*HEADER    DE NOVO PROTEIN                         22-APR-16   2ND2              
*TITLE     SOLUTION STRUCTURE OF THE DE NOVO MINI PROTEIN HHH_06                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DE NOVO MINI PROTEIN HHH_06;                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ARTIFICIAL GENE;                                
*SOURCE   3 ORGANISM_TAXID: 32630;                                               
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR: PET15                                      
*KEYWDS    ENGINEERED PROTEIN, DE NOVO PROTEIN                                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.ELETSKY, C.D.BAHL, J.M.GILMORE, G.W.BUCHKO, D.BAKER                 
*REVDAT   1   21-SEP-16 2ND2    0                                                


assign (resid 3     and name HN   ) (resid 4     and name HA   )    5.78    5.78    0.00
assign (resid 1     and name HB*  ) (resid 4     and name HN   )    5.19    5.19    0.00
assign (resid 4     and name HN   ) (resid 6     and name HB2  )    5.78    5.78    0.00
assign (resid 4     and name HN   ) (resid 4     and name HB*  )    3.51    3.51    0.00
assign (resid 4     and name HN   ) (resid 5     and name HB*  )    5.78    5.78    0.00
assign (resid 4     and name HN   ) (resid 5     and name HN   )    3.72    3.72    0.00
assign (resid 5     and name HN   ) (resid 6     and name HB2  )    5.78    5.78    0.00
assign (resid 5     and name HN   ) (resid 6     and name HB1  )    5.78    5.78    0.00
assign (resid 5     and name HN   ) (resid 8     and name HG*  )    5.78    5.78    0.00
assign (resid 3     and name HB*  ) (resid 5     and name HN   )    5.78    5.78    0.00
assign (resid 6     and name HN   ) (resid 6     and name HG   )    4.74    4.74    0.00
assign (resid 4     and name HB*  ) (resid 6     and name HN   )    5.39    5.39    0.00
assign (resid 6     and name HN   ) (resid 8     and name HB*  )    5.78    5.78    0.00
assign (resid 6     and name HN   ) (resid 8     and name HG*  )    5.78    5.78    0.00
assign (resid 6     and name HN   ) (resid 7     and name HA   )    5.78    5.78    0.00
assign (resid 6     and name HN   ) (resid 7     and name HN   )    3.87    3.87    0.00
assign (resid 4     and name HN   ) (resid 6     and name HN   )    5.33    5.33    0.00
assign (resid 3     and name HN   ) (resid 5     and name HN   )    5.78    5.78    0.00
assign (resid 6     and name HD1* ) (resid 7     and name HN   )    5.06    5.06    0.00
assign (resid 6     and name HG   ) (resid 7     and name HN   )    5.39    5.39    0.00
assign (resid 7     and name HN   ) (resid 7     and name HB*  )    3.32    3.32    0.00
assign (resid 4     and name HB*  ) (resid 7     and name HN   )    5.78    5.78    0.00
assign (resid 7     and name HN   ) (resid 8     and name HB*  )    5.78    5.78    0.00
assign (resid 7     and name HN   ) (resid 8     and name HG*  )    5.78    5.78    0.00
assign (resid 7     and name HN   ) (resid 7     and name HE*  )    5.78    5.78    0.00
assign (resid 4     and name HA   ) (resid 7     and name HN   )    4.88    4.88    0.00
assign (resid 3     and name HA   ) (resid 7     and name HN   )    5.70    5.70    0.00
assign (resid 8     and name HN   ) (resid 10    and name HD1* )    5.78    5.78    0.00
assign (resid 7     and name HG2  ) (resid 8     and name HN   )    5.32    5.32    0.00
assign (resid 7     and name HG1  ) (resid 8     and name HN   )    5.32    5.32    0.00
assign (resid 7     and name HD*  ) (resid 8     and name HN   )    5.29    5.29    0.00
assign (resid 5     and name HB*  ) (resid 8     and name HN   )    5.69    5.69    0.00
assign (resid 7     and name HE*  ) (resid 8     and name HN   )    5.78    5.78    0.00
assign (resid 5     and name HA   ) (resid 8     and name HN   )    4.84    4.84    0.00
assign (resid 9     and name HN   ) (resid 9     and name HG2  )    4.66    4.66    0.00
assign (resid 9     and name HN   ) (resid 10    and name HD1* )    5.78    5.78    0.00
assign (resid 9     and name HN   ) (resid 9     and name HB1  )    3.63    3.63    0.00
assign (resid 8     and name HG*  ) (resid 9     and name HN   )    4.96    4.96    0.00
assign (resid 9     and name HN   ) (resid 9     and name HD*  )    5.18    5.18    0.00
assign (resid 7     and name HA   ) (resid 9     and name HN   )    5.78    5.78    0.00
assign (resid 10    and name HN   ) (resid 10    and name HB2  )    3.51    3.51    0.00
assign (resid 9     and name HN   ) (resid 10    and name HN   )    3.84    3.84    0.00
assign (resid 13    and name HN   ) (resid 13    and name HB2  )    3.96    3.96    0.00
assign (resid 13    and name HN   ) (resid 13    and name HB1  )    3.96    3.96    0.00
assign (resid 13    and name HD1* ) (resid 14    and name HN   )    5.78    5.78    0.00
assign (resid 13    and name HD2* ) (resid 14    and name HN   )    5.78    5.78    0.00
assign (resid 11    and name HB1  ) (resid 14    and name HN   )    5.78    5.78    0.00
assign (resid 12    and name HB1  ) (resid 14    and name HN   )    5.78    5.78    0.00
assign (resid 11    and name HB2  ) (resid 14    and name HN   )    5.78    5.78    0.00
assign (resid 12    and name HB2  ) (resid 14    and name HN   )    5.78    5.78    0.00
assign (resid 11    and name HA   ) (resid 14    and name HN   )    5.30    5.30    0.00
assign (resid 12    and name HA   ) (resid 14    and name HN   )    5.53    5.53    0.00
assign (resid 13    and name HN   ) (resid 14    and name HN   )    3.76    3.76    0.00
assign (resid 15    and name HN   ) (resid 15    and name HG2  )    4.30    4.30    0.00
assign (resid 15    and name HN   ) (resid 19    and name HB2  )    5.78    5.78    0.00
assign (resid 15    and name HB1  ) (resid 16    and name HN   )    4.36    4.36    0.00
assign (resid 18    and name HN   ) (resid 19    and name HB2  )    5.78    5.78    0.00
assign (resid 18    and name HN   ) (resid 19    and name HB1  )    5.78    5.78    0.00
assign (resid 19    and name HN   ) (resid 23    and name HD1* )    5.78    5.78    0.00
assign (resid 19    and name HN   ) (resid 20    and name HG2  )    5.78    5.78    0.00
assign (resid 19    and name HN   ) (resid 20    and name HG1  )    5.78    5.78    0.00
assign (resid 18    and name HG*  ) (resid 19    and name HN   )    4.65    4.65    0.00
assign (resid 15    and name HG2  ) (resid 19    and name HN   )    5.78    5.78    0.00
assign (resid 15    and name HG1  ) (resid 19    and name HN   )    5.78    5.78    0.00
assign (resid 19    and name HN   ) (resid 20    and name HA   )    5.78    5.78    0.00
assign (resid 16    and name HB2  ) (resid 19    and name HN   )    5.30    5.30    0.00
assign (resid 16    and name HB1  ) (resid 19    and name HN   )    4.87    4.87    0.00
assign (resid 17    and name HN   ) (resid 19    and name HN   )    5.67    5.67    0.00
assign (resid 20    and name HN   ) (resid 20    and name HG2  )    4.50    4.50    0.00
assign (resid 17    and name HG*  ) (resid 20    and name HN   )    5.78    5.78    0.00
assign (resid 16    and name HA   ) (resid 20    and name HN   )    5.78    5.78    0.00
assign (resid 16    and name HB1  ) (resid 20    and name HN   )    5.78    5.78    0.00
assign (resid 20    and name HN   ) (resid 20    and name HE   )    5.78    5.78    0.00
assign (resid 20    and name HG2  ) (resid 21    and name HN   )    5.24    5.24    0.00
assign (resid 20    and name HG1  ) (resid 21    and name HN   )    5.24    5.24    0.00
assign (resid 20    and name HD2  ) (resid 21    and name HN   )    5.78    5.78    0.00
assign (resid 20    and name HD1  ) (resid 21    and name HN   )    5.78    5.78    0.00
assign (resid 19    and name HB1  ) (resid 21    and name HN   )    5.78    5.78    0.00
assign (resid 22    and name HN   ) (resid 23    and name HD1* )    5.58    5.58    0.00
assign (resid 18    and name HG*  ) (resid 22    and name HN   )    5.73    5.73    0.00
assign (resid 21    and name HG2  ) (resid 22    and name HN   )    5.63    5.63    0.00
assign (resid 21    and name HG1  ) (resid 22    and name HN   )    5.63    5.63    0.00
assign (resid 22    and name HN   ) (resid 22    and name HD2  )    5.55    5.55    0.00
assign (resid 20    and name HA   ) (resid 22    and name HN   )    5.53    5.53    0.00
assign (resid 19    and name HA   ) (resid 22    and name HN   )    4.61    4.61    0.00
assign (resid 23    and name HN   ) (resid 23    and name HG   )    3.90    3.90    0.00
assign (resid 22    and name HB2  ) (resid 23    and name HN   )    4.14    4.14    0.00
assign (resid 22    and name HB1  ) (resid 23    and name HN   )    4.14    4.14    0.00
assign (resid 22    and name HD2  ) (resid 23    and name HN   )    5.78    5.78    0.00
assign (resid 22    and name HD1  ) (resid 23    and name HN   )    5.78    5.78    0.00
assign (resid 20    and name HB*  ) (resid 24    and name HN   )    5.71    5.71    0.00
assign (resid 24    and name HN   ) (resid 25    and name HB2  )    5.78    5.78    0.00
assign (resid 10    and name HG   ) (resid 24    and name HN   )    5.78    5.78    0.00
assign (resid 24    and name HN   ) (resid 25    and name HB1  )    5.78    5.78    0.00
assign (resid 24    and name HN   ) (resid 24    and name HB*  )    3.44    3.44    0.00
assign (resid 24    and name HN   ) (resid 24    and name HG2  )    4.60    4.60    0.00
assign (resid 24    and name HN   ) (resid 24    and name HG1  )    4.60    4.60    0.00
assign (resid 22    and name HN   ) (resid 24    and name HN   )    5.70    5.70    0.00
assign (resid 24    and name HN   ) (resid 26    and name HN   )    5.71    5.71    0.00
assign (resid 10    and name HD1* ) (resid 25    and name HN   )    5.78    5.78    0.00
assign (resid 25    and name HN   ) (resid 25    and name HD*  )    5.01    5.01    0.00
assign (resid 23    and name HB1  ) (resid 25    and name HN   )    5.34    5.34    0.00
assign (resid 24    and name HB*  ) (resid 25    and name HN   )    3.70    3.70    0.00
assign (resid 24    and name HG1  ) (resid 25    and name HN   )    5.55    5.55    0.00
assign (resid 25    and name HN   ) (resid 26    and name HG2  )    5.78    5.78    0.00
assign (resid 25    and name HN   ) (resid 26    and name HG1  )    5.78    5.78    0.00
assign (resid 25    and name HN   ) (resid 25    and name HE*  )    5.78    5.78    0.00
assign (resid 25    and name HN   ) (resid 28    and name HE*  )    5.78    5.78    0.00
assign (resid 25    and name HN   ) (resid 27    and name HB2  )    5.78    5.78    0.00
assign (resid 25    and name HN   ) (resid 26    and name HA   )    5.50    5.50    0.00
assign (resid 25    and name HN   ) (resid 26    and name HN   )    3.93    3.93    0.00
assign (resid 23    and name HD2* ) (resid 26    and name HN   )    5.78    5.78    0.00
assign (resid 26    and name HN   ) (resid 35    and name HB*  )    5.78    5.78    0.00
assign (resid 23    and name HB2  ) (resid 26    and name HN   )    5.60    5.60    0.00
assign (resid 25    and name HD*  ) (resid 26    and name HN   )    5.46    5.46    0.00
assign (resid 26    and name HN   ) (resid 27    and name HB2  )    5.78    5.78    0.00
assign (resid 26    and name HN   ) (resid 27    and name HB1  )    5.78    5.78    0.00
assign (resid 24    and name HA   ) (resid 26    and name HN   )    5.67    5.67    0.00
assign (resid 26    and name HN   ) (resid 27    and name HN   )    4.07    4.07    0.00
assign (resid 23    and name HD2* ) (resid 27    and name HN   )    5.78    5.78    0.00
assign (resid 23    and name HB2  ) (resid 27    and name HN   )    5.78    5.78    0.00
assign (resid 27    and name HN   ) (resid 28    and name HB*  )    5.78    5.78    0.00
assign (resid 26    and name HB2  ) (resid 27    and name HN   )    4.69    4.69    0.00
assign (resid 26    and name HG2  ) (resid 27    and name HN   )    5.78    5.78    0.00
assign (resid 26    and name HG1  ) (resid 27    and name HN   )    5.78    5.78    0.00
assign (resid 28    and name HN   ) (resid 28    and name HG2  )    4.86    4.86    0.00
