534   1.209   3.971
   64    HB2  CYS  12           2HB      CYS  12   4.962   0.482   1.489
   65    HB3  CYS  12           1HB      CYS  12   6.080  -0.598   2.311
   66    H    SER  13           H        SER  13   8.628   0.918   3.296
   67    HA   SER  13           HA       SER  13   9.632   2.803   1.446
   68    HB2  SER  13           2HB      SER  13  11.785   1.583   2.120
   69    HB3  SER  13           1HB      SER  13  10.898   2.448   3.379
   70    HG   SER  13           HG       SER  13  11.613   0.248   3.827
   71    H    HIS  14           H        HIS  14   8.486  -0.363   1.172
   72    HA   HIS  14           HA       HIS  14   9.974  -0.711  -1.311
   73    HB2  HIS  14           2HB      HIS  14   8.732  -2.829   0.458
   74    HB3  HIS  14           1HB      HIS  14   9.476  -3.146  -1.101
   75    HD1  HIS  14           1HD      HIS  14  10.291  -2.426   2.447
   76    HD2  HIS  14           2HD      HIS  14  12.264  -2.917  -1.165
   77    HE1  HIS  14           1HE      HIS  14  12.718  -2.639   3.033
   78    HE2  HIS  14           2HE      HIS  14  13.907  -2.780   0.820
   79    H    VAL  15           H        VAL  15   8.317  -2.666  -2.478
   80    HA   VAL  15           HA       VAL  15   6.511  -1.048  -3.803
   81    HB   VAL  15           HB       VAL  15   6.589  -4.068  -3.618
   82   HG11  VAL  15          1HG1      VAL  15   5.253  -4.104  -5.665
   83   HG12  VAL  15          2HG1      VAL  15   5.106  -2.346  -5.611
   84   HG13  VAL  15          3HG1      VAL  15   4.364  -3.331  -4.352
   85   HG21  VAL  15          3HG2      VAL  15   7.687  -3.900  -5.814
   86   HG22  VAL  15          1HG2      VAL  15   8.599  -3.093  -4.537
   87   HG23  VAL  15          2HG2      VAL  15   7.645  -2.143  -5.676
   88    H    CYS  16           H        CYS  16   4.516  -0.409  -3.404
   89    HA   CYS  16           HA       CYS  16   3.035  -1.718  -1.235
   90    HB2  CYS  16           2HB      CYS  16   3.632   0.808  -1.068
   91    HB3  CYS  16           1HB      CYS  16   2.502   0.987  -2.410
   92    H    ASN  17           H        ASN  17   1.184  -2.627  -1.821
   93    HA   ASN  17           HA       ASN  17   0.185  -2.072  -4.511
   94    HB2  ASN  17           2HB      ASN  17   1.284  -4.277  -4.546
   95    HB3  ASN  17           1HB      ASN  17   0.298  -4.804  -3.190
   96   HD21  ASN  17          1HD2      ASN  17  -1.820  -5.419  -3.563
   97   HD22  ASN  17          2HD2      ASN  17  -2.469  -5.600  -5.146
   98    H    ASP  18           H        ASP  18  -1.628  -1.129  -4.329
   99    HA   ASP  18           HA       ASP  18  -3.075  -1.034  -1.898
  100    HB2  ASP  18           2HB      ASP  18  -3.134   0.926  -3.228
  101    HB3  ASP  18           1HB      ASP  18  -3.689   0.035  -4.640
  102    H    LEU  19           H        LEU  19  -4.675  -2.140  -1.185
  103    HA   LEU  19           HA       LEU  19  -5.895  -4.113  -2.966
  104    HB2  LEU  19           2HB      LEU  19  -5.767  -4.183   0.041
  105    HB3  LEU  19           1HB      LEU  19  -6.367  -5.421  -1.021
  106    HG   LEU  19           HG       LEU  19  -3.479  -4.583  -0.857
  107   HD11  LEU  19          1HD1      LEU  19  -3.187  -6.799   0.172
  108   HD12  LEU  19          2HD1      LEU  19  -4.946  -6.968   0.221
  109   HD13  LEU  19          3HD1      LEU  19  -4.155  -5.697   1.148
  110   HD21  LEU  19          3HD2      LEU  19  -4.082  -5.384  -3.074
  111   HD22  LEU  19          1HD2      LEU  19  -4.824  -6.821  -2.370
  112   HD23  LEU  19          2HD2      LEU  19  -3.085  -6.569  -2.235
  113    H    LYS  20           H        LYS  20  -8.169  -4.586  -2.332
  114    HA   LYS  20           HA       LYS  20  -9.657  -2.208  -2.312
  115    HB2  LYS  20           2HB      LYS  20 -10.509  -5.079  -1.908
  116    HB3  LYS  20           1HB      LYS  20 -11.653  -3.744  -2.021
  117    HG2  LYS  20           2HG      LYS  20 -10.883  -3.201  -4.234
  118    HG3  LYS  20           1HG      LYS  20  -9.629  -4.433  -4.123
  119    HD2  LYS  20           2HD      LYS  20 -11.289  -6.172  -4.100
  120    HD3  LYS  20           1HD      LYS  20 -12.583  -4.976  -4.021
  121    HE2  LYS  20           2HE      LYS  20 -12.312  -5.856  -6.297
  122    HE3  LYS  20           1HE      LYS  20 -11.980  -4.131  -6.222
  123    HZ1  LYS  20           3HZ      LYS  20  -9.968  -6.326  -6.413
  124    HZ2  LYS  20           1HZ      LYS  20  -9.559  -4.698  -6.227
  125    HZ3  LYS  20           2HZ      LYS  20 -10.359  -5.198  -7.590
  126    H    ILE  21           H        ILE  21  -9.100  -4.576   0.219
  127    HA   ILE  21           HA       ILE  21  -9.692  -2.393   2.009
  128    HB   ILE  21           HB       ILE  21  -9.975  -4.107   3.880
  129   HG12  ILE  21          2HG1      ILE  21 -10.963  -6.334   3.078
  130   HG13  ILE  21          1HG1      ILE  21 -10.156  -6.035   1.549
  131   HG21  ILE  21          1HG2      ILE  21 -12.035  -4.018   1.713
  132   HG22  ILE  21          2HG2      ILE  21 -11.830  -2.886   3.051
  133   HG23  ILE  21          3HG2      ILE  21 -12.327  -4.547   3.370
  134   HD11  ILE  21          3HD1      ILE  21  -7.998  -6.047   2.731
  135   HD12  ILE  21          1HD1      ILE  21  -8.881  -7.557   2.947
  136   HD13  ILE  21          2HD1      ILE  21  -8.844  -6.365   4.245
  137    H    GLY  22           H        GLY  22  -8.187  -1.545   3.135
  138    HA2  GLY  22           2HA      GLY  22  -6.084  -1.103   3.876
  139    HA3  GLY  22           1HA      GLY  22  -5.814  -2.842   3.927
  140    H    TYR  23           H        TYR  23  -3.828  -2.891   3.075
  141    HA   TYR  23           HA       TYR  23  -3.520  -2.857   0.289
  142    HB2  TYR  23           2HB      TYR  23  -1.726  -1.142   0.180
  143    HB3  TYR  23           1HB      TYR  23  -3.265  -0.430   0.623
  144    HD1  TYR  23           1HD      TYR  23  -3.634   0.252   3.034
  145    HD2  TYR  23           2HD      TYR  23   0.167  -0.948   1.577
  146    HE1  TYR  23           1HE      TYR  23  -2.560   1.353   4.948
  147    HE2  TYR  23           2HE      TYR  23   1.248   0.139   3.489
  148    HH   TYR  23           HH       TYR  23   0.783   1.898   5.007
  149    H    GLU  24           H        GLU  24  -1.218  -3.602  -0.200
  150    HA   GLU  24           HA       GLU  24  -0.097  -4.939   2.153
  151    HB2  GLU  24           2HB      GLU  24   0.501  -6.861   0.808
  152    HB3  GLU  24           1HB      GLU  24  -1.219  -6.579   0.635
  153    HG2  GLU  24           2HG      GLU  24  -0.834  -5.567  -1.560
  154    HG3  GLU  24           1HG      GLU  24   0.899  -5.776  -1.343
  155    H    CYS  25           H        CYS  25   2.177  -5.227   2.084
  156    HA   CYS  25           HA       CYS  25   3.489  -3.496   0.148
  157    HB2  CYS  25           2HB      CYS  25   4.086  -3.614   3.112
  158    HB3  CYS  25           1HB      CYS  25   5.049  -2.732   1.927
  159    H    LEU  26           H        LEU  26   5.050  -4.347  -0.869
  160    HA   LEU  26           HA       LEU  26   6.110  -6.948   0.003
  161    HB2  LEU  26           2HB      LEU  26   5.636  -5.916  -2.793
  162    HB3  LEU  26           1HB      LEU  26   6.367  -7.455  -2.392
  163    HG   LEU  26           HG       LEU  26   3.505  -6.675  -1.784
  164   HD11  LEU  26          1HD1      LEU  26   3.914  -6.947  -4.161
  165   HD12  LEU  26          2HD1      LEU  26   2.945  -8.280  -3.528
  166   HD13  LEU  26          3HD1      LEU  26   4.662  -8.515  -3.863
  167   HD21  LEU  26          3HD2      LEU  26   4.978  -9.292  -1.460
  168   HD22  LEU  26          1HD2      LEU  26   3.250  -9.040  -1.200
  169   HD23  LEU  26          2HD2      LEU  26   4.424  -8.246  -0.153
  170    HN1  NH2  27           1H       LEU  26   7.823  -5.974   1.030
  171    HN2  NH2  27           2H       LEU  26   9.113  -5.198   0.197
  Start of MODEL   14
    1    H1   GLY   1           1HT      GLY   1 -11.427   5.358  -4.307
    2    H2   GLY   1           2HT      GLY   1 -12.377   5.094  -2.950
    3    H3   GLY   1           3HT      GLY   1 -12.714   4.256  -4.409
    4    HA2  GLY   1           1HA      GLY   1 -11.596   2.831  -2.831
    5    HA3  GLY   1           2HA      GLY   1 -10.586   3.160  -4.241
    6    H    THR   2           H        THR   2 -10.533   2.952  -0.983
    7    HA   THR   2           HA       THR   2  -8.933   5.237  -0.393
    8    HB   THR   2           HB       THR   2  -9.239   2.744   1.300
    9    HG1  THR   2           1HG      THR   2 -11.292   3.224   1.406
   10   HG21  THR   2          3HG2      THR   2  -7.619   4.442   2.053
   11   HG22  THR   2          1HG2      THR   2  -9.008   4.369   3.138
   12   HG23  THR   2          2HG2      THR   2  -8.874   5.678   1.965
   13    H    ASN   3           H        ASN   3  -7.244   5.102  -1.749
   14    HA   ASN   3           HA       ASN   3  -5.612   2.718  -1.943
   15    HB2  ASN   3           2HB      ASN   3  -6.241   4.077  -3.946
   16    HB3  ASN   3           1HB      ASN   3  -5.317   5.413  -3.282
   17   HD21  ASN   3          1HD2      ASN   3  -4.941   4.096  -5.778
   18   HD22  ASN   3          2HD2      ASN   3  -3.341   3.450  -5.752
   19    H    GLU   4           H        GLU   4  -4.267   2.450  -0.330
   20    HA   GLU   4           HA       GLU   4  -3.215   4.542   1.276
   21    HB2  GLU   4           2HB      GLU   4  -2.486   1.636   1.020
   22    HB3  GLU   4           1HB      GLU   4  -1.665   2.721   2.122
   23    HG2  GLU   4           2HG      GLU   4  -3.325   1.403   3.286
   24    HG3  GLU   4           1HG      GLU   4  -3.741   3.107   3.312
   25    H    CYS   5           H        CYS   5  -2.061   2.781  -1.480
   26    HA   CYS   5           HA       CYS   5   0.687   3.428  -1.304
   27    HB2  CYS   5           2HB      CYS   5  -0.968   2.642  -3.672
   28    HB3  CYS   5           1HB      CYS   5   0.786   2.578  -3.564
   29    H    LEU   6           H        LEU   6  -2.022   4.965  -2.691
   30    HA   LEU   6           HA       LEU   6  -0.673   6.838  -4.372
   31    HB2  LEU   6           2HB      LEU   6  -3.202   6.030  -4.094
   32    HB3  LEU   6           1HB      LEU   6  -3.288   7.445  -3.088
   33    HG   LEU   6           HG       LEU   6  -4.133   7.864  -5.364
   34   HD11  LEU   6          1HD1      LEU   6  -2.908   9.897  -5.871
   35   HD12  LEU   6          2HD1      LEU   6  -1.635   9.405  -4.750
   36   HD13  LEU   6          3HD1      LEU   6  -3.257   9.749  -4.148
   37   HD21  LEU   6          3HD2      LEU   6  -1.309   7.320  -6.256
   38   HD22  LEU   6          1HD2      LEU   6  -2.620   7.921  -7.264
   39   HD23  LEU   6          2HD2      LEU   6  -2.714   6.304  -6.566
   40    H    ASP   7           H        ASP   7  -1.311   6.581  -1.053
   41    HA   ASP   7           HA       ASP   7  -0.648   9.369  -0.457
   42    HB2  ASP   7           2HB      ASP   7  -2.656   8.415   0.610
   43    HB3  ASP   7           1HB      ASP   7  -1.657   7.139   1.292
   44    H    ASN   8           H        ASN   8   1.521   9.279  -0.891
   45    HA   ASN   8           HA       ASN   8   3.753   8.998  -0.586
   46    HB2  ASN   8           2HB      ASN   8   2.796   8.667   2.226
   47    HB3  ASN   8           1HB      ASN   8   4.506   8.676   1.788
   48   HD21  ASN   8          1HD2      ASN   8   2.938  10.577   3.425
   49   HD22  ASN   8          2HD2      ASN   8   3.140  12.122   2.681
   50    H    ASN   9           H        ASN   9   2.672   6.883  -1.582
   51    HA   ASN   9           HA       ASN   9   3.052   4.716  -2.210
   52    HB2  ASN   9           2HB      ASN   9   5.449   5.628  -2.238
   53    HB3  ASN   9           1HB      ASN   9   5.629   4.923  -0.635
   54   HD21  ASN   9          1HD2      ASN   9   6.163   2.819  -0.469
   55   HD22  ASN   9          2HD2      ASN   9   6.374   1.730  -1.773