assign (resid 28    and name HN   ) (resid 28    and name HG1  )    4.86    4.86    0.00
assign (resid 28    and name HN   ) (resid 29    and name HG2  )    5.78    5.78    0.00
assign (resid 28    and name HN   ) (resid 29    and name HG1  )    5.78    5.78    0.00
assign (resid 24    and name HA   ) (resid 28    and name HN   )    5.78    5.78    0.00
assign (resid 27    and name HN   ) (resid 28    and name HN   )    4.17    4.17    0.00
assign (resid 28    and name HG2  ) (resid 29    and name HN   )    5.78    5.78    0.00
assign (resid 28    and name HG1  ) (resid 29    and name HN   )    5.78    5.78    0.00
assign (resid 28    and name HD*  ) (resid 29    and name HN   )    5.78    5.78    0.00
assign (resid 29    and name HN   ) (resid 29    and name HB2  )    4.15    4.15    0.00
assign (resid 29    and name HN   ) (resid 29    and name HG1  )    4.43    4.43    0.00
assign (resid 25    and name HA   ) (resid 29    and name HN   )    5.78    5.78    0.00
assign (resid 28    and name HN   ) (resid 29    and name HN   )    3.55    3.55    0.00
assign (resid 29    and name HB2  ) (resid 30    and name HN   )    5.12    5.12    0.00
assign (resid 29    and name HB1  ) (resid 30    and name HN   )    5.12    5.12    0.00
assign (resid 29    and name HG2  ) (resid 30    and name HN   )    5.78    5.78    0.00
assign (resid 29    and name HG1  ) (resid 30    and name HN   )    5.78    5.78    0.00
assign (resid 29    and name HN   ) (resid 30    and name HN   )    3.81    3.81    0.00
assign (resid 30    and name HN   ) (resid 31    and name HN   )    4.79    4.79    0.00
assign (resid 26    and name HE*  ) (resid 31    and name HN   )    5.63    5.63    0.00
assign (resid 32    and name HN   ) (resid 33    and name HB*  )    5.78    5.78    0.00
assign (resid 32    and name HN   ) (resid 33    and name HG*  )    5.78    5.78    0.00
assign (resid 32    and name HN   ) (resid 34    and name HN   )    5.78    5.78    0.00
assign (resid 32    and name HN   ) (resid 35    and name HN   )    5.78    5.78    0.00
assign (resid 31    and name HN   ) (resid 32    and name HN   )    4.98    4.98    0.00
assign (resid 33    and name HN   ) (resid 35    and name HB*  )    5.78    5.78    0.00
assign (resid 33    and name HN   ) (resid 34    and name HB*  )    5.78    5.78    0.00
assign (resid 31    and name HA   ) (resid 33    and name HN   )    5.53    5.53    0.00
assign (resid 31    and name HG2* ) (resid 34    and name HN   )    5.78    5.78    0.00
assign (resid 34    and name HN   ) (resid 35    and name HB*  )    5.63    5.63    0.00
assign (resid 33    and name HB*  ) (resid 34    and name HN   )    3.82    3.82    0.00
assign (resid 33    and name HG*  ) (resid 34    and name HN   )    4.82    4.82    0.00
assign (resid 23    and name HD2* ) (resid 35    and name HN   )    5.78    5.78    0.00
assign (resid 35    and name HN   ) (resid 36    and name HB*  )    5.33    5.33    0.00
assign (resid 34    and name HB*  ) (resid 35    and name HN   )    3.94    3.94    0.00
assign (resid 33    and name HA   ) (resid 35    and name HN   )    5.78    5.78    0.00
assign (resid 34    and name HB*  ) (resid 36    and name HN   )    5.40    5.40    0.00
assign (resid 9     and name HD*  ) (resid 10    and name HN   )    5.78    5.78    0.00
assign (resid 32    and name HA   ) (resid 36    and name HN   )    5.78    5.78    0.00
assign (resid 35    and name HN   ) (resid 36    and name HN   )    3.89    3.89    0.00
assign (resid 23    and name HD2* ) (resid 37    and name HN   )    5.78    5.78    0.00
assign (resid 37    and name HN   ) (resid 37    and name HG1  )    4.85    4.85    0.00
assign (resid 37    and name HN   ) (resid 37    and name HB*  )    3.28    3.28    0.00
assign (resid 34    and name HB*  ) (resid 37    and name HN   )    5.30    5.30    0.00
assign (resid 37    and name HN   ) (resid 37    and name HD*  )    5.18    5.18    0.00
assign (resid 33    and name HA   ) (resid 37    and name HN   )    5.39    5.39    0.00
assign (resid 35    and name HB*  ) (resid 38    and name HN   )    5.45    5.45    0.00
assign (resid 38    and name HN   ) (resid 39    and name HB*  )    5.72    5.72    0.00
assign (resid 37    and name HG2  ) (resid 38    and name HN   )    5.78    5.78    0.00
assign (resid 37    and name HG1  ) (resid 38    and name HN   )    5.78    5.78    0.00
assign (resid 38    and name HN   ) (resid 38    and name HB*  )    3.31    3.31    0.00
assign (resid 38    and name HN   ) (resid 38    and name HG2  )    4.36    4.36    0.00
assign (resid 37    and name HD*  ) (resid 38    and name HN   )    5.59    5.59    0.00
assign (resid 36    and name HA   ) (resid 38    and name HN   )    5.50    5.50    0.00
assign (resid 35    and name HA   ) (resid 38    and name HN   )    4.47    4.47    0.00
assign (resid 34    and name HA   ) (resid 38    and name HN   )    5.78    5.78    0.00
assign (resid 37    and name HN   ) (resid 38    and name HN   )    3.73    3.73    0.00
assign (resid 39    and name HN   ) (resid 39    and name HB*  )    3.26    3.26    0.00
assign (resid 37    and name HB*  ) (resid 39    and name HN   )    5.39    5.39    0.00
assign (resid 39    and name HN   ) (resid 40    and name HB*  )    5.78    5.78    0.00
assign (resid 38    and name HG2  ) (resid 39    and name HN   )    5.67    5.67    0.00
assign (resid 38    and name HG1  ) (resid 39    and name HN   )    5.67    5.67    0.00
assign (resid 39    and name HN   ) (resid 40    and name HD*  )    5.78    5.78    0.00
assign (resid 36    and name HA   ) (resid 39    and name HN   )    4.83    4.83    0.00
assign (resid 38    and name HN   ) (resid 39    and name HN   )    3.85    3.85    0.00
assign (resid 23    and name HD1* ) (resid 40    and name HN   )    5.78    5.78    0.00
assign (resid 23    and name HD2* ) (resid 40    and name HN   )    5.78    5.78    0.00
assign (resid 40    and name HN   ) (resid 40    and name HB*  )    3.45    3.45    0.00
assign (resid 38    and name HB*  ) (resid 40    and name HN   )    5.50    5.50    0.00
assign (resid 40    and name HN   ) (resid 40    and name HD*  )    5.09    5.09    0.00
assign (resid 40    and name HN   ) (resid 41    and name HN   )    4.05    4.05    0.00
assign (resid 23    and name HD1* ) (resid 41    and name HN   )    5.78    5.78    0.00
assign (resid 40    and name HG2  ) (resid 41    and name HN   )    5.68    5.68    0.00
assign (resid 40    and name HG1  ) (resid 41    and name HN   )    5.68    5.68    0.00
assign (resid 41    and name HN   ) (resid 41    and name HB2  )    4.28    4.28    0.00
assign (resid 41    and name HN   ) (resid 41    and name HB1  )    4.28    4.28    0.00
assign (resid 40    and name HD*  ) (resid 41    and name HN   )    5.78    5.78    0.00
assign (resid 41    and name HN   ) (resid 42    and name HB1  )    5.78    5.78    0.00
assign (resid 37    and name HA   ) (resid 41    and name HN   )    5.71    5.71    0.00
assign (resid 39    and name HA   ) (resid 41    and name HN   )    5.78    5.78    0.00
assign (resid 23    and name HD1* ) (resid 42    and name HN   )    5.39    5.39    0.00
assign (resid 39    and name HB*  ) (resid 42    and name HN   )    5.55    5.55    0.00
assign (resid 38    and name HB*  ) (resid 42    and name HN   )    5.48    5.48    0.00
assign (resid 41    and name HB1  ) (resid 42    and name HN   )    5.13    5.13    0.00
assign (resid 39    and name HA   ) (resid 42    and name HN   )    4.88    4.88    0.00
assign (resid 40    and name HA   ) (resid 42    and name HN   )    5.61    5.61    0.00
assign (resid 38    and name HA   ) (resid 42    and name HN   )    5.78    5.78    0.00
assign (resid 42    and name HN   ) (resid 43    and name HN   )    4.18    4.18    0.00
assign (resid 43    and name HN   ) (resid 43    and name HB1  )    3.98    3.98    0.00
assign (resid 43    and name HN   ) (resid 43    and name HG1  )    4.79    4.79    0.00
assign (resid 42    and name HB2  ) (resid 43    and name HN   )    5.05    5.05    0.00
assign (resid 43    and name HB1  ) (resid 44    and name HN   )    4.83    4.83    0.00
assign (resid 43    and name HB2  ) (resid 44    and name HN   )    4.78    4.78    0.00
assign (resid 43    and name HG1  ) (resid 44    and name HN   )    5.78    5.78    0.00
assign (resid 42    and name HB1  ) (resid 44    and name HN   )    5.78    5.78    0.00
assign (resid 43    and name HN   ) (resid 44    and name HN   )    4.20    4.20    0.00
assign (resid 8     and name HN   ) (resid 10    and name HN   )    5.48    5.48    0.00
assign (resid 12    and name HN   ) (resid 12    and name HB2  )    3.70    3.70    0.00
assign (resid 8     and name HG*  ) (resid 11    and name HN   )    5.78    5.78    0.00
assign (resid 17    and name HB2  ) (resid 21    and name HE22 )    5.78    5.78    0.00
assign (resid 17    and name HB1  ) (resid 21    and name HE22 )    5.78    5.78    0.00
assign (resid 21    and name HB1  ) (resid 21    and name HE21 )    5.78    5.78    0.00
assign (resid 18    and name HA   ) (resid 21    and name HE21 )    5.78    5.78    0.00
assign (resid 26    and name HB2  ) (resid 28    and name HN   )    5.78    5.78    0.00
assign (resid 26    and name HB1  ) (resid 28    and name HN   )    5.78    5.78    0.00
assign (resid 27    and name HB1  ) (resid 29    and name HN   )    5.78    5.78    0.00
assign (resid 30    and name HN   ) (resid 31    and name HG2* )    5.78    5.78    0.00
assign (resid 30    and name HN   ) (resid 31    and name HA   )    5.78    5.78    0.00
assign (resid 30    and name HA*  ) (resid 32    and name HN   )    5.78    5.78    0.00
assign (resid 36    and name HG2  ) (resid 38    and name HN   )    5.78    5.78    0.00
assign (resid 36    and name HG1  ) (resid 38    and name HN   )    5.78    5.78    0.00
assign (resid 15    and name HE*  ) (resid 41    and name HN   )    5.78    5.78    0.00
assign (resid 38    and name HE*  ) (resid 41    and name HN   )    5.78    5.78    0.00
assign (resid 38    and name HB*  ) (resid 41    and name HN   )    5.78    5.78    0.00
assign (resid 37    and name HB*  ) (resid 41    and name HD22 )    5.78    5.78    0.00
assign (resid 40    and name HB*  ) (resid 41    and name HD22 )    5.78    5.78    0.00
assign (resid 38    and name HE*  ) (resid 41    and name HD22 )    5.78    5.78    0.00
assign (resid 37    and name HB*  ) (resid 41    and name HD21 )    5.78    5.78    0.00
assign (resid 40    and name HB*  ) (resid 41    and name HD21 )    5.78    5.78    0.00
assign (resid 38    and name HE*  ) (resid 41    and name HD21 )    5.78    5.78    0.00
assign (resid 37    and name HD*  ) (resid 41    and name HD21 )    5.78    5.78    0.00
assign (resid 40    and name HD*  ) (resid 41    and name HD21 )    5.78    5.78    0.00
assign (resid 40    and name HA   ) (resid 43    and name HN   )    5.78    5.78    0.00
assign (resid 42    and name HB2  ) (resid 44    and name HN   )    5.78    5.78    0.00
assign (resid 9     and name HB1  ) (resid 9     and name HE   )    5.69    5.69    0.00
assign (resid 22    and name HB2  ) (resid 22    and name HE   )    5.78    5.78    0.00
assign (resid 22    and name HB1  ) (resid 22    and name HE   )    5.70    5.70    0.00
assign (resid 18    and name HG*  ) (resid 22    and name HE   )    5.78    5.78    0.00
assign (resid 20    and name HB*  ) (resid 20    and name HE   )    5.04    5.04    0.00
assign (resid 18    and name HA   ) (resid 20    and name HE   )    5.78    5.78    0.00
assign (resid 20    and name HE   ) (resid 21    and name HA   )    5.78    5.78    0.00
assign (resid 40    and name HB*  ) (resid 40    and name HE   )    5.72    5.72    0.00
assign (resid 37    and name HB*  ) (resid 37    and name HE   )    5.46    5.46    0.00
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assign (resid 3     and name HN   ) (resid 6     and name HN   )    5.78    5.78    0.00
assign (resid 3     and name HN   ) (resid 7     and name HN   )    5.78    5.78    0.00