   56    H    GLY  10           H        GLY  10   1.648   5.285   0.263
   57    HA2  GLY  10           2HA      GLY  10   0.463   3.991   1.737
   58    HA3  GLY  10           1HA      GLY  10   1.332   2.587   1.141
   59    H    GLY  11           H        GLY  11   3.550   4.867   2.003
   60    HA2  GLY  11           2HA      GLY  11   4.915   5.104   3.852
   61    HA3  GLY  11           1HA      GLY  11   3.744   4.174   4.788
   62    H    CYS  12           H        CYS  12   4.530   2.654   1.905
   63    HA   CYS  12           HA       CYS  12   5.944   0.598   3.352
   64    HB2  CYS  12           2HB      CYS  12   5.169   0.735   0.423
   65    HB3  CYS  12           1HB      CYS  12   5.702  -0.698   1.287
   66    H    SER  13           H        SER  13   8.089   0.194   3.130
   67    HA   SER  13           HA       SER  13   9.750   2.233   2.004
   68    HB2  SER  13           2HB      SER  13  10.308   1.073   4.128
   69    HB3  SER  13           1HB      SER  13  10.482  -0.433   3.232
   70    HG   SER  13           HG       SER  13  12.055   1.089   1.963
   71    H    HIS  14           H        HIS  14   8.389  -0.651   0.866
   72    HA   HIS  14           HA       HIS  14  10.072  -0.567  -1.513
   73    HB2  HIS  14           2HB      HIS  14   8.923  -3.031  -0.154
   74    HB3  HIS  14           1HB      HIS  14   9.535  -3.047  -1.795
   75    HD1  HIS  14           1HD      HIS  14  12.056  -3.200  -2.111
   76    HD2  HIS  14           2HD      HIS  14  10.903  -2.711   1.847
   77    HE1  HIS  14           1HE      HIS  14  14.116  -3.589  -0.771
   78    HE2  HIS  14           2HE      HIS  14  13.460  -3.027   1.583
   79    H    VAL  15           H        VAL  15   8.479  -2.345  -3.025
   80    HA   VAL  15           HA       VAL  15   6.616  -0.637  -4.163
   81    HB   VAL  15           HB       VAL  15   6.497  -3.666  -4.188
   82   HG11  VAL  15          1HG1      VAL  15   4.518  -2.648  -5.145
   83   HG12  VAL  15          2HG1      VAL  15   5.487  -3.412  -6.407
   84   HG13  VAL  15          3HG1      VAL  15   5.519  -1.659  -6.208
   85   HG21  VAL  15          3HG2      VAL  15   7.894  -3.557  -6.209
   86   HG22  VAL  15          1HG2      VAL  15   8.733  -2.982  -4.768
   87   HG23  VAL  15          2HG2      VAL  15   8.106  -1.825  -5.940
   88    H    CYS  16           H        CYS  16   4.500  -0.272  -3.824
   89    HA   CYS  16           HA       CYS  16   3.294  -1.463  -1.450
   90    HB2  CYS  16           2HB      CYS  16   3.553   1.029  -1.532
   91    HB3  CYS  16           1HB      CYS  16   2.543   1.034  -2.971
   92    H    ASN  17           H        ASN  17   1.241  -2.335  -1.606
   93    HA   ASN  17           HA       ASN  17   0.115  -2.697  -4.282
   94    HB2  ASN  17           2HB      ASN  17   1.324  -4.743  -3.629
   95    HB3  ASN  17           1HB      ASN  17   0.401  -4.827  -2.132
   96   HD21  ASN  17          1HD2      ASN  17  -0.460  -6.869  -2.646
   97   HD22  ASN  17          2HD2      ASN  17  -1.642  -7.061  -3.881
   98    H    ASP  18           H        ASP  18  -1.631  -1.519  -4.124
   99    HA   ASP  18           HA       ASP  18  -3.014  -1.220  -1.618
  100    HB2  ASP  18           2HB      ASP  18  -2.915   0.779  -2.891
  101    HB3  ASP  18           1HB      ASP  18  -3.511  -0.027  -4.336
  102    H    LEU  19           H        LEU  19  -4.449  -2.470  -0.922
  103    HA   LEU  19           HA       LEU  19  -5.898  -4.265  -2.735
  104    HB2  LEU  19           2HB      LEU  19  -5.544  -4.359   0.245
  105    HB3  LEU  19           1HB      LEU  19  -6.316  -5.573  -0.719
  106    HG   LEU  19           HG       LEU  19  -3.382  -4.886  -0.840
  107   HD11  LEU  19          1HD1      LEU  19  -3.994  -6.034   1.203
  108   HD12  LEU  19          2HD1      LEU  19  -3.082  -7.106   0.135
  109   HD13  LEU  19          3HD1      LEU  19  -4.832  -7.274   0.272
  110   HD21  LEU  19          3HD2      LEU  19  -4.957  -7.034  -2.257
  111   HD22  LEU  19          1HD2      LEU  19  -3.204  -6.848  -2.287
  112   HD23  LEU  19          2HD2      LEU  19  -4.229  -5.612  -3.008
  113    H    LYS  20           H        LYS  20  -8.103  -4.717  -2.030
  114    HA   LYS  20           HA       LYS  20  -9.569  -2.286  -1.520
  115    HB2  LYS  20           2HB      LYS  20 -10.480  -5.112  -2.132
  116    HB3  LYS  20           1HB      LYS  20 -11.617  -3.869  -1.650
  117    HG2  LYS  20           2HG      LYS  20 -11.626  -4.103  -4.058
  118    HG3  LYS  20           1HG      LYS  20 -10.966  -2.531  -3.623
  119    HD2  LYS  20           2HD      LYS  20  -8.683  -3.508  -3.896
  120    HD3  LYS  20           1HD      LYS  20  -9.439  -4.979  -4.491
  121    HE2  LYS  20           2HE      LYS  20 -10.405  -3.793  -6.359
  122    HE3  LYS  20           1HE      LYS  20  -9.813  -2.256  -5.731
  123    HZ1  LYS  20           3HZ      LYS  20  -8.120  -4.511  -6.686
  124    HZ2  LYS  20           1HZ      LYS  20  -7.563  -3.103  -5.969
  125    HZ3  LYS  20           2HZ      LYS  20  -8.330  -3.012  -7.445
  126    H    ILE  21           H        ILE  21  -8.717  -5.186   0.153
  127    HA   ILE  21           HA       ILE  21  -9.977  -4.104   2.544
  128    HB   ILE  21           HB       ILE  21 -10.604  -6.416   2.219
  129   HG12  ILE  21          2HG1      ILE  21  -9.707  -7.566   4.252
  130   HG13  ILE  21          1HG1      ILE  21  -8.517  -6.281   4.404
  131   HG21  ILE  21          1HG2      ILE  21  -7.705  -7.106   1.942
  132   HG22  ILE  21          2HG2      ILE  21  -8.981  -7.224   0.721
  133   HG23  ILE  21          3HG2      ILE  21  -9.003  -8.284   2.127
  134   HD11  ILE  21          3HD1      ILE  21 -10.287  -4.665   4.739
  135   HD12  ILE  21          1HD1      ILE  21 -10.398  -5.969   5.917
  136   HD13  ILE  21          2HD1      ILE  21 -11.505  -5.927   4.540
  137    H    GLY  22           H        GLY  22  -8.547  -2.448   2.849
  138    HA2  GLY  22           2HA      GLY  22  -6.734  -1.561   4.060
  139    HA3  GLY  22           1HA      GLY  22  -6.127  -3.198   4.240
  140    H    TYR  23           H        TYR  23  -4.156  -3.145   3.537
  141    HA   TYR  23           HA       TYR  23  -3.610  -2.681   0.758
  142    HB2  TYR  23           2HB      TYR  23  -1.884  -1.005   1.031
  143    HB3  TYR  23           1HB      TYR  23  -3.354  -0.383   1.763
  144    HD1  TYR  23           2HD      TYR  23  -3.542  -0.562   4.349
  145    HD2  TYR  23           1HD      TYR  23   0.127  -1.068   2.255
  146    HE1  TYR  23           2HE      TYR  23  -2.294  -0.129   6.426
  147    HE2  TYR  23           1HE      TYR  23   1.373  -0.640   4.329
  148    HH   TYR  23           HH       TYR  23   1.006   0.505   6.486
  149    H    GLU  24           H        GLU  24  -1.077  -3.006   0.507
  150    HA   GLU  24           HA       GLU  24   0.003  -4.816   2.486
  151    HB2  GLU  24           2HB      GLU  24  -1.193  -6.320   1.080
  152    HB3  GLU  24           1HB      GLU  24  -0.641  -5.514  -0.374
  153    HG2  GLU  24           2HG      GLU  24   1.602  -6.328   0.002
  154    HG3  GLU  24           1HG      GLU  24   1.111  -7.076   1.516
  155    H    CYS  25           H        CYS  25   2.172  -4.556   2.627
  156    HA   CYS  25           HA       CYS  25   3.485  -2.941   0.577
  157    HB2  CYS  25           2HB      CYS  25   4.447  -3.725   3.338
  158    HB3  CYS  25           1HB      CYS  25   5.302  -2.683   2.215
  159    H    LEU  26           H        LEU  26   4.877  -3.870  -0.779
  160    HA   LEU  26           HA       LEU  26   5.486  -6.704  -0.394
  161    HB2  LEU  26           2HB      LEU  26   5.518  -4.937  -2.829
  162    HB3  LEU  26           1HB      LEU  26   5.982  -6.625  -2.829
  163    HG   LEU  26           HG       LEU  26   3.227  -5.608  -2.139
  164   HD11  LEU  26          1HD1      LEU  26   3.771  -5.192  -4.476
  165   HD12  LEU  26          2HD1      LEU  26   2.605  -6.512  -4.336
  166   HD13  LEU  26          3HD1      LEU  26   4.302  -6.861  -4.663
  167   HD21  LEU  26          3HD2      LEU  26   3.788  -7.726  -1.079
  168   HD22  LEU  26          1HD2      LEU  26   4.292  -8.385  -2.635
  169   HD23  LEU  26          2HD2      LEU  26   2.602  -7.958  -2.360
  170    HN1  NH2  27           1H       LEU  26   7.133  -6.072   1.114
  171    HN2  NH2  27           2H       LEU  26   8.677  -5.556   0.542
  Start of MODEL   15
    1    H1   GLY   1           1HT      GLY   1  -9.609   3.142  -5.587
    2    H2   GLY   1           2HT      GLY   1 -10.273   4.659  -5.887
    3    H3   GLY   1           3HT      GLY   1 -11.072   3.264  -6.438
    4    HA2  GLY   1           1HA      GLY   1 -12.104   4.220  -4.466
    5    HA3  GLY   1           2HA      GLY   1 -11.463   2.607  -4.159
    6    H    THR   2           H        THR   2 -10.957   2.846  -2.009
    7    HA   THR   2           HA       THR   2  -9.407   5.121  -1.230
    8    HB   THR   2           HB       THR   2 -11.094   4.283   0.359
    9    HG1  THR   2           1HG      THR   2  -8.505   3.822   1.451
   10   HG21  THR   2          3HG2      THR   2  -9.416   1.781   0.593
   11   HG22  THR   2          1HG2      THR   2 -11.009   1.869  -0.166
   12   HG23  THR   2          2HG2      THR   2 -10.832   2.166   1.566
   13    H    ASN   3           H        ASN   3  -7.579   5.060  -2.294
   14    HA   ASN   3           HA       ASN   3  -5.945   2.669  -2.391
   15    HB2  ASN   3           2HB      ASN   3  -6.255   4.184  -4.378
   16    HB3  ASN   3           1HB      ASN   3  -5.395   5.435  -3.496
   17   HD21  ASN   3          1HD2      ASN   3  -4.613   4.428  -5.980
   18   HD22  ASN   3          2HD2      ASN   3  -3.102   3.633  -5.785
   19    H    GLU   4           H        GLU   4  -4.776   2.290  -0.665
   20    HA   GLU   4           HA       GLU   4  -4.000   4.437   1.118
   21    HB2  GLU   4           2HB      GLU   4  -3.751   1.460   1.254
   22    HB3  GLU   4           1HB      GLU   4  -2.840   2.470   2.363
   23    HG2  GLU   4           2HG      GLU   4  -4.907   1.631   3.375
   24    HG3  GLU   4           1HG      GLU   4  -4.923   3.385   3.249
   25    H    CYS   5           H        CYS   5  -2.582   2.662  -1.426
   26    HA   CYS   5           HA       CYS   5   0.148   3.137  -0.627
   27    HB2  CYS   5           2HB      CYS   5  -1.039   2.146  -3.190
   28    HB3  CYS   5           1HB      CYS   5   0.674   2.181  -2.807
   29    H    LEU   6           H        LEU   6  -2.220   4.652  -2.406
   30    HA   LEU   6           HA       LEU   6  -0.789   6.432  -4.055
   31    HB2  LEU   6           2HB      LEU   6  -3.316   5.986  -3.846
   32    HB3  LEU   6           1HB      LEU   6  -3.298   7.131  -2.540
   33    HG   LEU   6           HG       LEU   6  -2.564   7.807  -5.403
   34   HD11  LEU   6          1HD1      LEU   6  -4.743   8.904  -5.476
   35   HD12  LEU   6          2HD1      LEU   6  -5.105   8.285  -3.867
   36   HD13  LEU   6          3HD1      LEU   6  -4.894   7.166  -5.216
   37   HD21  LEU   6          3HD2      LEU   6  -2.794  10.114  -4.695
   38   HD22  LEU   6          1HD2      LEU   6  -1.563   9.295  -3.732
   39   HD23  LEU   6          2HD2      LEU   6  -3.164   9.592  -3.045
   40    H    ASP   7           H        ASP   7  -1.685   6.562  -0.678
   41    HA   ASP   7           HA       ASP   7  -0.469   9.196  -0.362
   42    HB2  ASP   7           2HB      ASP   7  -2.688   8.875   0.594
   43    HB3  ASP   7           1HB      ASP   7  -2.091   7.527   1.554
   44    H    ASN   8           H        ASN   8   1.627   9.111  -0.147
   45    HA   ASN   8           HA       ASN   8   3.706   8.722   0.631
   46    HB2  ASN   8           2HB      ASN   8   2.193   7.769   3.047
   47    HB3  ASN   8           1HB      ASN   8   3.953   7.839   2.949
   48   HD21  ASN   8          1HD2      ASN   8   4.942   9.846   2.846
   49   HD22  ASN   8          2HD2      ASN   8   4.131  11.294   3.313
   50    H    ASN   9           H        ASN   9   2.332   6.727  -0.814
   51    HA   ASN   9           HA       ASN   9   2.475   4.591  -1.615
   52    HB2  ASN   9           2HB      ASN   9   4.894   5.402  -1.880
   53    HB3  ASN   9           1HB      ASN   9   5.260   4.510  -0.407
   54   HD21  ASN   9          1HD2      ASN   9   6.608   3.048  -1.315
   55   HD22  ASN   9          2HD2      ASN   9   6.146   1.835  -2.435
   56    H    GLY  10           H        GLY  10   1.328   4.967   0.966
   57    HA2  GLY  10           2HA      GLY  10   0.374   3.642   2.563
   58    HA3  GLY  10           1HA      GLY  10   1.178   2.262   1.835
   59    H    GLY  11           H        GLY  11   3.582   4.412   2.448
   60    HA2  GLY  11           2HA      GLY  11   5.018   4.665   4.271
   61    HA3  GLY  11           1HA      GLY  11   4.007   3.557   5.200
   62    H    CYS  12           H        CYS  12   4.745   2.601   2.025
   63    HA   CYS  12           HA       CYS  12   6.597   0.579   3.024
   64    HB2  CYS  12           2HB      CYS  12   5.162   0.735   0.358
   65    HB3  CYS  12           1HB      CYS  12   5.996  -0.661   1.023
   66    H    SER  13           H        SER  13   8.712   0.610   2.320
   67    HA   SER  13           HA       SER  13   9.522   2.836   0.668
   68    HB2  SER  13           2HB      SER  13  11.154   0.736   2.109
   69    HB3  SER  13           1HB      SER  13  11.801   2.179   1.320
   70    HG   SER  13           HG       SER  13  10.014   3.164   2.805
   71    H    HIS  14           H        HIS  14   8.735  -0.405   0.311
   72    HA   HIS  14           HA       HIS  14  10.015  -0.495  -2.312
   73    HB2  HIS  14           2HB      HIS  14   8.980  -2.777  -0.583
   74    HB3  HIS  14           1HB      HIS  14   9.517  -2.969  -2.246
   75    HD1  HIS  14           1HD      HIS  14  10.768  -3.148   1.147
   76    HD2  HIS  14           2HD      HIS  14  12.334  -2.157  -2.566
   77    HE1  HIS  14           1HE      HIS  14  13.234  -3.277   1.406
   78    HE2  HIS  14           2HE      HIS  14  14.093  -2.257  -0.721
   79    H    VAL  15           H        VAL  15   8.232  -2.354  -3.495
   80    HA   VAL  15           HA       VAL  15   6.219  -0.570  -4.294
   81    HB   VAL  15           HB       VAL  15   6.321  -3.582  -4.659
   82   HG11  VAL  15          1HG1      VAL  15   4.800  -1.514  -6.247
   83   HG12  VAL  15          2HG1      VAL  15   4.091  -2.618  -5.076
   84   HG13  VAL  15          3HG1      VAL  15   4.831  -3.255  -6.544
   85   HG21  VAL  15          3HG2      VAL  15   7.305  -1.364  -6.444
   86   HG22  VAL  15          1HG2      VAL  15   7.306  -3.081  -6.842
   87   HG23  VAL  15          2HG2      VAL  15   8.315  -2.476  -5.525
   88    H    CYS  16           H        CYS  16   4.127  -0.333  -3.699
   89    HA   CYS  16           HA       CYS  16   3.215  -1.833  -1.354
   90    HB2  CYS  16           2HB      CYS  16   3.402   0.681  -1.165
   91    HB3  CYS  16           1HB      CYS  16   2.261   0.783  -2.501
   92    H    ASN  17           H        ASN  17   1.201  -2.811  -1.517
   93    HA   ASN  17           HA       ASN  17  -0.045  -2.701  -4.178
   94    HB2  ASN  17           2HB      ASN  17   0.888  -4.935  -3.815
   95    HB3  ASN  17           1HB      ASN  17   0.012  -5.080  -2.301
   96   HD21  ASN  17          1HD2      ASN  17  -1.208  -6.858  -2.882
   97   HD22  ASN  17          2HD2      ASN  17  -2.397  -6.805  -4.130
   98    H    ASP  18           H        ASP  18  -1.833  -1.637  -4.105
   99    HA   ASP  18           HA       ASP  18  -3.147  -1.173  -1.608
  100    HB2  ASP  18           2HB      ASP  18  -3.044   0.718  -3.063
  101    HB3  ASP  18           1HB      ASP  18  -3.737  -0.189  -4.398
  102    H    LEU  19           H        LEU  19  -3.906  -3.005  -0.934
  103    HA   LEU  19           HA       LEU  19  -5.720  -4.683  -2.342
  104    HB2  LEU  19           2HB      LEU  19  -5.623  -4.237   0.645
  105    HB3  LEU  19           1HB      LEU  19  -6.229  -5.619  -0.194
  106    HG   LEU  19           HG       LEU  19  -3.308  -4.879  -0.133
  107   HD11  LEU  19          1HD1      LEU  19  -4.112  -5.549   2.061
  108   HD12  LEU  19          2HD1      LEU  19  -3.079  -6.794   1.358
  109   HD13  LEU  19          3HD1      LEU  19  -4.831  -7.000   1.362
  110   HD21  LEU  19          3HD2      LEU  19  -3.974  -6.108  -2.140
  111   HD22  LEU  19          1HD2      LEU  19  -4.726  -7.346  -1.133
  112   HD23  LEU  19          2HD2      LEU  19  -2.979  -7.100  -1.076
  113    H    LYS  20           H        LYS  20  -8.119  -4.765  -1.597
  114    HA   LYS  20           HA       LYS  20  -9.213  -2.177  -1.951
  115    HB2  LYS  20           2HB      LYS  20 -10.433  -4.344  -2.455
  116    HB3  LYS  20           1HB      LYS  20 -10.651  -4.544  -0.723
  117    HG2  LYS  20           2HG      LYS  20 -11.923  -2.452  -0.639
  118    HG3  LYS  20           1HG      LYS  20 -11.722  -2.270  -2.381
  119    HD2  LYS  20           2HD      LYS  20 -12.869  -4.455  -2.678
  120    HD3  LYS  20           1HD      LYS  20 -13.167  -4.483  -0.942
  121    HE2  LYS  20           2HE      LYS  20 -14.149  -2.382  -2.871
  122    HE3  LYS  20           1HE      LYS  20 -15.117  -3.678  -2.183
  123    HZ1  LYS  20           3HZ      LYS  20 -13.843  -1.475  -0.643
  124    HZ2  LYS  20           1HZ      LYS  20 -14.785  -2.713   0.011
  125    HZ3  LYS  20           2HZ      LYS  20 -15.454  -1.582  -1.061
  126    H    ILE  21           H        ILE  21  -9.001  -4.301   0.819
  127    HA   ILE  21           HA       ILE  21  -9.508  -2.036   2.568
  128    HB   ILE  21           HB       ILE  21 -10.923  -3.928   3.098
  129   HG12  ILE  21          2HG1      ILE  21 -10.285  -4.411   5.463
  130   HG13  ILE  21          1HG1      ILE  21  -8.719  -3.678   5.151
  131   HG21  ILE  21          1HG2      ILE  21  -9.715  -5.743   2.104
  132   HG22  ILE  21          2HG2      ILE  21 -10.076  -6.128   3.788
  133   HG23  ILE  21          3HG2      ILE  21  -8.451  -5.620   3.329
  134   HD11  ILE  21          3HD1      ILE  21 -11.378  -2.270   4.976
  135   HD12  ILE  21          1HD1      ILE  21  -9.797  -1.539   4.700
  136   HD13  ILE  21          2HD1      ILE  21 -10.221  -2.142   6.301
  137    H    GLY  22           H        GLY  22  -7.834  -1.000   3.253
  138    HA2  GLY  22           2HA      GLY  22  -5.727  -0.541   4.010
  139    HA3  GLY  22           1HA      GLY  22  -5.526  -2.267   4.292
  140    H    TYR  23           H        TYR  23  -3.604  -2.627   3.452
  141    HA   TYR  23           HA       TYR  23  -3.213  -2.747   0.650
  142    HB2  TYR  23           2HB      TYR  23  -1.310  -1.174   0.546
  143    HB3  TYR  23           1HB      TYR  23  -2.766  -0.313   1.024
  144    HD1  TYR  23           1HD      TYR  23  -3.059   0.333   3.439
  145    HD2  TYR  23           2HD      TYR  23   0.603  -1.255   1.984
  146    HE1  TYR  23           1HE      TYR  23  -1.919   1.147   5.441
  147    HE2  TYR  23           2HE      TYR  23   1.753  -0.443   3.991
  148    HH   TYR  23           HH       TYR  23   1.416   1.315   5.658
  149    H    GLU  24           H        GLU  24  -0.635  -3.230   0.470
  150    HA   GLU  24           HA       GLU  24   0.421  -4.442   2.874
  151    HB2  GLU  24           2HB      GLU  24   0.931  -6.566   1.780
  152    HB3  GLU  24           1HB      GLU  24  -0.802  -6.286   1.754
  153    HG2  GLU  24           2HG      GLU  24  -0.678  -5.577  -0.546
  154    HG3  GLU  24           1HG      GLU  24   1.074  -5.779  -0.535
  155    H    CYS  25           H        CYS  25   2.638  -4.358   2.920
  156    HA   CYS  25           HA       CYS  25   3.942  -2.932   0.756
  157    HB2  CYS  25           2HB      CYS  25   5.036  -3.929   3.401
  158    HB3  CYS  25           1HB      CYS  25   5.916  -2.936   2.253
  159    H    LEU  26           H        LEU  26   5.013  -3.984  -0.786
  160    HA   LEU  26           HA       LEU  26   5.207  -6.868  -0.582
  161    HB2  LEU  26           2HB      LEU  26   5.783  -5.008  -2.887
  162    HB3  LEU  26           1HB      LEU  26   5.787  -6.756  -2.970
  163    HG   LEU  26           HG       LEU  26   3.355  -5.047  -2.397
  164   HD11  LEU  26          1HD1      LEU  26   4.126  -4.792  -4.677
  165   HD12  LEU  26          2HD1      LEU  26   2.645  -5.756  -4.642
  166   HD13  LEU  26          3HD1      LEU  26   4.210  -6.538  -4.862
  167   HD21  LEU  26          3HD2      LEU  26   3.223  -7.244  -1.335
  168   HD22  LEU  26          1HD2      LEU  26   3.633  -8.012  -2.870
  169   HD23  LEU  26          2HD2      LEU  26   2.113  -7.134  -2.701
  170    HN1  NH2  27           1H       LEU  26   6.846  -7.119   0.801
  171    HN2  NH2  27           2H       LEU  26   8.491  -6.706   0.484
  Start of MODEL   16
    1    H1   GLY   1           1HT      GLY   1 -12.754   4.906  -3.497
    2    H2   GLY   1           2HT      GLY   1 -13.392   3.347  -3.604
    3    H3   GLY   1           3HT      GLY   1 -11.722   3.608  -3.758
    4    HA2  GLY   1           1HA      GLY   1 -13.297   4.150  -1.338
    5    HA3  GLY   1           2HA      GLY   1 -12.282   2.737  -1.588
    6    H    THR   2           H        THR   2 -10.309   2.923  -0.735
    7    HA   THR   2           HA       THR   2  -9.046   5.522  -0.697
    8    HB   THR   2           HB       THR   2  -9.889   5.430   1.509
    9    HG1  THR   2           1HG      THR   2  -7.319   4.367   1.937
   10   HG21  THR   2          3HG2      THR   2  -9.595   3.532   3.048
   11   HG22  THR   2          1HG2      THR   2  -8.817   2.615   1.757
   12   HG23  THR   2          2HG2      THR   2 -10.516   3.068   1.616
   13    H    ASN   3           H        ASN   3  -7.250   5.401  -1.752
   14    HA   ASN   3           HA       ASN   3  -5.829   2.857  -1.965
   15    HB2  ASN   3           2HB      ASN   3  -6.475   4.033  -4.052
   16    HB3  ASN   3           1HB      ASN   3  -5.515   5.417  -3.557
   17   HD21  ASN   3          1HD2      ASN   3  -5.400   3.629  -5.876
   18   HD22  ASN   3          2HD2      ASN   3  -3.786   3.045  -5.959
   19    H    GLU   4           H        GLU   4  -4.365   2.585  -0.474
   20    HA   GLU   4           HA       GLU   4  -3.188   4.788   0.947
   21    HB2  GLU   4           2HB      GLU   4  -2.735   1.816   1.155
   22    HB3  GLU   4           1HB      GLU   4  -1.939   2.996   2.172
   23    HG2  GLU   4           2HG      GLU   4  -3.769   1.955   3.345
   24    HG3  GLU   4           1HG      GLU   4  -4.105   3.660   3.088
   25    H    CYS   5           H        CYS   5  -2.192   2.630  -1.562
   26    HA   CYS   5           HA       CYS   5   0.597   3.001  -1.097
   27    HB2  CYS   5           2HB      CYS   5  -0.894   1.794  -3.363
   28    HB3  CYS   5           1HB      CYS   5   0.857   1.755  -3.179
   29    H    LEU   6           H        LEU   6  -1.694   4.587  -2.970
   30    HA   LEU   6           HA       LEU   6   0.346   6.069  -4.401
   31    HB2  LEU   6           2HB      LEU   6  -2.602   6.016  -4.466
   32    HB3  LEU   6           1HB      LEU   6  -1.812   7.508  -4.932
   33    HG   LEU   6           HG       LEU   6  -2.372   6.078  -6.893
   34   HD11  LEU   6          1HD1      LEU   6  -0.461   7.575  -7.050
   35   HD12  LEU   6          2HD1      LEU   6  -0.208   6.108  -7.990
   36   HD13  LEU   6          3HD1      LEU   6   0.602   6.305  -6.439
   37   HD21  LEU   6          3HD2      LEU   6  -2.173   3.881  -5.824
   38   HD22  LEU   6          1HD2      LEU   6  -0.429   4.101  -5.692
   39   HD23  LEU   6          2HD2      LEU   6  -1.183   3.972  -7.282