assign (resid 9     and name HN   ) (resid 9     and name HE   )    5.78    5.78    0.00
assign (resid 16    and name HN   ) (resid 23    and name HD1* )    5.78    5.78    0.00
assign (resid 17    and name HN   ) (resid 19    and name HB2  )    5.78    5.78    0.00
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assign (resid 17    and name HN   ) (resid 17    and name HB1  )    3.63    3.63    0.00
assign (resid 17    and name HN   ) (resid 17    and name HG*  )    3.99    3.99    0.00
assign (resid 18    and name HN   ) (resid 18    and name HB2  )    3.68    3.68    0.00
assign (resid 17    and name HB2  ) (resid 18    and name HN   )    3.93    3.93    0.00
assign (resid 17    and name HB1  ) (resid 18    and name HN   )    3.93    3.93    0.00
assign (resid 18    and name HN   ) (resid 18    and name HB1  )    3.87    3.87    0.00
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assign (resid 10    and name HD1* ) (resid 24    and name HN   )    4.27    4.27    0.00
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assign (resid 6     and name HN   ) (resid 6     and name HD2* )    4.96    4.96    0.00
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assign (resid 7     and name HN   ) (resid 10    and name HD1* )    5.78    5.78    0.00
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assign (resid 35    and name HN   ) (resid 35    and name HB*  )    3.24    3.24    0.00
assign (resid 35    and name HB*  ) (resid 36    and name HN   )    3.48    3.48    0.00
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assign (resid 23    and name HN   ) (resid 23    and name HB1  )    3.46    3.46    0.00
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assign (resid 36    and name HN   ) (resid 36    and name HB*  )    3.15    3.15    0.00
assign (resid 4     and name HN   ) (resid 4     and name HG1  )    4.84    4.84    0.00
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assign (resid 4     and name HB*  ) (resid 5     and name HN   )    3.89    3.89    0.00
assign (resid 9     and name HN   ) (resid 9     and name HB2  )    3.66    3.66    0.00
assign (resid 28    and name HN   ) (resid 28    and name HB*  )    3.28    3.28    0.00
assign (resid 15    and name HE*  ) (resid 42    and name HN   )    5.78    5.78    0.00
assign (resid 28    and name HB*  ) (resid 29    and name HN   )    3.86    3.86    0.00
assign (resid 38    and name HB*  ) (resid 39    and name HN   )    3.52    3.52    0.00
assign (resid 26    and name HN   ) (resid 26    and name HB2  )    3.82    3.82    0.00
assign (resid 37    and name HB*  ) (resid 38    and name HN   )    3.41    3.41    0.00
assign (resid 27    and name HN   ) (resid 27    and name HB1  )    3.96    3.96    0.00
assign (resid 27    and name HN   ) (resid 27    and name HB2  )    3.77    3.77    0.00
assign (resid 34    and name HN   ) (resid 34    and name HB*  )    3.30    3.30    0.00
assign (resid 3     and name HB*  ) (resid 4     and name HN   )    4.25    4.25    0.00
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assign (resid 19    and name HA   ) (resid 23    and name HN   )    4.64    4.64    0.00
assign (resid 19    and name HA   ) (resid 21    and name HN   )    5.09    5.09    0.00
assign (resid 17    and name HA   ) (resid 21    and name HN   )    5.70    5.70    0.00
assign (resid 5     and name HA   ) (resid 9     and name HN   )    4.69    4.69    0.00
assign (resid 25    and name HA   ) (resid 28    and name HN   )    4.38    4.38    0.00
assign (resid 23    and name HA   ) (resid 27    and name HN   )    4.90    4.90    0.00
assign (resid 25    and name HA   ) (resid 27    and name HN   )    5.19    5.19    0.00
assign (resid 3     and name HA   ) (resid 6     and name HN   )    4.39    4.39    0.00
assign (resid 34    and name HA   ) (resid 37    and name HN   )    4.83    4.83    0.00
assign (resid 8     and name HA   ) (resid 11    and name HN   )    4.07    4.07    0.00
assign (resid 37    and name HA   ) (resid 40    and name HN   )    4.33    4.33    0.00
assign (resid 1     and name HB*  ) (resid 3     and name HN   )    5.12    5.12    0.00
assign (resid 15    and name HG2  ) (resid 16    and name HN   )    4.90    4.90    0.00
assign (resid 15    and name HG1  ) (resid 16    and name HN   )    4.90    4.90    0.00
assign (resid 15    and name HB2  ) (resid 16    and name HN   )    4.36    4.36    0.00
assign (resid 3     and name HN   ) (resid 3     and name HB*  )    3.79    3.79    0.00
assign (resid 16    and name HN   ) (resid 19    and name HB1  )    4.50    4.50    0.00
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assign (resid 19    and name HB2  ) (resid 20    and name HN   )    3.90    3.90    0.00
assign (resid 19    and name HB1  ) (resid 20    and name HN   )    4.05    4.05    0.00
assign (resid 16    and name HB2  ) (resid 17    and name HN   )    4.25    4.25    0.00
assign (resid 16    and name HB1  ) (resid 17    and name HN   )    3.40    3.40    0.00
assign (resid 15    and name HA   ) (resid 16    and name HN   )    3.00    3.00    0.00
assign (resid 16    and name HN   ) (resid 16    and name HB1  )    4.23    4.23    0.00
assign (resid 16    and name HN   ) (resid 16    and name HB2  )    3.54    3.54    0.00
assign (resid 16    and name HB2  ) (resid 18    and name HN   )    4.55    4.55    0.00
assign (resid 16    and name HB1  ) (resid 18    and name HN   )    3.91    3.91    0.00
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assign (resid 31    and name HB   ) (resid 32    and name HN   )    3.89    3.89    0.00
assign (resid 32    and name HN   ) (resid 32    and name HB1  )    4.23    4.23    0.00
assign (resid 32    and name HN   ) (resid 32    and name HB2  )    4.23    4.23    0.00
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assign (resid 12    and name HN   ) (resid 12    and name HB1  )    3.70    3.70    0.00
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assign (resid 25    and name HN   ) (resid 25    and name HB1  )    3.49    3.49    0.00
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assign (resid 7     and name HB*  ) (resid 8     and name HN   )    3.57    3.57    0.00
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assign (resid 39    and name HB*  ) (resid 41    and name HN   )    4.96    4.96    0.00
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assign (resid 19    and name HB1  ) (resid 23    and name HD1* )    4.69    4.69    0.00
assign (resid 3     and name HB*  ) (resid 6     and name HD1* )    5.78    5.78    0.00
assign (resid 9     and name HD*  ) (resid 10    and name HD2* )    5.24    5.24    0.00
assign (resid 30    and name HA*  ) (resid 31    and name HG2* )    4.53    4.53    0.00
assign (resid 12    and name HA   ) (resid 12    and name HG2  )    4.30    4.30    0.00
assign (resid 12    and name HA   ) (resid 12    and name HG1  )    4.30    4.30    0.00
assign (resid 12    and name HA   ) (resid 12    and name HD*  )    4.20    4.20    0.00
assign (resid 19    and name HA   ) (resid 22    and name HD2  )    4.79    4.79    0.00
assign (resid 19    and name HA   ) (resid 22    and name HD1  )    4.79    4.79    0.00
assign (resid 40    and name HA   ) (resid 40    and name HD*  )    4.49    4.49    0.00
assign (resid 9     and name HA   ) (resid 9     and name HD*  )    4.09    4.09    0.00
assign (resid 24    and name HA   ) (resid 27    and name HB2  )    4.20    4.20    0.00
assign (resid 19    and name HB1  ) (resid 20    and name HA   )    4.57    4.57    0.00
assign (resid 24    and name HA   ) (resid 27    and name HB1  )    4.97    4.97    0.00
assign (resid 20    and name HA   ) (resid 20    and name HD1  )    5.44    5.44    0.00
assign (resid 3     and name HB*  ) (resid 24    and name HA   )    5.70    5.70    0.00
assign (resid 38    and name HA   ) (resid 38    and name HE*  )    4.21    4.21    0.00
assign (resid 37    and name HB*  ) (resid 37    and name HD*  )    3.54    3.54    0.00
assign (resid 40    and name HB*  ) (resid 40    and name HD*  )    3.57    3.57    0.00
assign (resid 22    and name HB1  ) (resid 22    and name HD1  )    4.25    4.25    0.00
assign (resid 22    and name HB1  ) (resid 22    and name HD2  )    4.25    4.25    0.00
assign (resid 9     and name HB1  ) (resid 9     and name HD*  )    3.91    3.91    0.00
assign (resid 7     and name HG2  ) (resid 7     and name HE*  )    4.40    4.40    0.00
assign (resid 7     and name HG1  ) (resid 7     and name HE*  )    4.40    4.40    0.00
assign (resid 7     and name HB*  ) (resid 7     and name HE*  )    4.23    4.23    0.00
assign (resid 28    and name HB*  ) (resid 28    and name HE*  )    4.76    4.76    0.00
assign (resid 24    and name HB*  ) (resid 28    and name HE*  )    4.98    4.98    0.00
assign (resid 23    and name HD1* ) (resid 38    and name HB*  )    3.94    3.94    0.00
assign (resid 10    and name HD1* ) (resid 24    and name HB*  )    4.38    4.38    0.00
assign (resid 23    and name HD2* ) (resid 38    and name HB*  )    4.88    4.88    0.00
assign (resid 10    and name HB2  ) (resid 10    and name HD2* )    3.93    3.93    0.00
assign (resid 10    and name HB2  ) (resid 10    and name HD1* )    3.74    3.74    0.00
assign (resid 23    and name HD1* ) (resid 39    and name HB*  )    3.78    3.78    0.00
assign (resid 23    and name HD2* ) (resid 39    and name HB*  )    3.76    3.76    0.00
assign (resid 10    and name HD2* ) (resid 23    and name HB2  )    3.75    3.75    0.00
assign (resid 10    and name HD1* ) (resid 23    and name HB2  )    4.19    4.19    0.00
assign (resid 28    and name HB*  ) (resid 28    and name HD*  )    4.14    4.14    0.00
assign (resid 7     and name HB*  ) (resid 7     and name HD*  )    3.13    3.13    0.00
assign (resid 15    and name HB2  ) (resid 19    and name HB2  )    5.10    5.10    0.00
assign (resid 15    and name HB1  ) (resid 19    and name HB2  )    5.10    5.10    0.00
assign (resid 5     and name HA   ) (resid 5     and name HB*  )    3.14    3.14    0.00
assign (resid 26    and name HA   ) (resid 26    and name HG1  )    4.30    4.30    0.00
assign (resid 21    and name HA   ) (resid 21    and name HG2  )    4.42    4.42    0.00
assign (resid 23    and name HA   ) (resid 26    and name HG2  )    4.97    4.97    0.00
assign (resid 33    and name HA   ) (resid 33    and name HG*  )    3.39    3.39    0.00
assign (resid 36    and name HA   ) (resid 36    and name HG1  )    4.34    4.34    0.00
assign (resid 17    and name HA   ) (resid 17    and name HG*  )    3.98    3.98    0.00
assign (resid 4     and name HA   ) (resid 4     and name HG2  )    3.92    3.92    0.00
assign (resid 37    and name HA   ) (resid 37    and name HD*  )    4.42    4.42    0.00
assign (resid 39    and name HA   ) (resid 42    and name HB2  )    4.80    4.80    0.00
assign (resid 37    and name HA   ) (resid 40    and name HD*  )    4.45    4.45    0.00
assign (resid 20    and name HA   ) (resid 20    and name HD2  )    5.44    5.44    0.00
assign (resid 39    and name HA   ) (resid 42    and name HB1  )    4.80    4.80    0.00
assign (resid 34    and name HB*  ) (resid 37    and name HB*  )    4.87    4.87    0.00
assign (resid 31    and name HA   ) (resid 31    and name HG2* )    3.60    3.60    0.00
assign (resid 26    and name HA   ) (resid 35    and name HB*  )    5.78    5.78    0.00
assign (resid 39    and name HB*  ) (resid 40    and name HA   )    5.78    5.78    0.00
assign (resid 37    and name HA   ) (resid 39    and name HB*  )    5.02    5.02    0.00
assign (resid 12    and name HD*  ) (resid 13    and name HA   )    4.82    4.82    0.00
assign (resid 7     and name HA   ) (resid 7     and name HD*  )    4.54    4.54    0.00
assign (resid 1     and name HB*  ) (resid 2     and name HD2  )    3.90    3.90    0.00
assign (resid 9     and name HA   ) (resid 9     and name HG2  )    4.22    4.22    0.00
assign (resid 3     and name HA   ) (resid 6     and name HB1  )    4.51    4.51    0.00
assign (resid 3     and name HA   ) (resid 6     and name HB2  )    4.47    4.47    0.00
assign (resid 10    and name HN   ) (resid 10    and name HB1  )    4.04    4.04    0.00
assign (resid 7     and name HN   ) (resid 7     and name HD*  )    4.92    4.92    0.00
assign (resid 28    and name HN   ) (resid 28    and name HD*  )    5.19    5.19    0.00
assign (resid 5     and name HB*  ) (resid 6     and name HN   )    3.52    3.52    0.00
assign (resid 5     and name HN   ) (resid 5     and name HB*  )    3.45    3.45    0.00
assign (resid 31    and name HN   ) (resid 34    and name HB*  )    3.52    3.52    0.00
assign (resid 42    and name HN   ) (resid 42    and name HB1  )    3.73    3.73    0.00
assign (resid 42    and name HB1  ) (resid 43    and name HN   )    5.05    5.05    0.00
assign (resid 41    and name HN   ) (resid 42    and name HB2  )    5.78    5.78    0.00
assign (resid 8     and name HN   ) (resid 8     and name HG*  )    3.46    3.46    0.00
assign (resid 33    and name HN   ) (resid 33    and name HG*  )    3.87    3.87    0.00
assign (resid 36    and name HN   ) (resid 36    and name HG1  )    4.24    4.24    0.00
assign (resid 43    and name HN   ) (resid 43    and name HG2  )    4.79    4.79    0.00
assign (resid 4     and name HN   ) (resid 4     and name HG2  )    4.84    4.84    0.00
assign (resid 36    and name HN   ) (resid 36    and name HG2  )    4.24    4.24    0.00
assign (resid 9     and name HB2  ) (resid 10    and name HN   )    4.49    4.49    0.00
assign (resid 21    and name HN   ) (resid 21    and name HB1  )    3.79    3.79    0.00
assign (resid 26    and name HB1  ) (resid 27    and name HN   )    4.69    4.69    0.00
assign (resid 13    and name HN   ) (resid 13    and name HG   )    4.48    4.48    0.00
assign (resid 24    and name HG2  ) (resid 25    and name HN   )    5.55    5.55    0.00
assign (resid 8     and name HB*  ) (resid 9     and name HN   )    3.74    3.74    0.00
assign (resid 26    and name HN   ) (resid 26    and name HB1  )    3.82    3.82    0.00
assign (resid 29    and name HN   ) (resid 29    and name HB1  )    4.15    4.15    0.00
assign (resid 35    and name HN   ) (resid 37    and name HB*  )    5.78    5.78    0.00
assign (resid 12    and name HN   ) (resid 12    and name HG1  )    5.06    5.06    0.00
assign (resid 11    and name HN   ) (resid 11    and name HD*  )    5.10    5.10    0.00
assign (resid 12    and name HD*  ) (resid 13    and name HN   )    5.67    5.67    0.00
assign (resid 23    and name HN   ) (resid 23    and name HD1* )    3.66    3.66    0.00
assign (resid 10    and name HN   ) (resid 10    and name HD2* )    3.75    3.75    0.00
assign (resid 23    and name HB2  ) (resid 23    and name HD2* )    3.57    3.57    0.00
assign (resid 6     and name HB2  ) (resid 6     and name HD2* )    3.90    3.90    0.00
assign (resid 10    and name HB1  ) (resid 10    and name HD1* )    3.73    3.73    0.00
assign (resid 10    and name HD2* ) (resid 15    and name HE*  )    3.55    3.55    0.00
assign (resid 10    and name HB1  ) (resid 10    and name HD2* )    3.79    3.79    0.00
assign (resid 6     and name HB2  ) (resid 6     and name HD1* )    3.90    3.90    0.00
assign (resid 15    and name HE*  ) (resid 23    and name HD1* )    3.51    3.51    0.00
assign (resid 23    and name HB1  ) (resid 23    and name HD1* )    3.97    3.97    0.00
assign (resid 15    and name HE*  ) (resid 23    and name HD2* )    4.50    4.50    0.00
assign (resid 6     and name HA   ) (resid 6     and name HD2* )    4.25    4.25    0.00
assign (resid 23    and name HD1* ) (resid 39    and name HA   )    3.52    3.52    0.00
assign (resid 3     and name HA   ) (resid 6     and name HD1* )    5.41    5.41    0.00
assign (resid 3     and name HA   ) (resid 6     and name HD2* )    5.41    5.41    0.00
assign (resid 6     and name HD2* ) (resid 24    and name HA   )    5.06    5.06    0.00
assign (resid 10    and name HD1* ) (resid 20    and name HA   )    3.54    3.54    0.00
assign (resid 10    and name HA   ) (resid 10    and name HD1* )    4.60    4.60    0.00
assign (resid 24    and name HN   ) (resid 25    and name HN   )    3.55    3.55    0.00
assign (resid 23    and name HN   ) (resid 25    and name HN   )    4.62    4.62    0.00
assign (resid 39    and name HN   ) (resid 40    and name HN   )    3.50    3.50    0.00
assign (resid 35    and name HN   ) (resid 37    and name HN   )    4.82    4.82    0.00
assign (resid 37    and name HN   ) (resid 39    and name HN   )    5.23    5.23    0.00
assign (resid 5     and name HN   ) (resid 6     and name HN   )    3.46    3.46    0.00
assign (resid 7     and name HN   ) (resid 8     and name HN   )    3.30    3.30    0.00
assign (resid 8     and name HN   ) (resid 9     and name HN   )    3.50    3.50    0.00
assign (resid 15    and name HA   ) (resid 16    and name HB2  )    5.53    5.53    0.00
assign (resid 1     and name HA   ) (resid 2     and name HD2  )    3.46    3.46    0.00
assign (resid 1     and name HA   ) (resid 2     and name HD1  )    3.46    3.46    0.00
assign (resid 38    and name HG1  ) (resid 38    and name HE*  )    4.37    4.37    0.00
assign (resid 38    and name HG2  ) (resid 38    and name HE*  )    4.37    4.37    0.00
assign (resid 33    and name HB*  ) (resid 34    and name HB*  )    5.00    5.00    0.00
assign (resid 18    and name HA   ) (resid 21    and name HB2  )    3.63    3.63    0.00
assign (resid 4     and name HB*  ) (resid 5     and name HA   )    4.63    4.63    0.00
assign (resid 5     and name HA   ) (resid 8     and name HB*  )    4.79    4.79    0.00
assign (resid 34    and name HA   ) (resid 37    and name HB*  )    4.48    4.48    0.00
assign (resid 3     and name HB*  ) (resid 6     and name HD2* )    5.78    5.78    0.00
assign (resid 19    and name HB2  ) (resid 23    and name HD1* )    5.10    5.10    0.00
assign (resid 15    and name HB1  ) (resid 19    and name HB1  )    5.06    5.06    0.00
assign (resid 15    and name HE*  ) (resid 19    and name HB1  )    5.66    5.66    0.00
assign (resid 15    and name HB2  ) (resid 19    and name HB1  )    5.06    5.06    0.00
assign (resid 6     and name HD2* ) (resid 27    and name HB1  )    5.78    5.78    0.00
assign (resid 6     and name HD1* ) (resid 27    and name HB1  )    5.78    5.78    0.00
assign (resid 17    and name HA   ) (resid 20    and name HD2  )    5.18    5.18    0.00
assign (resid 17    and name HA   ) (resid 20    and name HD1  )    5.18    5.18    0.00
assign (resid 17    and name HA   ) (resid 20    and name HG1  )    4.80    4.80    0.00
assign (resid 17    and name HA   ) (resid 20    and name HG2  )    4.80    4.80    0.00
assign (resid 16    and name HA   ) (resid 17    and name HA   )    4.84    4.84    0.00
assign (resid 17    and name HA   ) (resid 20    and name HE   )    5.42    5.42    0.00
assign (resid 1     and name HA   ) (resid 4     and name HB*  )    5.78    5.78    0.00
assign (resid 15    and name HN   ) (resid 15    and name HE*  )    4.56    4.56    0.00
assign (resid 38    and name HN   ) (resid 38    and name HE*  )    3.95    3.95    0.00
assign (resid 17    and name HG*  ) (resid 18    and name HN   )    5.34    5.34    0.00
assign (resid 29    and name HN   ) (resid 29    and name HG2  )    4.43    4.43    0.00
assign (resid 17    and name HG*  ) (resid 21    and name HE22 )    4.98    4.98    0.00
assign (resid 15    and name HG1  ) (resid 20    and name HN   )    5.78    5.78    0.00
assign (resid 15    and name HG2  ) (resid 20    and name HN   )    5.78    5.78    0.00
assign (resid 18    and name HB1  ) (resid 20    and name HN   )    5.74    5.74    0.00
assign (resid 16    and name HN   ) (resid 20    and name HN   )    5.66    5.66    0.00
assign (resid 10    and name HD1* ) (resid 20    and name HN   )    5.78    5.78    0.00
assign (resid 20    and name HN   ) (resid 23    and name HD1* )    5.78    5.78    0.00
assign (resid 31    and name HG2* ) (resid 33    and name HN   )    4.89    4.89    0.00
assign (resid 31    and name HG2* ) (resid 32    and name HN   )    4.46    4.46    0.00
assign (resid 32    and name HN   ) (resid 35    and name HB*  )    5.32    5.32    0.00
assign (resid 15    and name HE*  ) (resid 20    and name HA   )    4.55    4.55    0.00
assign (resid 6     and name HA   ) (resid 6     and name HG   )    3.96    3.96    0.00
assign (resid 15    and name HG2  ) (resid 19    and name HB2  )    5.78    5.78    0.00
assign (resid 15    and name HG1  ) (resid 19    and name HB2  )    5.78    5.78    0.00
assign (resid 25    and name HA   ) (resid 28    and name HE*  )    4.60    4.60    0.00
assign (resid 22    and name HN   ) (resid 22    and name HD1  )    5.55    5.55    0.00
assign (resid 1     and name HB*  ) (resid 5     and name HN   )    5.22    5.22    0.00
assign (resid 27    and name HA   ) (resid 35    and name HB*  )    4.57    4.57    0.00
assign (resid 1     and name HA   ) (resid 2     and name HG*  )    5.19    5.19    0.00
assign (resid 1     and name HA   ) (resid 2     and name HD*  )    2.94    2.94    0.00
assign (resid 1     and name HB*  ) (resid 2     and name HD*  )    3.31    3.31    0.00
assign (resid 1     and name HB*  ) (resid 4     and name HG*  )    4.60    4.60    0.00
assign (resid 2     and name HB*  ) (resid 3     and name HN   )    4.27    4.27    0.00
assign (resid 2     and name HB*  ) (resid 3     and name HB*  )    5.55    5.55    0.00
assign (resid 2     and name HG*  ) (resid 3     and name HN   )    5.06    5.06    0.00
assign (resid 2     and name HG*  ) (resid 4     and name HN   )    5.15    5.15    0.00
assign (resid 2     and name HD*  ) (resid 3     and name HN   )    5.04    5.04    0.00
assign (resid 3     and name HN   ) (resid 6     and name HD*  )    5.71    5.71    0.00
assign (resid 3     and name HA   ) (resid 6     and name HD*  )    4.27    4.27    0.00
assign (resid 3     and name HB*  ) (resid 6     and name HD*  )    4.47    4.47    0.00
assign (resid 4     and name HG*  ) (resid 5     and name HN   )    5.61    5.61    0.00
assign (resid 5     and name HN   ) (resid 6     and name HD*  )    5.71    5.71    0.00
assign (resid 6     and name HN   ) (resid 6     and name HD*  )    3.91    3.91    0.00
assign (resid 6     and name HA   ) (resid 6     and name HD*  )    3.63    3.63    0.00
assign (resid 6     and name HD*  ) (resid 8     and name HN   )    5.71    5.71    0.00
assign (resid 6     and name HD*  ) (resid 9     and name HN   )    5.71    5.71    0.00
assign (resid 6     and name HD*  ) (resid 25    and name HN   )    5.71    5.71    0.00
assign (resid 6     and name HD*  ) (resid 26    and name HN   )    5.71    5.71    0.00
assign (resid 6     and name HD*  ) (resid 27    and name HN   )    5.71    5.71    0.00
assign (resid 6     and name HD*  ) (resid 27    and name HB2  )    4.46    4.46    0.00
assign (resid 6     and name HD*  ) (resid 27    and name HB1  )    5.05    5.05    0.00
assign (resid 6     and name HD*  ) (resid 35    and name HN   )    5.71    5.71    0.00
assign (resid 6     and name HD*  ) (resid 35    and name HB*  )    4.32    4.32    0.00
assign (resid 6     and name HD*  ) (resid 36    and name HN   )    4.76    4.76    0.00
assign (resid 6     and name HD*  ) (resid 36    and name HA   )    4.69    4.69    0.00
assign (resid 6     and name HD*  ) (resid 36    and name HB*  )    4.84    4.84    0.00
assign (resid 7     and name HN   ) (resid 7     and name HG*  )    4.37    4.37    0.00
assign (resid 7     and name HG*  ) (resid 8     and name HN   )    4.61    4.61    0.00
assign (resid 8     and name HA   ) (resid 11    and name HB*  )    4.18    4.18    0.00
assign (resid 8     and name HA   ) (resid 11    and name HG*  )    4.75    4.75    0.00
assign (resid 9     and name HN   ) (resid 9     and name HG*  )    3.83    3.83    0.00
assign (resid 9     and name HA   ) (resid 9     and name HG*  )    3.65    3.65    0.00
assign (resid 9     and name HB2  ) (resid 9     and name HG*  )    2.73    2.73    0.00
assign (resid 9     and name HB2  ) (resid 13    and name HD*  )    5.71    5.71    0.00