   40    H    ASP   7           H        ASP   7  -1.242   6.275  -1.517
   41    HA   ASP   7           HA       ASP   7  -0.560   9.101  -1.087
   42    HB2  ASP   7           2HB      ASP   7  -2.796   8.346  -0.344
   43    HB3  ASP   7           1HB      ASP   7  -2.017   7.160   0.695
   44    H    ASN   8           H        ASN   8   1.626   9.011  -0.962
   45    HA   ASN   8           HA       ASN   8   3.682   8.947   0.029
   46    HB2  ASN   8           2HB      ASN   8   2.273   9.710   1.916
   47    HB3  ASN   8           1HB      ASN   8   2.197   8.068   2.518
   48   HD21  ASN   8          1HD2      ASN   8   4.156  10.899   2.226
   49   HD22  ASN   8          2HD2      ASN   8   5.473  10.401   3.197
   50    H    ASN   9           H        ASN   9   2.491   6.743  -1.180
   51    HA   ASN   9           HA       ASN   9   2.849   4.552  -1.817
   52    HB2  ASN   9           2HB      ASN   9   5.219   5.474  -1.995
   53    HB3  ASN   9           1HB      ASN   9   5.525   4.802  -0.401
   54   HD21  ASN   9          1HD2      ASN   9   7.038   3.336  -1.004
   55   HD22  ASN   9          2HD2      ASN   9   6.734   1.950  -1.974
   56    H    GLY  10           H        GLY  10   1.383   4.888   0.540
   57    HA2  GLY  10           2HA      GLY  10   0.429   3.538   2.137
   58    HA3  GLY  10           1HA      GLY  10   1.484   2.249   1.593
   59    H    GLY  11           H        GLY  11   3.285   4.958   2.353
   60    HA2  GLY  11           2HA      GLY  11   4.549   5.569   4.178
   61    HA3  GLY  11           1HA      GLY  11   3.630   4.428   5.163
   62    H    CYS  12           H        CYS  12   4.766   3.123   2.253
   63    HA   CYS  12           HA       CYS  12   6.721   1.580   3.742
   64    HB2  CYS  12           2HB      CYS  12   5.093   1.035   1.298
   65    HB3  CYS  12           1HB      CYS  12   6.334  -0.063   1.863
   66    H    SER  13           H        SER  13   8.742   1.173   2.876
   67    HA   SER  13           HA       SER  13   9.725   3.052   0.935
   68    HB2  SER  13           2HB      SER  13  11.886   1.937   1.610
   69    HB3  SER  13           1HB      SER  13  11.018   2.771   2.908
   70    HG   SER  13           HG       SER  13  11.106   0.940   3.888
   71    H    HIS  14           H        HIS  14   8.657  -0.183   1.103
   72    HA   HIS  14           HA       HIS  14  10.087  -1.046  -1.294
   73    HB2  HIS  14           2HB      HIS  14   8.144  -2.524   0.500
   74    HB3  HIS  14           1HB      HIS  14   8.884  -3.227  -0.904
   75    HD1  HIS  14           1HD      HIS  14   9.399  -2.822   2.673
   76    HD2  HIS  14           2HD      HIS  14  11.813  -3.427  -0.648
   77    HE1  HIS  14           1HE      HIS  14  11.543  -3.716   3.564
   78    HE2  HIS  14           2HE      HIS  14  13.048  -3.910   1.559
   79    H    VAL  15           H        VAL  15   8.352  -2.584  -2.613
   80    HA   VAL  15           HA       VAL  15   6.605  -0.751  -3.926
   81    HB   VAL  15           HB       VAL  15   6.753  -3.785  -4.123
   82   HG11  VAL  15          1HG1      VAL  15   5.391  -1.813  -5.957
   83   HG12  VAL  15          2HG1      VAL  15   4.589  -2.968  -4.893
   84   HG13  VAL  15          3HG1      VAL  15   5.556  -3.545  -6.250
   85   HG21  VAL  15          3HG2      VAL  15   7.906  -1.663  -5.924
   86   HG22  VAL  15          1HG2      VAL  15   8.000  -3.401  -6.189
   87   HG23  VAL  15          2HG2      VAL  15   8.825  -2.672  -4.809
   88    H    CYS  16           H        CYS  16   4.563  -0.258  -3.387
   89    HA   CYS  16           HA       CYS  16   3.331  -1.779  -1.227
   90    HB2  CYS  16           2HB      CYS  16   3.655   0.704  -0.980
   91    HB3  CYS  16           1HB      CYS  16   2.592   0.933  -2.352
   92    H    ASN  17           H        ASN  17   1.285  -2.622  -1.469
   93    HA   ASN  17           HA       ASN  17   0.194  -2.761  -4.209
   94    HB2  ASN  17           2HB      ASN  17   1.238  -4.887  -3.503
   95    HB3  ASN  17           1HB      ASN  17   0.171  -4.937  -2.098
   96   HD21  ASN  17          1HD2      ASN  17  -1.076  -6.638  -2.545
   97   HD22  ASN  17          2HD2      ASN  17  -2.038  -6.831  -3.969
   98    H    ASP  18           H        ASP  18  -1.520  -1.487  -4.062
   99    HA   ASP  18           HA       ASP  18  -3.005  -1.227  -1.613
  100    HB2  ASP  18           2HB      ASP  18  -2.857   0.790  -2.842
  101    HB3  ASP  18           1HB      ASP  18  -3.392   0.012  -4.327
  102    H    LEU  19           H        LEU  19  -4.366  -2.622  -0.958
  103    HA   LEU  19           HA       LEU  19  -5.884  -4.217  -2.859
  104    HB2  LEU  19           2HB      LEU  19  -5.891  -4.317   0.161
  105    HB3  LEU  19           1HB      LEU  19  -6.691  -5.426  -0.905
  106    HG   LEU  19           HG       LEU  19  -3.691  -5.146  -0.734
  107   HD11  LEU  19          1HD1      LEU  19  -3.776  -7.309   0.393
  108   HD12  LEU  19          2HD1      LEU  19  -5.539  -7.259   0.365
  109   HD13  LEU  19          3HD1      LEU  19  -4.639  -6.076   1.314
  110   HD21  LEU  19          3HD2      LEU  19  -4.467  -5.885  -2.924
  111   HD22  LEU  19          1HD2      LEU  19  -5.448  -7.137  -2.160
  112   HD23  LEU  19          2HD2      LEU  19  -3.690  -7.201  -2.048
  113    H    LYS  20           H        LYS  20  -8.224  -4.452  -2.341
  114    HA   LYS  20           HA       LYS  20  -9.449  -1.872  -2.329
  115    HB2  LYS  20           2HB      LYS  20 -10.273  -3.821  -3.642
  116    HB3  LYS  20           1HB      LYS  20 -10.753  -4.593  -2.137
  117    HG2  LYS  20           2HG      LYS  20 -12.304  -2.714  -1.724
  118    HG3  LYS  20           1HG      LYS  20 -11.858  -2.041  -3.292
  119    HD2  LYS  20           2HD      LYS  20 -13.128  -4.741  -2.816
  120    HD3  LYS  20           1HD      LYS  20 -13.954  -3.312  -3.424
  121    HE2  LYS  20           2HE      LYS  20 -11.697  -4.794  -4.800
  122    HE3  LYS  20           1HE      LYS  20 -13.398  -4.875  -5.224
  123    HZ1  LYS  20           3HZ      LYS  20 -13.363  -2.571  -5.848
  124    HZ2  LYS  20           1HZ      LYS  20 -12.155  -3.394  -6.667
  125    HZ3  LYS  20           2HZ      LYS  20 -11.755  -2.387  -5.378
  126    H    ILE  21           H        ILE  21  -9.216  -4.563  -0.115
  127    HA   ILE  21           HA       ILE  21 -10.090  -2.749   1.983
  128    HB   ILE  21           HB       ILE  21 -11.777  -4.450   1.845
  129   HG12  ILE  21          2HG1      ILE  21 -11.638  -5.612   4.053
  130   HG13  ILE  21          1HG1      ILE  21  -9.967  -5.078   4.183
  131   HG21  ILE  21          1HG2      ILE  21  -9.628  -6.520   1.920
  132   HG22  ILE  21          2HG2      ILE  21 -10.706  -6.126   0.581
  133   HG23  ILE  21          3HG2      ILE  21 -11.354  -6.855   2.050
  134   HD11  ILE  21          3HD1      ILE  21 -12.384  -3.297   4.014
  135   HD12  ILE  21          1HD1      ILE  21 -10.712  -2.754   4.156
  136   HD13  ILE  21          2HD1      ILE  21 -11.459  -3.664   5.470
  137    H    GLY  22           H        GLY  22  -8.121  -1.961   2.332
  138    HA2  GLY  22           2HA      GLY  22  -6.354  -2.042   3.959
  139    HA3  GLY  22           1HA      GLY  22  -6.254  -3.778   3.661
  140    H    TYR  23           H        TYR  23  -4.051  -3.681   3.202
  141    HA   TYR  23           HA       TYR  23  -3.324  -3.629   0.534
  142    HB2  TYR  23           2HB      TYR  23  -1.955  -1.671   0.289
  143    HB3  TYR  23           1HB      TYR  23  -3.508  -1.095   0.864
  144    HD1  TYR  23           2HD      TYR  23  -3.665  -0.565   3.428
  145    HD2  TYR  23           1HD      TYR  23   0.013  -1.090   1.360
  146    HE1  TYR  23           2HE      TYR  23  -2.478   0.645   5.219
  147    HE2  TYR  23           1HE      TYR  23   1.199   0.110   3.134
  148    HH   TYR  23           HH       TYR  23   0.821   1.657   4.859
  149    H    GLU  24           H        GLU  24  -0.917  -4.023   0.378
  150    HA   GLU  24           HA       GLU  24   0.438  -4.169   2.907
  151    HB2  GLU  24           2HB      GLU  24   1.353  -6.390   2.662
  152    HB3  GLU  24           1HB      GLU  24  -0.391  -6.506   2.640
  153    HG2  GLU  24           2HG      GLU  24   1.041  -6.385   0.042
  154    HG3  GLU  24           1HG      GLU  24   1.152  -7.866   0.980
  155    H    CYS  25           H        CYS  25   2.802  -4.711   2.503
  156    HA   CYS  25           HA       CYS  25   3.560  -3.424   0.005
  157    HB2  CYS  25           2HB      CYS  25   4.848  -3.149   2.729
  158    HB3  CYS  25           1HB      CYS  25   5.386  -2.357   1.243
  159    H    LEU  26           H        LEU  26   4.961  -4.433  -1.169
  160    HA   LEU  26           HA       LEU  26   5.839  -7.077  -0.278
  161    HB2  LEU  26           2HB      LEU  26   5.622  -5.951  -3.078
  162    HB3  LEU  26           1HB      LEU  26   6.003  -7.611  -2.661
  163    HG   LEU  26           HG       LEU  26   3.368  -6.202  -2.235
  164   HD11  LEU  26          1HD1      LEU  26   2.526  -7.771  -3.902
  165   HD12  LEU  26          2HD1      LEU  26   4.156  -8.404  -4.127
  166   HD13  LEU  26          3HD1      LEU  26   3.792  -6.733  -4.556
  167   HD21  LEU  26          3HD2      LEU  26   4.166  -9.048  -1.607
  168   HD22  LEU  26          1HD2      LEU  26   2.522  -8.408  -1.549
  169   HD23  LEU  26          2HD2      LEU  26   3.743  -7.789  -0.444
  170    HN1  NH2  27           1H       LEU  26   7.286  -5.461  -2.998
  171    HN2  NH2  27           2H       LEU  26   8.808  -5.168  -2.243
  Start of MODEL   17
    1    H1   GLY   1           1HT      GLY   1 -13.811   5.508  -1.795
    2    H2   GLY   1           2HT      GLY   1 -13.776   3.874  -1.448
    3    H3   GLY   1           3HT      GLY   1 -14.461   4.402  -2.892
    4    HA2  GLY   1           1HA      GLY   1 -12.237   3.488  -3.249
    5    HA3  GLY   1           2HA      GLY   1 -12.292   5.205  -3.629
    6    H    THR   2           H        THR   2 -10.298   3.089  -2.376
    7    HA   THR   2           HA       THR   2  -9.088   5.046  -0.692
    8    HB   THR   2           HB       THR   2 -10.477   4.040   0.988
    9    HG1  THR   2           1HG      THR   2  -8.221   2.595   1.661
   10   HG21  THR   2          3HG2      THR   2 -10.447   1.625   1.534
   11   HG22  THR   2          1HG2      THR   2  -9.397   1.345   0.145
   12   HG23  THR   2          2HG2      THR   2 -11.047   1.916  -0.101
   13    H    ASN   3           H        ASN   3  -7.393   5.055  -2.153
   14    HA   ASN   3           HA       ASN   3  -5.871   2.562  -2.433
   15    HB2  ASN   3           2HB      ASN   3  -6.205   4.135  -4.431
   16    HB3  ASN   3           1HB      ASN   3  -5.209   5.288  -3.565
   17   HD21  ASN   3          1HD2      ASN   3  -4.371   4.551  -5.983
   18   HD22  ASN   3          2HD2      ASN   3  -3.035   3.455  -5.909
   19    H    GLU   4           H        GLU   4  -4.945   2.281  -0.465
   20    HA   GLU   4           HA       GLU   4  -4.035   4.378   1.155
   21    HB2  GLU   4           2HB      GLU   4  -3.447   1.427   1.280
   22    HB3  GLU   4           1HB      GLU   4  -3.022   2.575   2.530
   23    HG2  GLU   4           2HG      GLU   4  -4.955   1.514   3.309
   24    HG3  GLU   4           1HG      GLU   4  -5.509   3.068   2.720
   25    H    CYS   5           H        CYS   5  -2.534   2.532  -1.349
   26    HA   CYS   5           HA       CYS   5   0.186   3.123  -0.570
   27    HB2  CYS   5           2HB      CYS   5  -0.997   1.920  -3.041
   28    HB3  CYS   5           1HB      CYS   5   0.721   2.120  -2.757
   29    H    LEU   6           H        LEU   6  -2.223   4.549  -2.334
   30    HA   LEU   6           HA       LEU   6  -0.759   6.123  -4.223
   31    HB2  LEU   6           2HB      LEU   6  -3.248   5.519  -4.003
   32    HB3  LEU   6           1HB      LEU   6  -3.353   6.933  -3.003
   33    HG   LEU   6           HG       LEU   6  -2.629   8.340  -4.875
   34   HD11  LEU   6          1HD1      LEU   6  -2.546   7.428  -7.142
   35   HD12  LEU   6          2HD1      LEU   6  -2.692   5.800  -6.480
   36   HD13  LEU   6          3HD1      LEU   6  -1.270   6.778  -6.119
   37   HD21  LEU   6          3HD2      LEU   6  -4.663   8.146  -6.216
   38   HD22  LEU   6          1HD2      LEU   6  -4.998   8.010  -4.488
   39   HD23  LEU   6          2HD2      LEU   6  -4.972   6.566  -5.500
   40    H    ASP   7           H        ASP   7  -1.449   6.366  -0.935
   41    HA   ASP   7           HA       ASP   7  -0.366   9.104  -0.797
   42    HB2  ASP   7           2HB      ASP   7  -2.580   8.911   0.227
   43    HB3  ASP   7           1HB      ASP   7  -2.005   7.603   1.255
   44    H    ASN   8           H        ASN   8   1.741   9.045  -0.502
   45    HA   ASN   8           HA       ASN   8   3.768   8.746   0.397
   46    HB2  ASN   8           2HB      ASN   8   2.184   7.870   2.801
   47    HB3  ASN   8           1HB      ASN   8   3.941   7.999   2.757
   48   HD21  ASN   8          1HD2      ASN   8   0.922   9.753   2.847
   49   HD22  ASN   8          2HD2      ASN   8   1.644  11.300   3.080
   50    H    ASN   9           H        ASN   9   2.550   6.664  -1.036
   51    HA   ASN   9           HA       ASN   9   2.789   4.484  -1.726
   52    HB2  ASN   9           2HB      ASN   9   5.177   5.361  -1.908
   53    HB3  ASN   9           1HB      ASN   9   5.495   4.600  -0.354
   54   HD21  ASN   9          1HD2      ASN   9   6.891   3.125  -1.004
   55   HD22  ASN   9          2HD2      ASN   9   6.586   1.786  -2.047
   56    H    GLY  10           H        GLY  10   1.492   4.911   0.767
   57    HA2  GLY  10           2HA      GLY  10   0.478   3.571   2.336
   58    HA3  GLY  10           1HA      GLY  10   1.405   2.217   1.710
   59    H    GLY  11           H        GLY  11   3.458   4.743   2.468
   60    HA2  GLY  11           2HA      GLY  11   4.659   5.287   4.387
   61    HA3  GLY  11           1HA      GLY  11   3.795   4.032   5.265
   62    H    CYS  12           H        CYS  12   4.768   2.819   2.345
   63    HA   CYS  12           HA       CYS  12   6.975   1.421   3.628
   64    HB2  CYS  12           2HB      CYS  12   5.150   0.723   1.349
   65    HB3  CYS  12           1HB      CYS  12   6.471  -0.300   1.886
   66    H    SER  13           H        SER  13   8.898   1.182   2.509
   67    HA   SER  13           HA       SER  13   9.371   3.202   0.500
   68    HB2  SER  13           2HB      SER  13  10.966   3.016   2.339
   69    HB3  SER  13           1HB      SER  13  11.287   1.333   1.922
   70    HG   SER  13           HG       SER  13  11.642   2.838  -0.249
   71    H    HIS  14           H        HIS  14   8.762  -0.168   0.667
   72    HA   HIS  14           HA       HIS  14   9.974  -0.568  -1.949
   73    HB2  HIS  14           2HB      HIS  14   8.891  -2.600   0.010
   74    HB3  HIS  14           1HB      HIS  14   9.416  -3.020  -1.611
   75    HD1  HIS  14           1HD      HIS  14  11.938  -3.155  -2.031
   76    HD2  HIS  14           2HD      HIS  14  10.896  -1.950   1.777
   77    HE1  HIS  14           1HE      HIS  14  14.074  -3.194  -0.728
   78    HE2  HIS  14           2HE      HIS  14  13.421  -2.502   1.608
   79    H    VAL  15           H        VAL  15   8.370  -2.598  -2.975
   80    HA   VAL  15           HA       VAL  15   6.372  -1.085  -4.198
   81    HB   VAL  15           HB       VAL  15   6.553  -4.102  -4.043
   82   HG11  VAL  15          1HG1      VAL  15   5.133  -2.326  -6.028
   83   HG12  VAL  15          2HG1      VAL  15   4.369  -3.344  -4.809
   84   HG13  VAL  15          3HG1      VAL  15   5.268  -4.081  -6.135
   85   HG21  VAL  15          3HG2      VAL  15   8.612  -3.141  -4.917
   86   HG22  VAL  15          1HG2      VAL  15   7.688  -2.201  -6.087
   87   HG23  VAL  15          2HG2      VAL  15   7.718  -3.962  -6.198
   88    H    CYS  16           H        CYS  16   4.664  -0.354  -3.242
   89    HA   CYS  16           HA       CYS  16   3.355  -1.841  -1.114
   90    HB2  CYS  16           2HB      CYS  16   3.721   0.687  -0.986
   91    HB3  CYS  16           1HB      CYS  16   2.596   0.811  -2.332
   92    H    ASN  17           H        ASN  17   1.465  -2.814  -1.448
   93    HA   ASN  17           HA       ASN  17   0.387  -2.721  -4.170
   94    HB2  ASN  17           2HB      ASN  17   1.405  -4.890  -3.886
   95    HB3  ASN  17           1HB      ASN  17   0.579  -5.130  -2.354
   96   HD21  ASN  17          1HD2      ASN  17  -1.551  -5.796  -2.364
   97   HD22  ASN  17          2HD2      ASN  17  -2.390  -6.266  -3.789
   98    H    ASP  18           H        ASP  18  -1.375  -1.747  -4.215
   99    HA   ASP  18           HA       ASP  18  -2.986  -1.277  -1.943
  100    HB2  ASP  18           2HB      ASP  18  -2.869   0.451  -3.556
  101    HB3  ASP  18           1HB      ASP  18  -3.263  -0.647  -4.867
  102    H    LEU  19           H        LEU  19  -4.149  -2.785  -1.070
  103    HA   LEU  19           HA       LEU  19  -5.508  -4.863  -2.598
  104    HB2  LEU  19           2HB      LEU  19  -5.801  -4.183   0.346
  105    HB3  LEU  19           1HB      LEU  19  -6.258  -5.649  -0.446
  106    HG   LEU  19           HG       LEU  19  -3.373  -4.814  -0.172
  107   HD11  LEU  19          1HD1      LEU  19  -4.968  -6.799   1.420
  108   HD12  LEU  19          2HD1      LEU  19  -4.356  -5.254   2.011
  109   HD13  LEU  19          3HD1      LEU  19  -3.231  -6.532   1.545
  110   HD21  LEU  19          3HD2      LEU  19  -4.662  -7.405  -0.993
  111   HD22  LEU  19          1HD2      LEU  19  -2.932  -7.118  -0.812
  112   HD23  LEU  19          2HD2      LEU  19  -3.837  -6.271  -2.065
  113    H    LYS  20           H        LYS  20  -8.028  -4.993  -1.710
  114    HA   LYS  20           HA       LYS  20  -9.088  -2.532  -2.698
  115    HB2  LYS  20           2HB      LYS  20 -10.384  -5.016  -1.593
  116    HB3  LYS  20           1HB      LYS  20 -11.348  -3.572  -1.850
  117    HG2  LYS  20           2HG      LYS  20 -11.541  -5.100  -3.740
  118    HG3  LYS  20           1HG      LYS  20 -10.775  -3.593  -4.228
  119    HD2  LYS  20           2HD      LYS  20  -8.570  -4.748  -4.058
  120    HD3  LYS  20           1HD      LYS  20  -9.440  -6.245  -3.711
  121    HE2  LYS  20           2HE      LYS  20 -10.560  -6.120  -5.868
  122    HE3  LYS  20           1HE      LYS  20  -9.760  -4.588  -6.211
  123    HZ1  LYS  20           3HZ      LYS  20  -8.575  -6.347  -7.325
  124    HZ2  LYS  20           1HZ      LYS  20  -8.420  -7.234  -5.907
  125    HZ3  LYS  20           2HZ      LYS  20  -7.616  -5.796  -6.082
  126    H    ILE  21           H        ILE  21  -9.198  -4.034   0.457
  127    HA   ILE  21           HA       ILE  21  -9.423  -1.341   1.500
  128    HB   ILE  21           HB       ILE  21 -11.515  -2.453   2.050
  129   HG12  ILE  21          2HG1      ILE  21 -11.472  -2.412   4.550
  130   HG13  ILE  21          1HG1      ILE  21  -9.719  -2.322   4.478
  131   HG21  ILE  21          1HG2      ILE  21 -10.945  -4.752   1.792
  132   HG22  ILE  21          2HG2      ILE  21 -11.664  -4.509   3.385
  133   HG23  ILE  21          3HG2      ILE  21  -9.918  -4.704   3.222
  134   HD11  ILE  21          3HD1      ILE  21  -9.872  -0.182   3.320
  135   HD12  ILE  21          1HD1      ILE  21 -10.719  -0.139   4.864
  136   HD13  ILE  21          2HD1      ILE  21 -11.632  -0.279   3.363
  137    H    GLY  22           H        GLY  22  -7.605  -0.748   2.327
  138    HA2  GLY  22           2HA      GLY  22  -5.741  -0.994   3.678
  139    HA3  GLY  22           1HA      GLY  22  -5.992  -2.743   3.684
  140    H    TYR  23           H        TYR  23  -3.689  -2.751   3.209
  141    HA   TYR  23           HA       TYR  23  -3.123  -2.959   0.416
  142    HB2  TYR  23           2HB      TYR  23  -1.353  -1.286   0.379
  143    HB3  TYR  23           1HB      TYR  23  -2.872  -0.515   0.814
  144    HD1  TYR  23           2HD      TYR  23  -3.283  -0.096   3.355
  145    HD2  TYR  23           1HD      TYR  23   0.529  -1.016   1.725
  146    HE1  TYR  23           2HE      TYR  23  -2.209   0.828   5.359
  147    HE2  TYR  23           1HE      TYR  23   1.603  -0.101   3.716
  148    HH   TYR  23           HH       TYR  23   1.072   1.513   5.423
  149    H    GLU  24           H        GLU  24  -0.766  -3.691   0.228
  150    HA   GLU  24           HA       GLU  24   0.322  -4.635   2.754
  151    HB2  GLU  24           2HB      GLU  24   0.805  -6.832   1.928
  152    HB3  GLU  24           1HB      GLU  24  -0.890  -6.541   1.590
  153    HG2  GLU  24           2HG      GLU  24  -0.269  -6.020  -0.774
  154    HG3  GLU  24           1HG      GLU  24   1.391  -6.399  -0.356
  155    H    CYS  25           H        CYS  25   2.674  -5.125   2.483
  156    HA   CYS  25           HA       CYS  25   3.753  -3.574   0.258
  157    HB2  CYS  25           2HB      CYS  25   4.725  -3.539   3.119
  158    HB3  CYS  25           1HB      CYS  25   5.507  -2.717   1.768
  159    H    LEU  26           H        LEU  26   5.256  -4.489  -0.874
  160    HA   LEU  26           HA       LEU  26   6.064  -7.183  -0.148
  161    HB2  LEU  26           2HB      LEU  26   6.393  -5.626  -2.699
  162    HB3  LEU  26           1HB      LEU  26   6.756  -7.325  -2.479
  163    HG   LEU  26           HG       LEU  26   3.981  -6.115  -2.284
  164   HD11  LEU  26          1HD1      LEU  26   3.593  -7.256  -4.396
  165   HD12  LEU  26          2HD1      LEU  26   5.291  -7.747  -4.442
  166   HD13  LEU  26          3HD1      LEU  26   4.864  -6.039  -4.535
  167   HD21  LEU  26          3HD2      LEU  26   4.258  -8.079  -0.882
  168   HD22  LEU  26          1HD2      LEU  26   4.939  -8.976  -2.239
  169   HD23  LEU  26          2HD2      LEU  26   3.252  -8.452  -2.284
  170    HN1  NH2  27           1H       LEU  26   7.627  -6.746   1.374
  171    HN2  NH2  27           2H       LEU  26   9.142  -6.005   0.991
  Start of MODEL   18
    1    H1   GLY   1           1HT      GLY   1 -12.927   4.511  -1.900
    2    H2   GLY   1           2HT      GLY   1 -13.462   4.160  -3.465
    3    H3   GLY   1           3HT      GLY   1 -12.473   5.507  -3.168
    4    HA2  GLY   1           1HA      GLY   1 -11.635   2.725  -2.770
    5    HA3  GLY   1           2HA      GLY   1 -11.251   3.707  -4.179
    6    H    THR   2           H        THR   2 -10.382   2.893  -1.018
    7    HA   THR   2           HA       THR   2  -8.678   5.210  -0.728
    8    HB   THR   2           HB       THR   2  -8.977   2.818   1.114
    9    HG1  THR   2           1HG      THR   2 -10.584   4.923   0.588
   10   HG21  THR   2          3HG2      THR   2  -6.908   4.109   1.458
   11   HG22  THR   2          1HG2      THR   2  -8.023   4.335   2.806
   12   HG23  THR   2          2HG2      THR   2  -7.852   5.591   1.579
   13    H    ASN   3           H        ASN   3  -7.164   4.968  -2.274
   14    HA   ASN   3           HA       ASN   3  -5.595   2.537  -2.489
   15    HB2  ASN   3           2HB      ASN   3  -6.212   3.880  -4.499
   16    HB3  ASN   3           1HB      ASN   3  -5.350   5.244  -3.833
   17   HD21  ASN   3          1HD2      ASN   3  -4.138   1.981  -3.733
   18   HD22  ASN   3          2HD2      ASN   3  -2.827   2.243  -4.840
   19    H    GLU   4           H        GLU   4  -4.643   2.436  -0.448
   20    HA   GLU   4           HA       GLU   4  -3.581   4.538   0.994
   21    HB2  GLU   4           2HB      GLU   4  -2.802   1.630   1.024
   22    HB3  GLU   4           1HB      GLU   4  -2.081   2.798   2.109
   23    HG2  GLU   4           2HG      GLU   4  -3.762   1.687   3.336