assign (resid 9     and name HB1  ) (resid 13    and name HD*  )    4.46    4.46    0.00
assign (resid 9     and name HG*  ) (resid 10    and name HN   )    5.61    5.61    0.00
assign (resid 9     and name HD*  ) (resid 13    and name HD*  )    5.13    5.13    0.00
assign (resid 9     and name HE   ) (resid 13    and name HD*  )    5.71    5.71    0.00
assign (resid 10    and name HN   ) (resid 11    and name HG*  )    5.61    5.61    0.00
assign (resid 10    and name HD1* ) (resid 20    and name HD*  )    5.02    5.02    0.00
assign (resid 11    and name HN   ) (resid 11    and name HB*  )    3.35    3.35    0.00
assign (resid 11    and name HN   ) (resid 11    and name HG*  )    3.34    3.34    0.00
assign (resid 11    and name HN   ) (resid 11    and name HE*  )    5.61    5.61    0.00
assign (resid 11    and name HB*  ) (resid 11    and name HD*  )    3.53    3.53    0.00
assign (resid 11    and name HB*  ) (resid 11    and name HE*  )    5.31    5.31    0.00
assign (resid 12    and name HN   ) (resid 12    and name HB*  )    3.14    3.14    0.00
assign (resid 12    and name HN   ) (resid 12    and name HG*  )    4.29    4.29    0.00
assign (resid 12    and name HA   ) (resid 12    and name HG*  )    3.63    3.63    0.00
assign (resid 12    and name HB*  ) (resid 12    and name HE*  )    5.61    5.61    0.00
assign (resid 12    and name HB*  ) (resid 13    and name HN   )    3.60    3.60    0.00
assign (resid 12    and name HB*  ) (resid 13    and name HA   )    5.61    5.61    0.00
assign (resid 12    and name HB*  ) (resid 13    and name HD*  )    4.50    4.50    0.00
assign (resid 13    and name HN   ) (resid 13    and name HB*  )    3.42    3.42    0.00
assign (resid 13    and name HN   ) (resid 13    and name HD*  )    4.40    4.40    0.00
assign (resid 13    and name HA   ) (resid 13    and name HD*  )    3.38    3.38    0.00
assign (resid 13    and name HB*  ) (resid 14    and name HN   )    4.13    4.13    0.00
assign (resid 14    and name HN   ) (resid 15    and name HG*  )    5.61    5.61    0.00
assign (resid 15    and name HN   ) (resid 15    and name HB*  )    3.77    3.77    0.00
assign (resid 15    and name HN   ) (resid 15    and name HG*  )    3.77    3.77    0.00
assign (resid 15    and name HB*  ) (resid 19    and name HB2  )    4.39    4.39    0.00
assign (resid 15    and name HG*  ) (resid 16    and name HN   )    4.32    4.32    0.00
assign (resid 15    and name HG*  ) (resid 19    and name HB1  )    5.49    5.49    0.00
assign (resid 16    and name HA   ) (resid 17    and name HB*  )    5.61    5.61    0.00
assign (resid 17    and name HN   ) (resid 17    and name HB*  )    3.15    3.15    0.00
assign (resid 17    and name HN   ) (resid 20    and name HD*  )    5.61    5.61    0.00
assign (resid 17    and name HA   ) (resid 20    and name HD*  )    4.56    4.56    0.00
assign (resid 17    and name HB*  ) (resid 18    and name HN   )    3.41    3.41    0.00
assign (resid 17    and name HB*  ) (resid 21    and name HE21 )    5.61    5.61    0.00
assign (resid 17    and name HG*  ) (resid 20    and name HG*  )    4.57    4.57    0.00
assign (resid 19    and name HA   ) (resid 22    and name HG*  )    5.61    5.61    0.00
assign (resid 20    and name HN   ) (resid 20    and name HG*  )    3.63    3.63    0.00
assign (resid 20    and name HN   ) (resid 20    and name HD*  )    5.58    5.58    0.00
assign (resid 20    and name HA   ) (resid 20    and name HG*  )    3.69    3.69    0.00
assign (resid 20    and name HA   ) (resid 20    and name HD*  )    4.60    4.60    0.00
assign (resid 20    and name HB*  ) (resid 20    and name HD*  )    3.75    3.75    0.00
assign (resid 20    and name HG*  ) (resid 22    and name HN   )    5.61    5.61    0.00
assign (resid 20    and name HD*  ) (resid 21    and name HA   )    5.42    5.42    0.00
assign (resid 20    and name HD*  ) (resid 21    and name HG*  )    5.15    5.15    0.00
assign (resid 20    and name HD*  ) (resid 23    and name HN   )    5.61    5.61    0.00
assign (resid 21    and name HN   ) (resid 21    and name HG*  )    3.68    3.68    0.00
assign (resid 21    and name HA   ) (resid 21    and name HG*  )    3.85    3.85    0.00
assign (resid 21    and name HG*  ) (resid 22    and name HN   )    4.89    4.89    0.00
assign (resid 22    and name HN   ) (resid 22    and name HG*  )    3.71    3.71    0.00
assign (resid 22    and name HN   ) (resid 22    and name HD*  )    4.87    4.87    0.00
assign (resid 22    and name HA   ) (resid 22    and name HG*  )    3.68    3.68    0.00
assign (resid 22    and name HB1  ) (resid 22    and name HD*  )    3.72    3.72    0.00
assign (resid 23    and name HN   ) (resid 24    and name HG*  )    5.61    5.61    0.00
assign (resid 23    and name HN   ) (resid 26    and name HG*  )    5.61    5.61    0.00
assign (resid 23    and name HA   ) (resid 26    and name HB*  )    3.15    3.15    0.00
assign (resid 23    and name HD1* ) (resid 42    and name HB*  )    4.26    4.26    0.00
assign (resid 24    and name HN   ) (resid 24    and name HG*  )    3.97    3.97    0.00
assign (resid 24    and name HA   ) (resid 24    and name HG*  )    3.80    3.80    0.00
assign (resid 24    and name HG*  ) (resid 25    and name HN   )    4.65    4.65    0.00
assign (resid 24    and name HG*  ) (resid 28    and name HE*  )    4.32    4.32    0.00
assign (resid 25    and name HN   ) (resid 25    and name HG*  )    4.24    4.24    0.00
assign (resid 25    and name HN   ) (resid 26    and name HG*  )    5.07    5.07    0.00
assign (resid 25    and name HA   ) (resid 25    and name HG*  )    3.74    3.74    0.00
assign (resid 25    and name HB*  ) (resid 25    and name HE*  )    5.61    5.61    0.00
assign (resid 25    and name HB*  ) (resid 26    and name HN   )    3.80    3.80    0.00
assign (resid 25    and name HB*  ) (resid 27    and name HN   )    5.61    5.61    0.00
assign (resid 25    and name HG*  ) (resid 25    and name HE*  )    3.81    3.81    0.00
assign (resid 25    and name HG*  ) (resid 26    and name HN   )    5.60    5.60    0.00
assign (resid 26    and name HN   ) (resid 26    and name HB*  )    3.07    3.07    0.00
assign (resid 26    and name HN   ) (resid 26    and name HG*  )    3.62    3.62    0.00
assign (resid 26    and name HA   ) (resid 26    and name HG*  )    3.73    3.73    0.00
assign (resid 26    and name HB*  ) (resid 27    and name HN   )    4.07    4.07    0.00
assign (resid 26    and name HB*  ) (resid 28    and name HN   )    5.05    5.05    0.00
assign (resid 26    and name HB*  ) (resid 31    and name HN   )    5.61    5.61    0.00
assign (resid 26    and name HB*  ) (resid 35    and name HN   )    4.96    4.96    0.00
assign (resid 26    and name HB*  ) (resid 35    and name HB*  )    4.34    4.34    0.00
assign (resid 27    and name HN   ) (resid 28    and name HG*  )    5.61    5.61    0.00
assign (resid 28    and name HN   ) (resid 28    and name HG*  )    4.03    4.03    0.00
assign (resid 28    and name HA   ) (resid 28    and name HG*  )    3.91    3.91    0.00
assign (resid 29    and name HN   ) (resid 29    and name HB*  )    3.53    3.53    0.00
assign (resid 29    and name HN   ) (resid 29    and name HG*  )    3.86    3.86    0.00
assign (resid 29    and name HA   ) (resid 29    and name HG*  )    3.59    3.59    0.00
assign (resid 29    and name HB*  ) (resid 30    and name HN   )    4.44    4.44    0.00
assign (resid 32    and name HN   ) (resid 32    and name HB*  )    3.69    3.69    0.00
assign (resid 32    and name HB*  ) (resid 33    and name HN   )    4.09    4.09    0.00
assign (resid 32    and name HB*  ) (resid 34    and name HN   )    5.61    5.61    0.00
assign (resid 32    and name HB*  ) (resid 35    and name HB*  )    5.52    5.52    0.00
assign (resid 35    and name HN   ) (resid 36    and name HG*  )    5.61    5.61    0.00
assign (resid 36    and name HA   ) (resid 36    and name HG*  )    3.72    3.72    0.00
assign (resid 36    and name HG*  ) (resid 37    and name HN   )    5.05    5.05    0.00
assign (resid 37    and name HN   ) (resid 38    and name HG*  )    5.61    5.61    0.00
assign (resid 37    and name HA   ) (resid 37    and name HG*  )    3.77    3.77    0.00
assign (resid 37    and name HA   ) (resid 40    and name HG*  )    4.41    4.41    0.00
assign (resid 37    and name HG*  ) (resid 38    and name HN   )    5.07    5.07    0.00
assign (resid 37    and name HG*  ) (resid 41    and name HD21 )    5.61    5.61    0.00
assign (resid 38    and name HN   ) (resid 40    and name HG*  )    5.61    5.61    0.00
assign (resid 38    and name HA   ) (resid 38    and name HG*  )    3.86    3.86    0.00
assign (resid 38    and name HA   ) (resid 41    and name HB*  )    4.89    4.89    0.00
assign (resid 38    and name HB*  ) (resid 42    and name HB*  )    5.61    5.61    0.00
assign (resid 38    and name HG*  ) (resid 39    and name HN   )    5.00    5.00    0.00
assign (resid 39    and name HN   ) (resid 40    and name HG*  )    5.61    5.61    0.00
assign (resid 39    and name HN   ) (resid 42    and name HB*  )    5.61    5.61    0.00
assign (resid 39    and name HA   ) (resid 42    and name HB*  )    4.14    4.14    0.00
assign (resid 40    and name HN   ) (resid 40    and name HG*  )    3.70    3.70    0.00
assign (resid 40    and name HN   ) (resid 41    and name HB*  )    5.61    5.61    0.00
assign (resid 40    and name HA   ) (resid 40    and name HG*  )    3.83    3.83    0.00
assign (resid 41    and name HN   ) (resid 41    and name HB*  )    3.56    3.56    0.00
assign (resid 41    and name HB*  ) (resid 42    and name HN   )    4.37    4.37    0.00
assign (resid 42    and name HB*  ) (resid 43    and name HN   )    4.30    4.30    0.00
assign (resid 42    and name HB*  ) (resid 44    and name HN   )    5.07    5.07    0.00
assign (resid 43    and name HA   ) (resid 43    and name HG*  )    3.79    3.79    0.00
assign (resid 3     and name SG   ) (resid 27    and name SG   )    2.62    2.62    0.00
assign (resid 3     and name SG   ) (resid 27    and name CB   )    3.68    3.68    0.00
assign (resid 3     and name CB   ) (resid 27    and name SG   )    3.68    3.68    0.00
assign (resid 19    and name SG   ) (resid 42    and name SG   )    2.62    2.62    0.00
assign (resid 19    and name SG   ) (resid 42    and name CB   )    3.68    3.68    0.00
assign (resid 19    and name CB   ) (resid 42    and name SG   )    3.68    3.68    0.00
assign (resid 3     and name C    ) (resid 4     and name N    ) (resid 4     and name CA   ) (resid 4     and name C    )    1.0  -69.7   13.7 2
assign (resid 4     and name N    ) (resid 4     and name CA   ) (resid 4     and name C    ) (resid 5     and name N    )    1.0  -40.0   10.0 2
assign (resid 4     and name C    ) (resid 5     and name N    ) (resid 5     and name CA   ) (resid 5     and name C    )    1.0  -67.1   10.0 2
assign (resid 5     and name N    ) (resid 5     and name CA   ) (resid 5     and name C    ) (resid 6     and name N    )    1.0  -38.1   10.0 2
assign (resid 5     and name C    ) (resid 6     and name N    ) (resid 6     and name CA   ) (resid 6     and name C    )    1.0  -64.8   10.0 2
assign (resid 6     and name N    ) (resid 6     and name CA   ) (resid 6     and name C    ) (resid 7     and name N    )    1.0  -42.5   10.0 2
assign (resid 6     and name C    ) (resid 7     and name N    ) (resid 7     and name CA   ) (resid 7     and name C    )    1.0  -61.8   10.0 2
assign (resid 7     and name N    ) (resid 7     and name CA   ) (resid 7     and name C    ) (resid 8     and name N    )    1.0  -43.2   10.0 2
assign (resid 7     and name C    ) (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name C    )    1.0  -67.8   10.0 2
assign (resid 8     and name N    ) (resid 8     and name CA   ) (resid 8     and name C    ) (resid 9     and name N    )    1.0  -39.8   12.8 2
assign (resid 8     and name C    ) (resid 9     and name N    ) (resid 9     and name CA   ) (resid 9     and name C    )    1.0  -65.9   10.0 2
assign (resid 9     and name N    ) (resid 9     and name CA   ) (resid 9     and name C    ) (resid 10    and name N    )    1.0  -41.8   10.6 2
assign (resid 9     and name C    ) (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name C    )    1.0  -66.4   10.0 2
assign (resid 10    and name N    ) (resid 10    and name CA   ) (resid 10    and name C    ) (resid 11    and name N    )    1.0  -36.3   11.7 2
assign (resid 10    and name C    ) (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name C    )    1.0  -67.5   10.0 2
assign (resid 11    and name N    ) (resid 11    and name CA   ) (resid 11    and name C    ) (resid 12    and name N    )    1.0  -39.8   10.2 2
assign (resid 11    and name C    ) (resid 12    and name N    ) (resid 12    and name CA   ) (resid 12    and name C    )    1.0  -66.8   10.0 2
assign (resid 12    and name N    ) (resid 12    and name CA   ) (resid 12    and name C    ) (resid 13    and name N    )    1.0  -28.7   12.0 2
assign (resid 12    and name C    ) (resid 13    and name N    ) (resid 13    and name CA   ) (resid 13    and name C    )    1.0  -86.8   12.8 2
assign (resid 13    and name N    ) (resid 13    and name CA   ) (resid 13    and name C    ) (resid 14    and name N    )    1.0   -5.2   16.0 2
assign (resid 17    and name C    ) (resid 18    and name N    ) (resid 18    and name CA   ) (resid 18    and name C    )    1.0  -62.2   11.8 2
assign (resid 18    and name N    ) (resid 18    and name CA   ) (resid 18    and name C    ) (resid 19    and name N    )    1.0  -42.1   10.3 2
assign (resid 18    and name C    ) (resid 19    and name N    ) (resid 19    and name CA   ) (resid 19    and name C    )    1.0  -67.9   10.0 2
assign (resid 19    and name N    ) (resid 19    and name CA   ) (resid 19    and name C    ) (resid 20    and name N    )    1.0  -40.5   10.0 2
assign (resid 19    and name C    ) (resid 20    and name N    ) (resid 20    and name CA   ) (resid 20    and name C    )    1.0  -61.0   10.0 2
assign (resid 20    and name N    ) (resid 20    and name CA   ) (resid 20    and name C    ) (resid 21    and name N    )    1.0  -43.7   10.0 2
assign (resid 20    and name C    ) (resid 21    and name N    ) (resid 21    and name CA   ) (resid 21    and name C    )    1.0  -66.1   10.0 2
assign (resid 21    and name N    ) (resid 21    and name CA   ) (resid 21    and name C    ) (resid 22    and name N    )    1.0  -39.0   10.1 2
assign (resid 21    and name C    ) (resid 22    and name N    ) (resid 22    and name CA   ) (resid 22    and name C    )    1.0  -65.7   10.0 2
assign (resid 22    and name N    ) (resid 22    and name CA   ) (resid 22    and name C    ) (resid 23    and name N    )    1.0  -42.0   10.0 2
assign (resid 22    and name C    ) (resid 23    and name N    ) (resid 23    and name CA   ) (resid 23    and name C    )    1.0  -64.8   10.0 2
assign (resid 23    and name N    ) (resid 23    and name CA   ) (resid 23    and name C    ) (resid 24    and name N    )    1.0  -41.1   10.0 2
assign (resid 23    and name C    ) (resid 24    and name N    ) (resid 24    and name CA   ) (resid 24    and name C    )    1.0  -63.1   10.0 2
assign (resid 24    and name N    ) (resid 24    and name CA   ) (resid 24    and name C    ) (resid 25    and name N    )    1.0  -42.0   10.0 2
assign (resid 24    and name C    ) (resid 25    and name N    ) (resid 25    and name CA   ) (resid 25    and name C    )    1.0  -65.4   10.0 2
assign (resid 25    and name N    ) (resid 25    and name CA   ) (resid 25    and name C    ) (resid 26    and name N    )    1.0  -41.8   10.0 2
assign (resid 25    and name C    ) (resid 26    and name N    ) (resid 26    and name CA   ) (resid 26    and name C    )    1.0  -65.8   10.0 2
assign (resid 26    and name N    ) (resid 26    and name CA   ) (resid 26    and name C    ) (resid 27    and name N    )    1.0  -42.0   10.0 2
assign (resid 26    and name C    ) (resid 27    and name N    ) (resid 27    and name CA   ) (resid 27    and name C    )    1.0  -64.0   10.0 2
assign (resid 27    and name N    ) (resid 27    and name CA   ) (resid 27    and name C    ) (resid 28    and name N    )    1.0  -38.0   11.3 2
assign (resid 32    and name C    ) (resid 33    and name N    ) (resid 33    and name CA   ) (resid 33    and name C    )    1.0  -63.5   10.1 2
assign (resid 33    and name N    ) (resid 33    and name CA   ) (resid 33    and name C    ) (resid 34    and name N    )    1.0  -36.0   13.0 2
assign (resid 33    and name C    ) (resid 34    and name N    ) (resid 34    and name CA   ) (resid 34    and name C    )    1.0  -68.1   11.5 2
assign (resid 34    and name N    ) (resid 34    and name CA   ) (resid 34    and name C    ) (resid 35    and name N    )    1.0  -39.2   13.1 2
assign (resid 34    and name C    ) (resid 35    and name N    ) (resid 35    and name CA   ) (resid 35    and name C    )    1.0  -65.7   10.0 2
assign (resid 35    and name N    ) (resid 35    and name CA   ) (resid 35    and name C    ) (resid 36    and name N    )    1.0  -39.6   10.5 2
assign (resid 35    and name C    ) (resid 36    and name N    ) (resid 36    and name CA   ) (resid 36    and name C    )    1.0  -64.6   10.0 2
assign (resid 36    and name N    ) (resid 36    and name CA   ) (resid 36    and name C    ) (resid 37    and name N    )    1.0  -42.2   10.0 2
assign (resid 36    and name C    ) (resid 37    and name N    ) (resid 37    and name CA   ) (resid 37    and name C    )    1.0  -66.3   10.0 2
assign (resid 37    and name N    ) (resid 37    and name CA   ) (resid 37    and name C    ) (resid 38    and name N    )    1.0  -39.2   13.4 2
assign (resid 37    and name C    ) (resid 38    and name N    ) (resid 38    and name CA   ) (resid 38    and name C    )    1.0  -68.5   10.0 2
assign (resid 38    and name N    ) (resid 38    and name CA   ) (resid 38    and name C    ) (resid 39    and name N    )    1.0  -36.7   12.6 2
assign (resid 38    and name C    ) (resid 39    and name N    ) (resid 39    and name CA   ) (resid 39    and name C    )    1.0  -65.7   10.0 2
assign (resid 39    and name N    ) (resid 39    and name CA   ) (resid 39    and name C    ) (resid 40    and name N    )    1.0  -36.0   10.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           H1       ALA   1  -5.314   5.589  13.746
    2    H2   ALA   1           H2       ALA   1  -5.222   7.267  13.571
    3    H3   ALA   1           H3       ALA   1  -4.062   6.277  12.848
    4    HA   ALA   1           HA       ALA   1  -6.939   6.336  12.152
    5    HB1  ALA   1           HB1      ALA   1  -6.227   7.437  10.065
    6    HB2  ALA   1           HB2      ALA   1  -4.552   7.418  10.616
    7    HB3  ALA   1           HB3      ALA   1  -5.747   8.388  11.472
    8    HA   PRO   2           HA       PRO   2  -6.672   2.152  11.041
    9    HB2  PRO   2           HB2      PRO   2  -7.931   2.840   8.375
   10    HB3  PRO   2           HB3      PRO   2  -8.428   1.626   9.579
   11    HG2  PRO   2           HG2      PRO   2  -9.756   3.906   9.387
   12    HG3  PRO   2           HG3      PRO   2  -9.396   3.225  10.993
   13    HD2  PRO   2           HD2      PRO   2  -8.084   5.526   9.573
   14    HD3  PRO   2           HD3      PRO   2  -8.452   5.320  11.300
   15    H    CYS   3           H        CYS   3  -6.191   3.722   7.856
   16    HA   CYS   3           HA       CYS   3  -3.512   2.592   7.585
   17    HB2  CYS   3           HB2      CYS   3  -5.112   0.840   6.742
   18    HB3  CYS   3           HB3      CYS   3  -5.715   2.000   5.561
   19    H    GLU   4           H        GLU   4  -4.717   5.292   7.836
   20    HA   GLU   4           HA       GLU   4  -5.060   6.505   5.295
   21    HB2  GLU   4           HB2      GLU   4  -4.538   7.752   8.032
   22    HB3  GLU   4           HB3      GLU   4  -4.917   8.682   6.583
   23    HG2  GLU   4           HG2      GLU   4  -6.704   6.641   7.930
   24    HG3  GLU   4           HG3      GLU   4  -6.924   8.390   7.913
   25    H    ASP   5           H        ASP   5  -2.295   6.565   7.556
   26    HA   ASP   5           HA       ASP   5  -0.591   8.242   6.084
   27    HB2  ASP   5           HB2      ASP   5  -0.165   7.661   8.431
   28    HB3  ASP   5           HB3      ASP   5   0.089   5.974   8.005
   29    H    LEU   6           H        LEU   6  -0.958   4.706   6.059
   30    HA   LEU   6           HA       LEU   6   1.170   4.072   4.290
   31    HB2  LEU   6           HB2      LEU   6   0.038   2.547   5.926
   32    HB3  LEU   6           HB3      LEU   6  -1.384   2.523   4.910
   33    HG   LEU   6           HG       LEU   6   1.282   1.487   3.839
   34   HD11  LEU   6          HD11      LEU   6   0.657  -0.770   4.602
   35   HD12  LEU   6          HD12      LEU   6  -0.729  -0.103   5.469
   36   HD13  LEU   6          HD13      LEU   6   0.911   0.327   5.957
   37   HD21  LEU   6          HD21      LEU   6  -0.515   1.750   2.174
   38   HD22  LEU   6          HD22      LEU   6  -1.594   0.756   3.152
   39   HD23  LEU   6          HD23      LEU   6  -0.147   0.045   2.429
   40    H    LYS   7           H        LYS   7  -2.333   4.376   3.766
   41    HA   LYS   7           HA       LYS   7  -2.301   3.643   1.013
   42    HB2  LYS   7           HB2      LYS   7  -4.193   3.041   2.296
   43    HB3  LYS   7           HB3      LYS   7  -4.407   4.653   2.933
   44    HG2  LYS   7           HG2      LYS   7  -4.783   4.290  -0.023
   45    HG3  LYS   7           HG3      LYS   7  -6.004   3.593   1.037
   46    HD2  LYS   7           HD2      LYS   7  -5.162   6.516   0.949
   47    HD3  LYS   7           HD3      LYS   7  -6.674   5.841   0.337
   48    HE2  LYS   7           HE2      LYS   7  -7.350   5.208   2.620
   49    HE3  LYS   7           HE3      LYS   7  -5.812   5.799   3.257
   50    HZ1  LYS   7           HZ1      LYS   7  -7.547   7.433   3.595
   51    HZ2  LYS   7           HZ2      LYS   7  -7.910   7.453   1.944
   52    HZ3  LYS   7           HZ3      LYS   7  -6.420   8.033   2.492
   53    H    GLU   8           H        GLU   8  -2.294   6.741   2.703
   54    HA   GLU   8           HA       GLU   8  -2.615   8.347   0.351
   55    HB2  GLU   8           HB2      GLU   8  -1.532   9.029   3.106
   56    HB3  GLU   8           HB3      GLU   8  -1.686  10.213   1.814
   57    HG2  GLU   8           HG2      GLU   8  -3.937   8.668   3.110
   58    HG3  GLU   8           HG3      GLU   8  -3.562  10.374   3.349
   59    H    ARG   9           H        ARG   9   0.149   6.811   1.910
   60    HA   ARG   9           HA       ARG   9   2.149   8.162   0.345
   61    HB2  ARG   9           HB2      ARG   9   2.274   5.601   1.988
   62    HB3  ARG   9           HB3      ARG   9   3.661   6.245   1.106
   63    HG2  ARG   9           HG2      ARG   9   3.577   8.312   2.437
   64    HG3  ARG   9           HG3      ARG   9   2.154   7.714   3.290
   65    HD2  ARG   9           HD2      ARG   9   3.578   5.768   4.097
   66    HD3  ARG   9           HD3      ARG   9   4.980   6.610   3.420
   67    HE   ARG   9           HE       ARG   9   3.278   7.541   5.638
   68   HH11  ARG   9          HH11      ARG   9   6.296   7.831   3.875
   69   HH12  ARG   9          HH12      ARG   9   7.015   8.883   5.048
   70   HH21  ARG   9          HH21      ARG   9   4.181   8.893   7.156
   71   HH22  ARG   9          HH22      ARG   9   5.796   9.494   6.939
   72    H    LEU  10           H        LEU  10   0.179   5.256  -0.127
   73    HA   LEU  10           HA       LEU  10   1.486   4.200  -2.412
   74    HB2  LEU  10           HB2      LEU  10  -1.538   4.238  -2.038
   75    HB3  LEU  10           HB3      LEU  10  -0.596   3.083  -2.968
   76    HG   LEU  10           HG       LEU  10  -0.714   3.327   0.055
   77   HD11  LEU  10          HD11      LEU  10  -1.723   1.107  -0.002
   78   HD12  LEU  10          HD12      LEU  10  -1.648   1.099  -1.764
   79   HD13  LEU  10          HD13      LEU  10  -2.678   2.265  -0.929