   24    HG3  GLU   4           1HG      GLU   4  -4.398   3.280   2.969
   25    H    CYS   5           H        CYS   5  -2.107   2.751  -1.569
   26    HA   CYS   5           HA       CYS   5   0.556   3.504  -1.200
   27    HB2  CYS   5           2HB      CYS   5  -0.829   2.907  -3.793
   28    HB3  CYS   5           1HB      CYS   5   0.883   2.882  -3.465
   29    H    LEU   6           H        LEU   6  -2.056   5.232  -2.479
   30    HA   LEU   6           HA       LEU   6  -0.696   7.283  -3.889
   31    HB2  LEU   6           2HB      LEU   6  -3.316   7.304  -2.451
   32    HB3  LEU   6           1HB      LEU   6  -2.701   8.742  -3.246
   33    HG   LEU   6           HG       LEU   6  -3.496   6.110  -4.482
   34   HD11  LEU   6          1HD1      LEU   6  -4.647   8.882  -4.709
   35   HD12  LEU   6          2HD1      LEU   6  -5.314   7.564  -3.757
   36   HD13  LEU   6          3HD1      LEU   6  -5.251   7.434  -5.520
   37   HD21  LEU   6          3HD2      LEU   6  -1.611   6.989  -5.727
   38   HD22  LEU   6          1HD2      LEU   6  -2.365   8.587  -5.786
   39   HD23  LEU   6          2HD2      LEU   6  -3.096   7.233  -6.641
   40    H    ASP   7           H        ASP   7  -1.314   6.854  -0.491
   41    HA   ASP   7           HA       ASP   7  -0.160   9.481   0.072
   42    HB2  ASP   7           2HB      ASP   7  -2.268   8.949   1.243
   43    HB3  ASP   7           1HB      ASP   7  -1.508   7.517   1.932
   44    H    ASN   8           H        ASN   8   1.921   9.248  -0.201
   45    HA   ASN   8           HA       ASN   8   4.094   8.784   0.205
   46    HB2  ASN   8           2HB      ASN   8   2.973   7.923   2.862
   47    HB3  ASN   8           1HB      ASN   8   4.685   7.852   2.456
   48   HD21  ASN   8          1HD2      ASN   8   5.108   9.311   4.132
   49   HD22  ASN   8          2HD2      ASN   8   4.799  10.997   4.009
   50    H    ASN   9           H        ASN   9   2.657   6.917  -1.163
   51    HA   ASN   9           HA       ASN   9   2.715   4.809  -2.058
   52    HB2  ASN   9           2HB      ASN   9   5.190   5.461  -2.227
   53    HB3  ASN   9           1HB      ASN   9   5.448   4.525  -0.760
   54   HD21  ASN   9          1HD2      ASN   9   6.693   2.961  -1.590
   55   HD22  ASN   9          2HD2      ASN   9   6.246   1.813  -2.774
   56    H    GLY  10           H        GLY  10   1.438   5.108   0.425
   57    HA2  GLY  10           2HA      GLY  10   0.332   3.700   1.890
   58    HA3  GLY  10           1HA      GLY  10   1.294   2.358   1.280
   59    H    GLY  11           H        GLY  11   3.256   4.896   2.067
   60    HA2  GLY  11           2HA      GLY  11   4.587   5.390   3.860
   61    HA3  GLY  11           1HA      GLY  11   3.639   4.274   4.850
   62    H    CYS  12           H        CYS  12   4.723   3.167   1.764
   63    HA   CYS  12           HA       CYS  12   6.605   1.424   3.139
   64    HB2  CYS  12           2HB      CYS  12   4.882   1.019   0.718
   65    HB3  CYS  12           1HB      CYS  12   6.003  -0.183   1.339
   66    H    SER  13           H        SER  13   8.623   1.313   2.409
   67    HA   SER  13           HA       SER  13   9.461   3.147   0.348
   68    HB2  SER  13           2HB      SER  13  11.086   1.282   2.075
   69    HB3  SER  13           1HB      SER  13  11.671   2.684   1.176
   70    HG   SER  13           HG       SER  13  11.379   3.445   3.175
   71    H    HIS  14           H        HIS  14   8.499  -0.068   0.545
   72    HA   HIS  14           HA       HIS  14  10.019  -0.781  -1.864
   73    HB2  HIS  14           2HB      HIS  14   8.619  -2.651   0.099
   74    HB3  HIS  14           1HB      HIS  14   9.481  -3.161  -1.334
   75    HD1  HIS  14           1HD      HIS  14  12.049  -3.423  -1.131
   76    HD2  HIS  14           2HD      HIS  14  10.245  -1.795   2.237
   77    HE1  HIS  14           1HE      HIS  14  13.810  -3.412   0.637
   78    HE2  HIS  14           2HE      HIS  14  12.770  -2.230   2.593
   79    H    VAL  15           H        VAL  15   8.298  -2.772  -2.844
   80    HA   VAL  15           HA       VAL  15   6.393  -1.208  -4.175
   81    HB   VAL  15           HB       VAL  15   6.440  -4.228  -3.884
   82   HG11  VAL  15          1HG1      VAL  15   4.961  -2.520  -5.892
   83   HG12  VAL  15          2HG1      VAL  15   4.230  -3.446  -4.583
   84   HG13  VAL  15          3HG1      VAL  15   5.045  -4.282  -5.906
   85   HG21  VAL  15          3HG2      VAL  15   7.462  -4.199  -6.123
   86   HG22  VAL  15          1HG2      VAL  15   8.462  -3.387  -4.920
   87   HG23  VAL  15          2HG2      VAL  15   7.510  -2.436  -6.060
   88    H    CYS  16           H        CYS  16   4.627  -0.380  -3.418
   89    HA   CYS  16           HA       CYS  16   3.250  -1.507  -1.137
   90    HB2  CYS  16           2HB      CYS  16   3.406   0.980  -1.334
   91    HB3  CYS  16           1HB      CYS  16   2.545   0.901  -2.859
   92    H    ASN  17           H        ASN  17   1.324  -2.484  -1.235
   93    HA   ASN  17           HA       ASN  17   0.263  -3.192  -3.884
   94    HB2  ASN  17           2HB      ASN  17   1.550  -5.100  -3.068
   95    HB3  ASN  17           1HB      ASN  17   0.678  -5.066  -1.538
   96   HD21  ASN  17          1HD2      ASN  17  -0.110  -7.135  -1.729
   97   HD22  ASN  17          2HD2      ASN  17  -1.307  -7.614  -2.852
   98    H    ASP  18           H        ASP  18  -1.309  -1.813  -3.717
   99    HA   ASP  18           HA       ASP  18  -3.014  -1.552  -1.440
  100    HB2  ASP  18           2HB      ASP  18  -2.784   0.385  -2.742
  101    HB3  ASP  18           1HB      ASP  18  -3.148  -0.477  -4.230
  102    H    LEU  19           H        LEU  19  -4.518  -2.837  -0.889
  103    HA   LEU  19           HA       LEU  19  -5.782  -4.504  -2.916
  104    HB2  LEU  19           2HB      LEU  19  -5.803  -4.813   0.093
  105    HB3  LEU  19           1HB      LEU  19  -6.486  -5.916  -1.078
  106    HG   LEU  19           HG       LEU  19  -3.537  -5.327  -0.849
  107   HD11  LEU  19          1HD1      LEU  19  -4.340  -6.511   1.110
  108   HD12  LEU  19          2HD1      LEU  19  -3.362  -7.569   0.098
  109   HD13  LEU  19          3HD1      LEU  19  -5.120  -7.715   0.085
  110   HD21  LEU  19          3HD2      LEU  19  -5.047  -7.394  -2.453
  111   HD22  LEU  19          1HD2      LEU  19  -3.293  -7.243  -2.346
  112   HD23  LEU  19          2HD2      LEU  19  -4.238  -5.966  -3.103
  113    H    LYS  20           H        LYS  20  -8.215  -4.897  -2.296
  114    HA   LYS  20           HA       LYS  20  -9.437  -2.332  -2.361
  115    HB2  LYS  20           2HB      LYS  20 -10.673  -5.058  -1.945
  116    HB3  LYS  20           1HB      LYS  20 -11.591  -3.587  -2.233
  117    HG2  LYS  20           2HG      LYS  20  -9.592  -4.773  -4.161
  118    HG3  LYS  20           1HG      LYS  20 -11.339  -4.995  -4.250
  119    HD2  LYS  20           2HD      LYS  20 -11.649  -2.604  -4.573
  120    HD3  LYS  20           1HD      LYS  20  -9.918  -2.328  -4.377
  121    HE2  LYS  20           2HE      LYS  20 -11.153  -4.006  -6.561
  122    HE3  LYS  20           1HE      LYS  20 -10.663  -2.325  -6.745
  123    HZ1  LYS  20           3HZ      LYS  20  -8.972  -3.857  -7.559
  124    HZ2  LYS  20           1HZ      LYS  20  -8.831  -4.566  -6.041
  125    HZ3  LYS  20           2HZ      LYS  20  -8.394  -2.949  -6.283
  126    H    ILE  21           H        ILE  21  -9.153  -4.808   0.085
  127    HA   ILE  21           HA       ILE  21 -10.117  -2.896   2.074
  128    HB   ILE  21           HB       ILE  21  -9.661  -5.885   2.310
  129   HG12  ILE  21          2HG1      ILE  21 -11.603  -5.438   0.924
  130   HG13  ILE  21          1HG1      ILE  21 -12.092  -6.035   2.508
  131   HG21  ILE  21          1HG2      ILE  21 -10.843  -3.956   4.295
  132   HG22  ILE  21          2HG2      ILE  21  -9.280  -4.762   4.427
  133   HG23  ILE  21          3HG2      ILE  21 -10.769  -5.708   4.486
  134   HD11  ILE  21          3HD1      ILE  21 -13.532  -4.245   1.705
  135   HD12  ILE  21          1HD1      ILE  21 -12.152  -3.155   1.647
  136   HD13  ILE  21          2HD1      ILE  21 -12.700  -3.797   3.196
  137    H    GLY  22           H        GLY  22  -8.550  -1.764   2.833
  138    HA2  GLY  22           2HA      GLY  22  -6.527  -1.180   3.783
  139    HA3  GLY  22           1HA      GLY  22  -6.275  -2.897   4.081
  140    H    TYR  23           H        TYR  23  -4.226  -3.125   3.453
  141    HA   TYR  23           HA       TYR  23  -3.599  -3.444   0.717
  142    HB2  TYR  23           2HB      TYR  23  -1.994  -1.680   0.392
  143    HB3  TYR  23           1HB      TYR  23  -3.452  -0.890   0.977
  144    HD1  TYR  23           1HD      TYR  23  -3.440  -0.703   3.730
  145    HD2  TYR  23           2HD      TYR  23  -0.015  -0.929   1.219
  146    HE1  TYR  23           1HE      TYR  23  -2.087   0.366   5.480
  147    HE2  TYR  23           2HE      TYR  23   1.338   0.131   2.961
  148    HH   TYR  23           HH       TYR  23   0.967   1.619   4.841
  149    H    GLU  24           H        GLU  24  -0.985  -3.705   0.699
  150    HA   GLU  24           HA       GLU  24   0.213  -4.266   3.229
  151    HB2  GLU  24           2HB      GLU  24   0.785  -6.554   2.822
  152    HB3  GLU  24           1HB      GLU  24  -0.946  -6.441   2.567
  153    HG2  GLU  24           2HG      GLU  24  -0.556  -6.401   0.115
  154    HG3  GLU  24           1HG      GLU  24   1.166  -6.519   0.434
  155    H    CYS  25           H        CYS  25   2.606  -4.885   2.666
  156    HA   CYS  25           HA       CYS  25   3.219  -3.780   0.056
  157    HB2  CYS  25           2HB      CYS  25   4.561  -2.953   2.627
  158    HB3  CYS  25           1HB      CYS  25   5.106  -2.498   1.012
  159    H    LEU  26           H        LEU  26   5.171  -4.392  -0.831
  160    HA   LEU  26           HA       LEU  26   6.089  -6.982   0.189
  161    HB2  LEU  26           2HB      LEU  26   5.780  -6.062  -2.667
  162    HB3  LEU  26           1HB      LEU  26   6.342  -7.638  -2.149
  163    HG   LEU  26           HG       LEU  26   3.545  -6.551  -1.712
  164   HD11  LEU  26          1HD1      LEU  26   2.880  -8.227  -3.341
  165   HD12  LEU  26          2HD1      LEU  26   4.575  -8.659  -3.591
  166   HD13  LEU  26          3HD1      LEU  26   3.999  -7.053  -4.038
  167   HD21  LEU  26          3HD2      LEU  26   3.029  -8.811  -0.947
  168   HD22  LEU  26          1HD2      LEU  26   4.258  -8.053   0.066
  169   HD23  LEU  26          2HD2      LEU  26   4.728  -9.262  -1.127
  170    HN1  NH2  27           1H       LEU  26   7.973  -6.473   1.058
  171    HN2  NH2  27           2H       LEU  26   9.256  -5.590   0.311
  Start of MODEL   19
    1    H1   GLY   1           1HT      GLY   1 -11.881   4.786  -3.700
    2    H2   GLY   1           2HT      GLY   1 -12.527   3.295  -4.167
    3    H3   GLY   1           3HT      GLY   1 -10.869   3.606  -4.323
    4    HA2  GLY   1           1HA      GLY   1 -12.290   3.487  -1.754
    5    HA3  GLY   1           2HA      GLY   1 -11.276   2.211  -2.427
    6    H    THR   2           H        THR   2 -10.441   2.977  -0.104
    7    HA   THR   2           HA       THR   2  -8.731   5.235  -0.064
    8    HB   THR   2           HB       THR   2  -8.696   2.755   1.684
    9    HG1  THR   2           1HG      THR   2  -9.941   4.638   2.945
   10   HG21  THR   2          3HG2      THR   2  -7.764   4.271   3.383
   11   HG22  THR   2          1HG2      THR   2  -7.828   5.606   2.230
   12   HG23  THR   2          2HG2      THR   2  -6.747   4.243   1.945
   13    H    ASN   3           H        ASN   3  -7.228   5.113  -1.698
   14    HA   ASN   3           HA       ASN   3  -5.725   2.646  -2.131
   15    HB2  ASN   3           2HB      ASN   3  -6.725   4.012  -3.994