   80   HD21  LEU  10          HD21      LEU  10   1.572   2.747  -0.523
   81   HD22  LEU  10          HD22      LEU  10   1.013   1.437  -1.564
   82   HD23  LEU  10          HD23      LEU  10   0.755   1.352   0.180
   83    H    LYS  11           H        LYS  11  -0.797   6.802  -1.959
   84    HA   LYS  11           HA       LYS  11  -1.183   7.496  -4.723
   85    HB2  LYS  11           HB2      LYS  11  -1.810   8.983  -2.135
   86    HB3  LYS  11           HB3      LYS  11  -2.363   9.483  -3.733
   87    HG2  LYS  11           HG2      LYS  11  -3.781   7.553  -3.955
   88    HG3  LYS  11           HG3      LYS  11  -3.058   6.776  -2.542
   89    HD2  LYS  11           HD2      LYS  11  -5.310   7.714  -2.044
   90    HD3  LYS  11           HD3      LYS  11  -4.047   8.447  -1.055
   91    HE2  LYS  11           HE2      LYS  11  -4.029  10.416  -2.572
   92    HE3  LYS  11           HE3      LYS  11  -5.322   9.677  -3.520
   93    HZ1  LYS  11           HZ1      LYS  11  -6.191  11.293  -1.952
   94    HZ2  LYS  11           HZ2      LYS  11  -5.516  10.453  -0.652
   95    HZ3  LYS  11           HZ3      LYS  11  -6.747   9.748  -1.568
   96    H    LYS  12           H        LYS  12   0.815   8.736  -2.056
   97    HA   LYS  12           HA       LYS  12   1.678  11.133  -3.363
   98    HB2  LYS  12           HB2      LYS  12   1.463  10.663  -0.830
   99    HB3  LYS  12           HB3      LYS  12   2.978   9.790  -0.933
  100    HG2  LYS  12           HG2      LYS  12   2.732  12.713  -1.731
  101    HG3  LYS  12           HG3      LYS  12   3.041  12.214  -0.070
  102    HD2  LYS  12           HD2      LYS  12   5.131  11.105  -0.788
  103    HD3  LYS  12           HD3      LYS  12   4.811  11.583  -2.458
  104    HE2  LYS  12           HE2      LYS  12   4.971  13.961  -1.812
  105    HE3  LYS  12           HE3      LYS  12   5.276  13.488  -0.137
  106    HZ1  LYS  12           HZ1      LYS  12   7.352  13.983  -1.224
  107    HZ2  LYS  12           HZ2      LYS  12   7.020  12.901  -2.479
  108    HZ3  LYS  12           HZ3      LYS  12   7.290  12.322  -0.917
  109    H    LEU  13           H        LEU  13   3.126   7.940  -2.810
  110    HA   LEU  13           HA       LEU  13   5.648   8.517  -4.074
  111    HB2  LEU  13           HB2      LEU  13   4.354   5.867  -3.302
  112    HB3  LEU  13           HB3      LEU  13   6.002   6.024  -3.897
  113    HG   LEU  13           HG       LEU  13   4.963   7.287  -1.327
  114   HD11  LEU  13          HD11      LEU  13   5.013   4.849  -1.123
  115   HD12  LEU  13          HD12      LEU  13   6.251   5.596  -0.119
  116   HD13  LEU  13          HD13      LEU  13   6.703   4.818  -1.640
  117   HD21  LEU  13          HD21      LEU  13   6.788   8.582  -2.288
  118   HD22  LEU  13          HD22      LEU  13   7.792   7.135  -2.412
  119   HD23  LEU  13          HD23      LEU  13   7.322   7.755  -0.827
  120    H    GLY  14           H        GLY  14   2.525   7.573  -5.199
  121    HA2  GLY  14           HA2      GLY  14   1.657   7.527  -7.301
  122    HA3  GLY  14           HA3      GLY  14   3.154   8.247  -7.857
  123    H    MET  15           H        MET  15   2.262   5.080  -6.472
  124    HA   MET  15           HA       MET  15   3.829   3.581  -8.362
  125    HB2  MET  15           HB2      MET  15   2.921   1.626  -7.082
  126    HB3  MET  15           HB3      MET  15   3.686   2.822  -6.049
  127    HG2  MET  15           HG2      MET  15   1.389   3.716  -5.525
  128    HG3  MET  15           HG3      MET  15   0.727   2.360  -6.415
  129    HE1  MET  15           HE1      MET  15   3.385   1.519  -2.692
  130    HE2  MET  15           HE2      MET  15   3.282   3.141  -3.381
  131    HE3  MET  15           HE3      MET  15   4.047   1.837  -4.295
  132    H    SER  16           H        SER  16   2.376   1.451  -9.137
  133    HA   SER  16           HA       SER  16   0.589   2.345 -11.131
  134    HB2  SER  16           HB2      SER  16   0.844  -0.437  -9.928
  135    HB3  SER  16           HB3      SER  16   0.066  -0.049 -11.464
  136    HG   SER  16           HG       SER  16   2.177   0.848 -12.073
  137    H    GLU  17           H        GLU  17  -1.694   2.041 -11.304
  138    HA   GLU  17           HA       GLU  17  -3.325   2.750  -9.110
  139    HB2  GLU  17           HB2      GLU  17  -4.124   1.377 -11.715
  140    HB3  GLU  17           HB3      GLU  17  -5.199   2.288 -10.660
  141    HG2  GLU  17           HG2      GLU  17  -2.776   3.522 -11.927
  142    HG3  GLU  17           HG3      GLU  17  -4.317   3.446 -12.776
  143    H    GLU  18           H        GLU  18  -2.827  -0.338 -10.803
  144    HA   GLU  18           HA       GLU  18  -4.321  -2.058  -9.183
  145    HB2  GLU  18           HB2      GLU  18  -3.491  -2.776 -11.356
  146    HB3  GLU  18           HB3      GLU  18  -1.816  -2.573 -10.856
  147    HG2  GLU  18           HG2      GLU  18  -2.103  -4.437  -9.225
  148    HG3  GLU  18           HG3      GLU  18  -3.761  -4.651  -9.776
  149    H    CYS  19           H        CYS  19  -1.028  -0.742  -8.754
  150    HA   CYS  19           HA       CYS  19  -0.135  -2.532  -6.755
  151    HB2  CYS  19           HB2      CYS  19   1.396  -0.880  -7.960
  152    HB3  CYS  19           HB3      CYS  19   0.654   0.395  -7.030
  153    H    ARG  20           H        ARG  20  -1.661   0.705  -6.569
  154    HA   ARG  20           HA       ARG  20  -1.798   0.966  -3.762
  155    HB2  ARG  20           HB2      ARG  20  -4.010   1.983  -5.620
  156    HB3  ARG  20           HB3      ARG  20  -3.441   2.689  -4.117
  157    HG2  ARG  20           HG2      ARG  20  -1.356   3.400  -5.248
  158    HG3  ARG  20           HG3      ARG  20  -1.953   2.699  -6.767
  159    HD2  ARG  20           HD2      ARG  20  -3.315   4.892  -5.182
  160    HD3  ARG  20           HD3      ARG  20  -2.376   5.128  -6.661
  161    HE   ARG  20           HE       ARG  20  -4.565   3.267  -6.924
  162   HH11  ARG  20          HH11      ARG  20  -3.721   6.691  -7.147
  163   HH12  ARG  20          HH12      ARG  20  -5.072   7.077  -8.170
  164   HH21  ARG  20          HH21      ARG  20  -6.339   3.783  -8.211
  165   HH22  ARG  20          HH22      ARG  20  -6.557   5.413  -8.771
  166    H    GLN  21           H        GLN  21  -4.184  -0.260  -6.110
  167    HA   GLN  21           HA       GLN  21  -6.309  -0.782  -4.382
  168    HB2  GLN  21           HB2      GLN  21  -5.597  -1.926  -7.111
  169    HB3  GLN  21           HB3      GLN  21  -7.083  -2.380  -6.281
  170    HG2  GLN  21           HG2      GLN  21  -7.864  -0.079  -6.308
  171    HG3  GLN  21           HG3      GLN  21  -6.334   0.467  -6.996
  172   HE21  GLN  21          HE21      GLN  21  -5.962   0.165  -9.216
  173   HE22  GLN  21          HE22      GLN  21  -7.190  -0.339 -10.310
  174    H    ARG  22           H        ARG  22  -3.519  -2.761  -5.203
  175    HA   ARG  22           HA       ARG  22  -4.336  -5.208  -3.965
  176    HB2  ARG  22           HB2      ARG  22  -1.641  -4.021  -4.760
  177    HB3  ARG  22           HB3      ARG  22  -1.714  -5.542  -3.895
  178    HG2  ARG  22           HG2      ARG  22  -2.916  -6.610  -5.715
  179    HG3  ARG  22           HG3      ARG  22  -3.061  -5.073  -6.576
  180    HD2  ARG  22           HD2      ARG  22  -0.642  -4.962  -6.882
  181    HD3  ARG  22           HD3      ARG  22  -0.412  -6.412  -5.902
  182    HE   ARG  22           HE       ARG  22  -2.045  -7.201  -7.975
  183   HH11  ARG  22          HH11      ARG  22   1.188  -5.762  -7.743
  184   HH12  ARG  22          HH12      ARG  22   1.758  -6.518  -9.200
  185   HH21  ARG  22          HH21      ARG  22  -1.253  -8.217  -9.859
  186   HH22  ARG  22          HH22      ARG  22   0.370  -7.909 -10.394
  187    H    LEU  23           H        LEU  23  -2.479  -2.399  -2.894
  188    HA   LEU  23           HA       LEU  23  -1.422  -3.665  -0.539
  189    HB2  LEU  23           HB2      LEU  23  -1.283  -0.867  -1.693
  190    HB3  LEU  23           HB3      LEU  23  -0.364  -1.359  -0.298
  191    HG   LEU  23           HG       LEU  23  -0.127  -2.612  -3.054
  192   HD11  LEU  23          HD11      LEU  23   2.069  -1.505  -3.169
  193   HD12  LEU  23          HD12      LEU  23   1.700  -0.652  -1.667
  194   HD13  LEU  23          HD13      LEU  23   0.723  -0.369  -3.108
  195   HD21  LEU  23          HD21      LEU  23   0.394  -4.227  -1.310
  196   HD22  LEU  23          HD22      LEU  23   1.544  -3.104  -0.578
  197   HD23  LEU  23          HD23      LEU  23   1.849  -3.760  -2.187
  198    H    GLU  24           H        GLU  24  -3.684  -0.949  -1.094
  199    HA   GLU  24           HA       GLU  24  -4.198  -0.434   1.647
  200    HB2  GLU  24           HB2      GLU  24  -6.074   0.972   0.861
  201    HB3  GLU  24           HB3      GLU  24  -4.594   1.281  -0.026
  202    HG2  GLU  24           HG2      GLU  24  -6.028   1.284  -1.798
  203    HG3  GLU  24           HG3      GLU  24  -5.674  -0.434  -1.763
  204    H    LYS  25           H        LYS  25  -5.597  -2.656  -0.672
  205    HA   LYS  25           HA       LYS  25  -7.887  -3.507   0.748
  206    HB2  LYS  25           HB2      LYS  25  -7.404  -3.862  -1.682
  207    HB3  LYS  25           HB3      LYS  25  -6.147  -5.010  -1.274
  208    HG2  LYS  25           HG2      LYS  25  -9.013  -5.487  -0.436
  209    HG3  LYS  25           HG3      LYS  25  -8.472  -5.866  -2.070
  210    HD2  LYS  25           HD2      LYS  25  -6.747  -7.393  -1.121
  211    HD3  LYS  25           HD3      LYS  25  -7.352  -7.038   0.501
  212    HE2  LYS  25           HE2      LYS  25  -9.555  -7.969  -0.128
  213    HE3  LYS  25           HE3      LYS  25  -8.932  -8.337  -1.740
  214    HZ1  LYS  25           HZ1      LYS  25  -8.877 -10.288  -0.321
  215    HZ2  LYS  25           HZ2      LYS  25  -7.925  -9.483   0.816
  216    HZ3  LYS  25           HZ3      LYS  25  -7.297  -9.821  -0.714
  217    H    MET  26           H        MET  26  -4.570  -4.800   0.571
  218    HA   MET  26           HA       MET  26  -4.895  -6.894   2.477
  219    HB2  MET  26           HB2      MET  26  -2.354  -5.501   1.520
  220    HB3  MET  26           HB3      MET  26  -2.384  -6.951   2.512
  221    HG2  MET  26           HG2      MET  26  -3.828  -7.917   0.522
  222    HG3  MET  26           HG3      MET  26  -3.040  -6.632  -0.387
  223    HE1  MET  26           HE1      MET  26  -2.589  -9.884   1.716
  224    HE2  MET  26           HE2      MET  26  -1.588  -8.766   2.647
  225    HE3  MET  26           HE3      MET  26  -0.838 -10.083   1.748
  226    H    CYS  27           H        CYS  27  -4.125  -3.507   2.747
  227    HA   CYS  27           HA       CYS  27  -3.006  -3.553   5.383
  228    HB2  CYS  27           HB2      CYS  27  -2.568  -1.779   3.711
  229    HB3  CYS  27           HB3      CYS  27  -4.246  -1.254   3.818
  230    H    LYS  28           H        LYS  28  -6.268  -3.325   4.121
  231    HA   LYS  28           HA       LYS  28  -7.565  -2.415   6.510
  232    HB2  LYS  28           HB2      LYS  28  -8.642  -3.849   4.034
  233    HB3  LYS  28           HB3      LYS  28  -9.671  -3.236   5.329
  234    HG2  LYS  28           HG2      LYS  28  -9.165  -0.973   4.840
  235    HG3  LYS  28           HG3      LYS  28  -7.758  -1.402   3.862
  236    HD2  LYS  28           HD2      LYS  28  -9.304  -2.436   2.170
  237    HD3  LYS  28           HD3      LYS  28 -10.679  -1.872   3.127
  238    HE2  LYS  28           HE2      LYS  28 -10.028   0.453   2.770
  239    HE3  LYS  28           HE3      LYS  28  -8.547  -0.054   1.951
  240    HZ1  LYS  28           HZ1      LYS  28  -9.872  -1.009   0.184
  241    HZ2  LYS  28           HZ2      LYS  28 -10.261   0.622   0.393
  242    HZ3  LYS  28           HZ3      LYS  28 -11.304  -0.576   0.971
  243    H    GLU  29           H        GLU  29  -7.517  -5.626   4.933
  244    HA   GLU  29           HA       GLU  29  -8.754  -6.932   7.201