   16    HB3  ASN   3           1HB      ASN   3  -5.556   5.271  -3.635
   17   HD21  ASN   3          1HD2      ASN   3  -3.341   3.501  -3.198
   18   HD22  ASN   3          2HD2      ASN   3  -2.940   2.772  -4.727
   19    H    GLU   4           H        GLU   4  -4.679   2.719  -0.104
   20    HA   GLU   4           HA       GLU   4  -3.292   4.825   1.011
   21    HB2  GLU   4           2HB      GLU   4  -2.635   1.892   1.278
   22    HB3  GLU   4           1HB      GLU   4  -2.006   3.156   2.311
   23    HG2  GLU   4           2HG      GLU   4  -3.696   2.354   3.613
   24    HG3  GLU   4           1HG      GLU   4  -4.551   3.624   2.753
   25    H    CYS   5           H        CYS   5  -2.131   2.509  -1.337
   26    HA   CYS   5           HA       CYS   5   0.610   3.020  -1.148
   27    HB2  CYS   5           2HB      CYS   5  -0.999   2.154  -3.492
   28    HB3  CYS   5           1HB      CYS   5   0.753   2.096  -3.396
   29    H    LEU   6           H        LEU   6  -1.782   4.890  -2.629
   30    HA   LEU   6           HA       LEU   6   0.028   6.436  -4.270
   31    HB2  LEU   6           2HB      LEU   6  -2.872   6.425  -3.780
   32    HB3  LEU   6           1HB      LEU   6  -2.160   7.957  -4.228
   33    HG   LEU   6           HG       LEU   6  -3.184   6.544  -6.101
   34   HD11  LEU   6          1HD1      LEU   6  -1.688   8.404  -6.569
   35   HD12  LEU   6          2HD1      LEU   6  -1.385   7.082  -7.696
   36   HD13  LEU   6          3HD1      LEU   6  -0.287   7.359  -6.343
   37   HD21  LEU   6          3HD2      LEU   6  -1.767   4.789  -7.070
   38   HD22  LEU   6          1HD2      LEU   6  -2.311   4.366  -5.448
   39   HD23  LEU   6          2HD2      LEU   6  -0.661   4.931  -5.705
   40    H    ASP   7           H        ASP   7  -0.980   6.519  -1.082
   41    HA   ASP   7           HA       ASP   7   0.005   9.277  -0.777
   42    HB2  ASP   7           2HB      ASP   7  -2.260   8.906   0.114
   43    HB3  ASP   7           1HB      ASP   7  -1.641   7.621   1.148
   44    H    ASN   8           H        ASN   8   2.125   9.224  -0.412
   45    HA   ASN   8           HA       ASN   8   4.164   8.777   0.487
   46    HB2  ASN   8           2HB      ASN   8   2.476   7.847   2.817
   47    HB3  ASN   8           1HB      ASN   8   4.238   7.881   2.822
   48   HD21  ASN   8          1HD2      ASN   8   1.323   9.814   2.808
   49   HD22  ASN   8          2HD2      ASN   8   2.069  11.308   3.199
   50    H    ASN   9           H        ASN   9   2.915   6.941  -1.110
   51    HA   ASN   9           HA       ASN   9   2.927   4.853  -1.967
   52    HB2  ASN   9           2HB      ASN   9   5.374   5.593  -2.060
   53    HB3  ASN   9           1HB      ASN   9   5.620   4.577  -0.641
   54   HD21  ASN   9          1HD2      ASN   9   5.726   2.442  -0.899
   55   HD22  ASN   9          2HD2      ASN   9   5.761   1.581  -2.387
   56    H    GLY  10           H        GLY  10   1.507   5.000   0.373
   57    HA2  GLY  10           2HA      GLY  10   0.311   3.460   1.598
   58    HA3  GLY  10           1HA      GLY  10   1.419   2.207   1.061
   59    H    GLY  11           H        GLY  11   3.260   4.658   2.180
   60    HA2  GLY  11           2HA      GLY  11   4.158   5.161   4.267
   61    HA3  GLY  11           1HA      GLY  11   3.148   3.906   4.987
   62    H    CYS  12           H        CYS  12   4.526   2.826   2.175
   63    HA   CYS  12           HA       CYS  12   6.704   1.474   3.596
   64    HB2  CYS  12           2HB      CYS  12   4.987   0.546   1.270
   65    HB3  CYS  12           1HB      CYS  12   6.296  -0.382   1.972
   66    H    SER  13           H        SER  13   8.673   1.856   2.739
   67    HA   SER  13           HA       SER  13   8.885   3.693   0.571
   68    HB2  SER  13           2HB      SER  13  11.046   2.165   2.024
   69    HB3  SER  13           1HB      SER  13  11.272   3.599   1.018
   70    HG   SER  13           HG       SER  13   9.531   4.423   2.623
   71    H    HIS  14           H        HIS  14   9.158   0.257   0.992
   72    HA   HIS  14           HA       HIS  14  10.063  -0.081  -1.740
   73    HB2  HIS  14           2HB      HIS  14   9.722  -2.554  -1.385
   74    HB3  HIS  14           1HB      HIS  14  10.968  -1.840  -0.425
   75    HD1  HIS  14           1HD      HIS  14   7.197  -2.495   0.137
   76    HD2  HIS  14           2HD      HIS  14  10.880  -3.088   1.980
   77    HE1  HIS  14           1HE      HIS  14   6.714  -3.613   2.339
   78    HE2  HIS  14           2HE      HIS  14   8.898  -3.639   3.518
   79    H    VAL  15           H        VAL  15   8.664  -2.223  -2.620
   80    HA   VAL  15           HA       VAL  15   6.565  -0.918  -3.896
   81    HB   VAL  15           HB       VAL  15   6.964  -3.906  -3.604
   82   HG11  VAL  15          1HG1      VAL  15   5.657  -4.077  -5.672
   83   HG12  VAL  15          2HG1      VAL  15   5.355  -2.341  -5.621
   84   HG13  VAL  15          3HG1      VAL  15   4.708  -3.385  -4.357
   85   HG21  VAL  15          3HG2      VAL  15   8.898  -2.711  -4.558
   86   HG22  VAL  15          1HG2      VAL  15   7.848  -2.020  -5.787
   87   HG23  VAL  15          2HG2      VAL  15   8.123  -3.764  -5.740
   88    H    CYS  16           H        CYS  16   4.491  -0.682  -3.538
   89    HA   CYS  16           HA       CYS  16   3.267  -1.886  -1.176
   90    HB2  CYS  16           2HB      CYS  16   3.529   0.611  -1.110
   91    HB3  CYS  16           1HB      CYS  16   2.591   0.740  -2.582
   92    H    ASN  17           H        ASN  17   1.136  -2.654  -1.486
   93    HA   ASN  17           HA       ASN  17   0.222  -2.976  -4.246
   94    HB2  ASN  17           2HB      ASN  17   1.348  -5.043  -3.574
   95    HB3  ASN  17           1HB      ASN  17   0.353  -5.140  -2.125
   96   HD21  ASN  17          1HD2      ASN  17  -0.479  -7.172  -2.723
   97   HD22  ASN  17          2HD2      ASN  17  -1.596  -7.351  -4.008
   98    H    ASP  18           H        ASP  18  -1.506  -1.738  -4.170
   99    HA   ASP  18           HA       ASP  18  -3.036  -1.440  -1.771
  100    HB2  ASP  18           2HB      ASP  18  -2.901   0.536  -3.062
  101    HB3  ASP  18           1HB      ASP  18  -3.431  -0.286  -4.522
  102    H    LEU  19           H        LEU  19  -4.482  -2.647  -1.078
  103    HA   LEU  19           HA       LEU  19  -5.954  -4.426  -2.873
  104    HB2  LEU  19           2HB      LEU  19  -5.870  -4.413   0.134
  105    HB3  LEU  19           1HB      LEU  19  -6.506  -5.663  -0.894
  106    HG   LEU  19           HG       LEU  19  -3.594  -4.944  -0.629
  107   HD11  LEU  19          1HD1      LEU  19  -4.459  -6.019   1.340
  108   HD12  LEU  19          2HD1      LEU  19  -3.431  -7.136   0.435
  109   HD13  LEU  19          3HD1      LEU  19  -5.186  -7.288   0.355
  110   HD21  LEU  19          3HD2      LEU  19  -3.171  -6.906  -1.985
  111   HD22  LEU  19          1HD2      LEU  19  -4.164  -5.756  -2.874
  112   HD23  LEU  19          2HD2      LEU  19  -4.901  -7.195  -2.160
  113    H    LYS  20           H        LYS  20  -8.331  -4.630  -2.205
  114    HA   LYS  20           HA       LYS  20  -9.491  -2.038  -2.110
  115    HB2  LYS  20           2HB      LYS  20 -10.621  -3.940  -3.210
  116    HB3  LYS  20           1HB      LYS  20 -10.800  -4.733  -1.650
  117    HG2  LYS  20           2HG      LYS  20 -12.206  -2.891  -0.882
  118    HG3  LYS  20           1HG      LYS  20 -12.040  -2.114  -2.456
  119    HD2  LYS  20           2HD      LYS  20 -13.098  -4.063  -3.507
  120    HD3  LYS  20           1HD      LYS  20 -13.284  -4.808  -1.917
  121    HE2  LYS  20           2HE      LYS  20 -14.669  -2.931  -1.197
  122    HE3  LYS  20           1HE      LYS  20 -14.491  -2.178  -2.775
  123    HZ1  LYS  20           3HZ      LYS  20 -15.595  -4.138  -3.738
  124    HZ2  LYS  20           1HZ      LYS  20 -16.565  -3.316  -2.609
  125    HZ3  LYS  20           2HZ      LYS  20 -15.805  -4.752  -2.173
  126    H    ILE  21           H        ILE  21  -9.202  -4.661   0.174
  127    HA   ILE  21           HA       ILE  21 -10.046  -2.874   2.315
  128    HB   ILE  21           HB       ILE  21  -9.632  -5.879   2.350
  129   HG12  ILE  21          2HG1      ILE  21 -11.588  -5.321   1.032
  130   HG13  ILE  21          1HG1      ILE  21 -12.075  -5.980   2.592
  131   HG21  ILE  21          1HG2      ILE  21  -9.197  -4.905   4.539
  132   HG22  ILE  21          2HG2      ILE  21 -10.712  -5.812   4.562
  133   HG23  ILE  21          3HG2      ILE  21 -10.739  -4.054   4.483
  134   HD11  ILE  21          3HD1      ILE  21 -13.506  -4.132   1.967
  135   HD12  ILE  21          1HD1      ILE  21 -12.106  -3.068   1.820
  136   HD13  ILE  21          2HD1      ILE  21 -12.554  -3.718   3.393
  137    H    GLY  22           H        GLY  22  -8.480  -1.765   2.987
  138    HA2  GLY  22           2HA      GLY  22  -6.491  -1.195   3.975
  139    HA3  GLY  22           1HA      GLY  22  -6.150  -2.914   4.151
  140    H    TYR  23           H        TYR  23  -4.104  -2.945   3.436
  141    HA   TYR  23           HA       TYR  23  -3.726  -2.851   0.625
  142    HB2  TYR  23           2HB      TYR  23  -1.889  -1.230   0.615
  143    HB3  TYR  23           1HB      TYR  23  -3.332  -0.453   1.243
  144    HD1  TYR  23           2HD      TYR  23  -3.511  -0.217   3.814
  145    HD2  TYR  23           1HD      TYR  23   0.109  -1.185   1.814
  146    HE1  TYR  23           2HE      TYR  23  -2.233   0.497   5.790
  147    HE2  TYR  23           1HE      TYR  23   1.388  -0.477   3.779
  148    HH   TYR  23           HH       TYR  23  -0.012  -0.027   6.759
  149    H    GLU  24           H        GLU  24  -1.208  -3.280   0.350
  150    HA   GLU  24           HA       GLU  24  -0.220  -5.042   2.419
  151    HB2  GLU  24           2HB      GLU  24  -1.570  -6.427   0.941
  152    HB3  GLU  24           1HB      GLU  24  -0.799  -5.749  -0.475
  153    HG2  GLU  24           2HG      GLU  24   1.280  -6.860   0.128
  154    HG3  GLU  24           1HG      GLU  24   0.526  -7.487   1.595
  155    H    CYS  25           H        CYS  25   2.101  -5.227   2.187
  156    HA   CYS  25           HA       CYS  25   3.258  -3.524   0.107
  157    HB2  CYS  25           2HB      CYS  25   4.114  -3.620   3.015
  158    HB3  CYS  25           1HB      CYS  25   5.034  -2.863   1.717
  159    H    LEU  26           H        LEU  26   5.000  -4.328  -0.930
  160    HA   LEU  26           HA       LEU  26   5.725  -7.069  -0.148
  161    HB2  LEU  26           2HB      LEU  26   5.278  -5.994  -2.930
  162    HB3  LEU  26           1HB      LEU  26   5.761  -7.633  -2.524
  163    HG   LEU  26           HG       LEU  26   3.150  -6.335  -1.816
  164   HD11  LEU  26          1HD1      LEU  26   2.199  -7.852  -3.492
  165   HD12  LEU  26          2HD1      LEU  26   3.830  -8.394  -3.903
  166   HD13  LEU  26          3HD1      LEU  26   3.355  -6.722  -4.199
  167   HD21  LEU  26          3HD2      LEU  26   2.469  -8.620  -1.168
  168   HD22  LEU  26          1HD2      LEU  26   3.800  -8.005  -0.185
  169   HD23  LEU  26          2HD2      LEU  26   4.124  -9.168  -1.468
  170    HN1  NH2  27           1H       LEU  26   7.006  -5.818  -3.034
  171    HN2  NH2  27           2H       LEU  26   8.552  -5.379  -2.418
  Start of MODEL   20
    1    H1   GLY   1           1HT      GLY   1 -12.292   4.471  -4.746
    2    H2   GLY   1           2HT      GLY   1 -13.017   2.979  -5.048
    3    H3   GLY   1           3HT      GLY   1 -11.327   3.130  -5.095
    4    HA2  GLY   1           1HA      GLY   1 -13.036   3.445  -2.717
    5    HA3  GLY   1           2HA      GLY   1 -11.975   2.086  -3.072
    6    H    THR   2           H        THR   2 -10.829   2.558  -1.112
    7    HA   THR   2           HA       THR   2  -9.460   5.098  -1.125
    8    HB   THR   2           HB       THR   2 -10.609   4.768   0.917
    9    HG1  THR   2           1HG      THR   2  -7.979   4.042   1.632
   10   HG21  THR   2          3HG2      THR   2  -9.232   2.108   1.125
   11   HG22  THR   2          1HG2      THR   2 -10.955   2.372   0.864
   12   HG23  THR   2          2HG2      THR   2 -10.210   2.832   2.402
   13    H    ASN   3           H        ASN   3  -7.544   5.227  -1.834
   14    HA   ASN   3           HA       ASN   3  -5.882   2.820  -2.158
   15    HB2  ASN   3           2HB      ASN   3  -6.672   4.333  -4.119
   16    HB3  ASN   3           1HB      ASN   3  -5.529   5.488  -3.485
   17   HD21  ASN   3          1HD2      ASN   3  -3.684   3.038  -2.792
   18   HD22  ASN   3          2HD2      ASN   3  -2.993   2.736  -4.341
   19    H    GLU   4           H        GLU   4  -4.580   2.734  -0.428
   20    HA   GLU   4           HA       GLU   4  -3.782   5.032   1.086
   21    HB2  GLU   4           2HB      GLU   4  -3.044   2.105   1.271
   22    HB3  GLU   4           1HB      GLU   4  -2.476   3.325   2.390
   23    HG2  GLU   4           2HG      GLU   4  -4.300   2.049   3.359
   24    HG3  GLU   4           1HG      GLU   4  -4.774   3.722   3.132
   25    H    CYS   5           H        CYS   5  -2.343   2.783  -1.183
   26    HA   CYS   5           HA       CYS   5   0.356   3.410  -0.943
   27    HB2  CYS   5           2HB      CYS   5  -1.172   2.542  -3.365
   28    HB3  CYS   5           1HB      CYS   5   0.576   2.602  -3.267
   29    H    LEU   6           H        LEU   6  -2.081   5.226  -2.516
   30    HA   LEU   6           HA       LEU   6  -0.545   6.702  -4.337
   31    HB2  LEU   6           2HB      LEU   6  -3.071   7.446  -2.919
   32    HB3  LEU   6           1HB      LEU   6  -2.313   8.501  -4.095
   33    HG   LEU   6           HG       LEU   6  -3.434   5.743  -4.582
   34   HD11  LEU   6          1HD1      LEU   6  -5.076   6.922  -5.937
   35   HD12  LEU   6          2HD1      LEU   6  -4.343   8.460  -5.482
   36   HD13  LEU   6          3HD1      LEU   6  -5.120   7.460  -4.258
   37   HD21  LEU   6          3HD2      LEU   6  -1.503   6.095  -6.032
   38   HD22  LEU   6          1HD2      LEU   6  -2.139   7.670  -6.517
   39   HD23  LEU   6          2HD2      LEU   6  -2.993   6.196  -6.960
   40    H    ASP   7           H        ASP   7  -1.054   7.354  -0.913
   41    HA   ASP   7           HA       ASP   7   0.769   9.635  -1.244
   42    HB2  ASP   7           2HB      ASP   7  -1.410  10.326  -0.421
   43    HB3  ASP   7           1HB      ASP   7  -1.311   9.152   0.884
   44    H    ASN   8           H        ASN   8   2.701   9.515  -0.419
   45    HA   ASN   8           HA       ASN   8   4.562   8.855   0.685
   46    HB2  ASN   8           2HB      ASN   8   3.186   9.488   2.621
   47    HB3  ASN   8           1HB      ASN   8   2.649   7.830   2.791
   48   HD21  ASN   8          1HD2      ASN   8   6.002   8.729   2.005
   49   HD22  ASN   8          2HD2      ASN   8   6.674   8.148   3.468
   50    H    ASN   9           H        ASN   9   2.970   7.129  -0.961
   51    HA   ASN   9           HA       ASN   9   2.944   5.027  -1.917
   52    HB2  ASN   9           2HB      ASN   9   5.467   5.487  -1.885
   53    HB3  ASN   9           1HB      ASN   9   5.534   4.526  -0.414
   54   HD21  ASN   9          1HD2      ASN   9   6.764   2.899  -1.203
   55   HD22  ASN   9          2HD2      ASN   9   6.268   1.801  -2.422
   56    H    GLY  10           H        GLY  10   1.612   5.475   0.568
   57    HA2  GLY  10           2HA      GLY  10   0.328   4.243   2.016
   58    HA3  GLY  10           1HA      GLY  10   0.990   2.785   1.290
   59    H    GLY  11           H        GLY  11   3.468   4.798   2.264
   60    HA2  GLY  11           2HA      GLY  11   4.726   4.913   4.215
   61    HA3  GLY  11           1HA      GLY  11   3.616   3.775   4.975
   62    H    CYS  12           H        CYS  12   4.346   2.596   1.966
   63    HA   CYS  12           HA       CYS  12   6.046   0.571   3.112
   64    HB2  CYS  12           2HB      CYS  12   4.982   0.874   0.296
   65    HB3  CYS  12           1HB      CYS  12   5.739  -0.562   0.970
   66    H    SER  13           H        SER  13   8.188   0.562   2.919
   67    HA   SER  13           HA       SER  13   9.530   2.598   1.424
   68    HB2  SER  13           2HB      SER  13  10.617   0.216   2.941
   69    HB3  SER  13           1HB      SER  13  11.570   1.583   2.359
   70    HG   SER  13           HG       SER  13   9.660   2.672   3.712
   71    H    HIS  14           H        HIS  14   8.495  -0.596   0.957
   72    HA   HIS  14           HA       HIS  14  10.109  -0.906  -1.471
   73    HB2  HIS  14           2HB      HIS  14   8.479  -2.885   0.107
   74    HB3  HIS  14           1HB      HIS  14   9.210  -3.290  -1.422
   75    HD1  HIS  14           1HD      HIS  14  11.814  -3.629  -1.427
   76    HD2  HIS  14           2HD      HIS  14  10.191  -2.821   2.311
   77    HE1  HIS  14           1HE      HIS  14  13.579  -4.234   0.215
   78    HE2  HIS  14           2HE      HIS  14  12.687  -3.423   2.409
   79    H    VAL  15           H        VAL  15   8.428  -2.538  -2.966
   80    HA   VAL  15           HA       VAL  15   6.613  -0.782  -4.121
   81    HB   VAL  15           HB       VAL  15   6.640  -3.826  -4.234
   82   HG11  VAL  15          1HG1      VAL  15   5.154  -1.892  -6.019
   83   HG12  VAL  15          2HG1      VAL  15   4.422  -2.994  -4.854
   84   HG13  VAL  15          3HG1      VAL  15   5.272  -3.636  -6.260
   85   HG21  VAL  15          3HG2      VAL  15   7.632  -1.776  -6.206
   86   HG22  VAL  15          1HG2      VAL  15   7.744  -3.522  -6.379
   87   HG23  VAL  15          2HG2      VAL  15   8.661  -2.689  -5.115
   88    H    CYS  16           H        CYS  16   4.545  -0.248  -3.688
   89    HA   CYS  16           HA       CYS  16   3.274  -1.500  -1.372
   90    HB2  CYS  16           2HB      CYS  16   3.528   1.056  -1.555
   91    HB3  CYS  16           1HB      CYS  16   2.405   0.930  -2.908
   92    H    ASN  17           H        ASN  17   1.418  -2.614  -1.641
   93    HA   ASN  17           HA       ASN  17   0.202  -2.697  -4.316
   94    HB2  ASN  17           2HB      ASN  17   1.430  -4.815  -3.859
   95    HB3  ASN  17           1HB      ASN  17   0.507  -5.004  -2.372
   96   HD21  ASN  17          1HD2      ASN  17  -0.427  -6.967  -3.004
   97   HD22  ASN  17          2HD2      ASN  17  -1.595  -7.048  -4.263
   98    H    ASP  18           H        ASP  18  -1.757  -1.877  -4.158
   99    HA   ASP  18           HA       ASP  18  -2.870  -1.552  -1.495
  100    HB2  ASP  18           2HB      ASP  18  -2.669   0.219  -3.434
  101    HB3  ASP  18           1HB      ASP  18  -4.191  -0.506  -3.944
  102    H    LEU  19           H        LEU  19  -4.646  -2.589  -0.804
  103    HA   LEU  19           HA       LEU  19  -5.963  -4.391  -2.713
  104    HB2  LEU  19           2HB      LEU  19  -5.747  -4.756   0.274
  105    HB3  LEU  19           1HB      LEU  19  -6.431  -5.872  -0.865
  106    HG   LEU  19           HG       LEU  19  -3.499  -5.165  -0.709
  107   HD11  LEU  19          1HD1      LEU  19  -4.225  -6.485   1.191
  108   HD12  LEU  19          2HD1      LEU  19  -3.218  -7.447   0.110
  109   HD13  LEU  19          3HD1      LEU  19  -4.969  -7.663   0.109
  110   HD21  LEU  19          3HD2      LEU  19  -4.948  -7.191  -2.422
  111   HD22  LEU  19          1HD2      LEU  19  -3.197  -7.015  -2.299
  112   HD23  LEU  19          2HD2      LEU  19  -4.166  -5.715  -2.989
  113    H    LYS  20           H        LYS  20  -8.263  -4.856  -2.036
  114    HA   LYS  20           HA       LYS  20  -9.796  -2.522  -1.930
  115    HB2  LYS  20           2HB      LYS  20 -10.683  -4.705  -2.684
  116    HB3  LYS  20           1HB      LYS  20 -10.606  -5.283  -1.025
  117    HG2  LYS  20           2HG      LYS  20 -12.237  -3.530  -0.380
  118    HG3  LYS  20           1HG      LYS  20 -12.368  -3.069  -2.075
  119    HD2  LYS  20           2HD      LYS  20 -14.214  -4.521  -1.479
  120    HD3  LYS  20           1HD      LYS  20 -13.139  -5.356  -2.600
  121    HE2  LYS  20           2HE      LYS  20 -12.092  -6.526  -0.694
  122    HE3  LYS  20           1HE      LYS  20 -13.200  -5.698   0.399
  123    HZ1  LYS  20           3HZ      LYS  20 -13.980  -7.553  -1.769
  124    HZ2  LYS  20           1HZ      LYS  20 -15.033  -6.838  -0.659
  125    HZ3  LYS  20           2HZ      LYS  20 -13.872  -7.953  -0.147
  126    H    ILE  21           H        ILE  21  -9.075  -4.813   0.614
  127    HA   ILE  21           HA       ILE  21  -9.705  -2.722   2.524
  128    HB   ILE  21           HB       ILE  21  -9.775  -4.503   4.259
  129   HG12  ILE  21          2HG1      ILE  21  -9.721  -6.463   1.964
  130   HG13  ILE  21          1HG1      ILE  21  -8.319  -6.110   2.971
  131   HG21  ILE  21          1HG2      ILE  21 -11.943  -5.466   3.603
  132   HG22  ILE  21          2HG2      ILE  21 -11.668  -4.921   1.948
  133   HG23  ILE  21          3HG2      ILE  21 -11.845  -3.741   3.245
  134   HD11  ILE  21          3HD1      ILE  21 -10.935  -7.216   3.914
  135   HD12  ILE  21          1HD1      ILE  21  -9.524  -6.852   4.903
  136   HD13  ILE  21          2HD1      ILE  21  -9.433  -8.137   3.681
  137    H    GLY  22           H        GLY  22  -8.157  -2.009   3.768
  138    HA2  GLY  22           2HA      GLY  22  -5.983  -1.355   4.252
  139    HA3  GLY  22           1HA      GLY  22  -5.663  -3.080   4.339
  140    H    TYR  23           H        TYR  23  -3.742  -3.210   3.393
  141    HA   TYR  23           HA       TYR  23  -3.449  -3.286   0.628
  142    HB2  TYR  23           2HB      TYR  23  -1.773  -1.481   0.340
  143    HB3  TYR  23           1HB      TYR  23  -3.312  -0.790   0.839
  144    HD1  TYR  23           2HD      TYR  23  -3.573  -0.104   3.270
  145    HD2  TYR  23           1HD      TYR  23   0.186  -1.131   1.581
  146    HE1  TYR  23           2HE      TYR  23  -2.441   1.031   5.123
  147    HE2  TYR  23           1HE      TYR  23   1.327  -0.004   3.423
  148    HH   TYR  23           HH       TYR  23   0.868   1.739   5.020
  149    H    GLU  24           H        GLU  24  -0.871  -3.585   0.286
  150    HA   GLU  24           HA       GLU  24   0.362  -4.622   2.688
  151    HB2  GLU  24           2HB      GLU  24   0.960  -6.753   1.529
  152    HB3  GLU  24           1HB      GLU  24  -0.752  -6.589   1.882
  153    HG2  GLU  24           2HG      GLU  24  -1.173  -5.975  -0.451
  154    HG3  GLU  24           1HG      GLU  24   0.558  -6.102  -0.767
  155    H    CYS  25           H        CYS  25   2.534  -4.397   2.694
  156    HA   CYS  25           HA       CYS  25   3.743  -3.059   0.422
  157    HB2  CYS  25           2HB      CYS  25   4.945  -3.792   3.110
  158    HB3  CYS  25           1HB      CYS  25   5.610  -2.683   1.919
  159    H    LEU  26           H        LEU  26   4.955  -4.173  -1.014
  160    HA   LEU  26           HA       LEU  26   5.684  -6.934  -0.301
  161    HB2  LEU  26           2HB      LEU  26   5.086  -5.819  -3.050
  162    HB3  LEU  26           1HB      LEU  26   5.490  -7.485  -2.682
  163    HG   LEU  26           HG       LEU  26   2.999  -6.010  -1.872
  164   HD11  LEU  26          1HD1      LEU  26   1.866  -7.567  -3.378
  165   HD12  LEU  26          2HD1      LEU  26   3.422  -8.261  -3.825
  166   HD13  LEU  26          3HD1      LEU  26   3.056  -6.583  -4.230
  167   HD21  LEU  26          3HD2      LEU  26   2.201  -8.183  -1.030
  168   HD22  LEU  26          1HD2      LEU  26   3.617  -7.617  -0.145
  169   HD23  LEU  26          2HD2      LEU  26   3.783  -8.883  -1.360
  170    HN1  NH2  27           1H       LEU  26   6.805  -5.524  -3.248
  171    HN2  NH2  27           2H       LEU  26   8.429  -5.247  -2.750