  245    HB2  GLU  29           HB2      GLU  29  -8.539  -9.005   5.801
  246    HB3  GLU  29           HB3      GLU  29  -9.377  -7.688   4.994
  247    HG2  GLU  29           HG2      GLU  29  -7.423  -7.197   3.631
  248    HG3  GLU  29           HG3      GLU  29  -6.459  -8.367   4.532
  249    H    GLY  30           H        GLY  30  -5.489  -6.769   5.852
  250    HA2  GLY  30           HA2      GLY  30  -4.479  -8.799   7.738
  251    HA3  GLY  30           HA3      GLY  30  -3.663  -8.198   6.305
  252    H    THR  31           H        THR  31  -1.835  -8.033   7.831
  253    HA   THR  31           HA       THR  31  -1.862  -5.897   9.806
  254    HB   THR  31           HB       THR  31   0.602  -6.482  10.038
  255    HG1  THR  31           HG1      THR  31   1.341  -8.299   8.912
  256   HG21  THR  31          HG21      THR  31   0.250  -8.719  11.042
  257   HG22  THR  31          HG22      THR  31  -1.324  -8.831  10.252
  258   HG23  THR  31          HG23      THR  31  -1.042  -7.606  11.493
  259    H    SER  32           H        SER  32  -1.175  -3.845   9.464
  260    HA   SER  32           HA       SER  32  -0.994  -2.802   6.843
  261    HB2  SER  32           HB2      SER  32  -0.478  -0.638   8.045
  262    HB3  SER  32           HB3      SER  32  -1.914  -1.460   8.649
  263    HG   SER  32           HG       SER  32  -0.986  -1.375  10.524
  264    H    GLU  33           H        GLU  33   1.462  -3.559   9.304
  265    HA   GLU  33           HA       GLU  33   3.714  -2.400   8.110
  266    HB2  GLU  33           HB2      GLU  33   3.531  -4.866   9.881
  267    HB3  GLU  33           HB3      GLU  33   5.052  -4.102   9.424
  268    HG2  GLU  33           HG2      GLU  33   4.276  -1.992  10.526
  269    HG3  GLU  33           HG3      GLU  33   2.830  -2.847  11.064
  270    H    ASP  34           H        ASP  34   2.215  -5.556   7.468
  271    HA   ASP  34           HA       ASP  34   4.286  -6.424   5.646
  272    HB2  ASP  34           HB2      ASP  34   1.549  -7.534   6.390
  273    HB3  ASP  34           HB3      ASP  34   2.429  -8.190   5.008
  274    H    ALA  35           H        ALA  35   1.235  -4.709   5.323
  275    HA   ALA  35           HA       ALA  35   0.931  -4.930   2.501
  276    HB1  ALA  35           HB1      ALA  35  -0.700  -3.108   2.730
  277    HB2  ALA  35           HB2      ALA  35  -0.129  -2.783   4.371
  278    HB3  ALA  35           HB3      ALA  35  -0.923  -4.315   3.996
  279    H    GLU  36           H        GLU  36   2.275  -2.290   4.522
  280    HA   GLU  36           HA       GLU  36   3.201  -0.670   2.380
  281    HB2  GLU  36           HB2      GLU  36   4.634   0.459   4.078
  282    HB3  GLU  36           HB3      GLU  36   2.951   0.322   4.568
  283    HG2  GLU  36           HG2      GLU  36   3.408  -1.058   6.328
  284    HG3  GLU  36           HG3      GLU  36   4.683  -1.913   5.477
  285    H    ARG  37           H        ARG  37   4.679  -3.369   4.116
  286    HA   ARG  37           HA       ARG  37   7.300  -3.155   3.075
  287    HB2  ARG  37           HB2      ARG  37   5.748  -5.196   4.544
  288    HB3  ARG  37           HB3      ARG  37   6.811  -5.946   3.365
  289    HG2  ARG  37           HG2      ARG  37   7.843  -5.796   5.598
  290    HG3  ARG  37           HG3      ARG  37   8.766  -4.911   4.387
  291    HD2  ARG  37           HD2      ARG  37   7.902  -2.792   5.224
  292    HD3  ARG  37           HD3      ARG  37   6.836  -3.631   6.354
  293    HE   ARG  37           HE       ARG  37   9.479  -4.432   6.833
  294   HH11  ARG  37          HH11      ARG  37   7.518  -1.526   7.247
  295   HH12  ARG  37          HH12      ARG  37   8.470  -0.945   8.576
  296   HH21  ARG  37          HH21      ARG  37  10.691  -3.659   8.565
  297   HH22  ARG  37          HH22      ARG  37  10.265  -2.155   9.317
  298    H    MET  38           H        MET  38   4.339  -4.686   1.810
  299    HA   MET  38           HA       MET  38   5.559  -5.710  -0.592
  300    HB2  MET  38           HB2      MET  38   2.627  -5.197   0.041
  301    HB3  MET  38           HB3      MET  38   3.210  -6.033  -1.391
  302    HG2  MET  38           HG2      MET  38   3.489  -6.973   1.466
  303    HG3  MET  38           HG3      MET  38   2.365  -7.599   0.273
  304    HE1  MET  38           HE1      MET  38   6.285  -7.192   1.052
  305    HE2  MET  38           HE2      MET  38   6.680  -8.906   0.927
  306    HE3  MET  38           HE3      MET  38   5.492  -8.361   2.112
  307    H    ALA  39           H        ALA  39   4.239  -2.599   0.359
  308    HA   ALA  39           HA       ALA  39   4.040  -1.403  -2.226
  309    HB1  ALA  39           HB1      ALA  39   4.048   0.749  -1.024
  310    HB2  ALA  39           HB2      ALA  39   4.567  -0.066   0.455
  311    HB3  ALA  39           HB3      ALA  39   2.979  -0.410  -0.230
  312    H    ARG  40           H        ARG  40   6.643  -1.755   0.112
  313    HA   ARG  40           HA       ARG  40   8.616  -0.227  -1.291
  314    HB2  ARG  40           HB2      ARG  40   8.968  -2.379   0.851
  315    HB3  ARG  40           HB3      ARG  40  10.210  -1.235   0.328
  316    HG2  ARG  40           HG2      ARG  40   8.866   0.651   1.155
  317    HG3  ARG  40           HG3      ARG  40   7.569  -0.452   1.605
  318    HD2  ARG  40           HD2      ARG  40   9.268  -1.565   3.183
  319    HD3  ARG  40           HD3      ARG  40  10.301  -0.162   2.891
  320    HE   ARG  40           HE       ARG  40   8.015  -0.307   4.594
  321   HH11  ARG  40          HH11      ARG  40   9.705   2.011   2.524
  322   HH12  ARG  40          HH12      ARG  40   9.099   3.381   3.399
  323   HH21  ARG  40          HH21      ARG  40   7.231   1.507   5.677
  324   HH22  ARG  40          HH22      ARG  40   7.706   3.099   5.175
  325    H    ASN  41           H        ASN  41   7.567  -3.583  -1.319
  326    HA   ASN  41           HA       ASN  41   9.673  -4.502  -3.107
  327    HB2  ASN  41           HB2      ASN  41   7.096  -5.823  -2.139
  328    HB3  ASN  41           HB3      ASN  41   8.133  -6.580  -3.340
  329   HD21  ASN  41          HD21      ASN  41   7.648  -6.053  -0.007
  330   HD22  ASN  41          HD22      ASN  41   9.071  -6.838   0.563
  331    H    CYS  42           H        CYS  42   6.535  -3.076  -3.408
  332    HA   CYS  42           HA       CYS  42   5.896  -3.829  -6.072
  333    HB2  CYS  42           HB2      CYS  42   4.211  -2.925  -4.463
  334    HB3  CYS  42           HB3      CYS  42   4.983  -1.351  -4.543
  335    H    GLU  43           H        GLU  43   7.198  -0.802  -4.696
  336    HA   GLU  43           HA       GLU  43   8.438  -0.151  -7.312
  337    HB2  GLU  43           HB2      GLU  43   7.009   1.740  -5.394
  338    HB3  GLU  43           HB3      GLU  43   8.024   2.282  -6.724
  339    HG2  GLU  43           HG2      GLU  43   5.510   0.618  -7.000
  340    HG3  GLU  43           HG3      GLU  43   5.629   2.351  -7.301
  341    H    SER  44           H        SER  44   8.563   1.042  -3.918
  342    HA   SER  44           HA       SER  44  11.243   0.338  -3.403
  343    HB2  SER  44           HB2      SER  44  12.290   2.676  -3.513
  344    HB3  SER  44           HB3      SER  44  11.982   1.930  -5.078
  345    HG   SER  44           HG       SER  44   9.884   3.444  -4.134
  Start of MODEL    2
    1    H1   ALA   1           H1       ALA   1  -3.839   5.887  10.719
    2    H2   ALA   1           H2       ALA   1  -4.548   5.044  12.003
    3    H3   ALA   1           H3       ALA   1  -4.541   6.738  11.998
    4    HA   ALA   1           HA       ALA   1  -6.718   5.829  11.404
    5    HB1  ALA   1           HB1      ALA   1  -7.026   7.255   9.393
    6    HB2  ALA   1           HB2      ALA   1  -5.272   7.329   9.189
    7    HB3  ALA   1           HB3      ALA   1  -6.024   8.052  10.611
    8    HA   PRO   2           HA       PRO   2  -6.751   2.002   9.209
    9    HB2  PRO   2           HB2      PRO   2  -9.256   2.018   8.013
   10    HB3  PRO   2           HB3      PRO   2  -8.993   1.732   9.745
   11    HG2  PRO   2           HG2      PRO   2  -9.749   4.294   8.358
   12    HG3  PRO   2           HG3      PRO   2 -10.429   3.583   9.842
   13    HD2  PRO   2           HD2      PRO   2  -8.636   5.561   9.998
   14    HD3  PRO   2           HD3      PRO   2  -8.588   4.210  11.158
   15    H    CYS   3           H        CYS   3  -5.144   2.190   7.684
   16    HA   CYS   3           HA       CYS   3  -4.184   1.964   5.680
   17    HB2  CYS   3           HB2      CYS   3  -6.993   1.978   4.514
   18    HB3  CYS   3           HB3      CYS   3  -5.533   1.388   3.715
   19    H    GLU   4           H        GLU   4  -5.375   4.728   6.704
   20    HA   GLU   4           HA       GLU   4  -5.483   6.354   4.321
   21    HB2  GLU   4           HB2      GLU   4  -5.441   7.041   7.288
   22    HB3  GLU   4           HB3      GLU   4  -5.597   8.252   6.016
   23    HG2  GLU   4           HG2      GLU   4  -7.541   5.964   6.462
   24    HG3  GLU   4           HG3      GLU   4  -7.762   7.598   7.086
   25    H    ASP   5           H        ASP   5  -3.236   6.033   7.079
   26    HA   ASP   5           HA       ASP   5  -1.242   7.855   6.310
   27    HB2  ASP   5           HB2      ASP   5  -0.911   5.241   7.862
   28    HB3  ASP   5           HB3      ASP   5   0.255   6.564   7.842
   29    H    LEU   6           H        LEU   6  -1.697   4.455   5.561
   30    HA   LEU   6           HA       LEU   6   0.698   4.055   4.086
   31    HB2  LEU   6           HB2      LEU   6  -0.731   2.324   5.261
   32    HB3  LEU   6           HB3      LEU   6  -1.884   2.464   3.953
   33    HG   LEU   6           HG       LEU   6   0.967   1.740   3.239
   34   HD11  LEU   6          HD11      LEU   6   0.571  -0.621   3.671
   35   HD12  LEU   6          HD12      LEU   6  -1.000  -0.252   4.386
   36   HD13  LEU   6          HD13      LEU   6   0.482   0.311   5.164
   37   HD21  LEU   6          HD21      LEU   6  -0.120   0.371   1.498
   38   HD22  LEU   6          HD22      LEU   6  -0.667   2.044   1.419
   39   HD23  LEU   6          HD23      LEU   6  -1.711   0.813   2.132
   40    H    LYS   7           H        LYS   7  -2.570   5.109   3.281
   41    HA   LYS   7           HA       LYS   7  -2.393   4.888   0.434
   42    HB2  LYS   7           HB2      LYS   7  -4.470   5.013   1.930
   43    HB3  LYS   7           HB3      LYS   7  -4.231   6.753   1.966
   44    HG2  LYS   7           HG2      LYS   7  -4.553   6.855  -0.479
   45    HG3  LYS   7           HG3      LYS   7  -4.711   5.095  -0.542
   46    HD2  LYS   7           HD2      LYS   7  -6.603   7.066   0.800
   47    HD3  LYS   7           HD3      LYS   7  -6.947   6.043  -0.594
   48    HE2  LYS   7           HE2      LYS   7  -6.803   4.036   0.817
   49    HE3  LYS   7           HE3      LYS   7  -6.354   5.020   2.209
   50    HZ1  LYS   7           HZ1      LYS   7  -8.954   5.169   0.784
   51    HZ2  LYS   7           HZ2      LYS   7  -8.509   6.062   2.150
   52    HZ3  LYS   7           HZ3      LYS   7  -8.673   4.386   2.260
   53    H    GLU   8           H        GLU   8  -1.605   7.414   2.729
   54    HA   GLU   8           HA       GLU   8  -1.172   9.494   0.813
   55    HB2  GLU   8           HB2      GLU   8  -0.017   9.293   3.613
   56    HB3  GLU   8           HB3      GLU   8  -0.180  10.753   2.637
   57    HG2  GLU   8           HG2      GLU   8  -2.358   9.128   3.943
   58    HG3  GLU   8           HG3      GLU   8  -1.919  10.796   4.273
   59    H    ARG   9           H        ARG   9   0.793   6.902   2.128
   60    HA   ARG   9           HA       ARG   9   3.262   7.664   0.896
   61    HB2  ARG   9           HB2      ARG   9   2.237   4.882   1.630
   62    HB3  ARG   9           HB3      ARG   9   3.905   5.270   1.207
   63    HG2  ARG   9           HG2      ARG   9   4.088   6.699   3.203
   64    HG3  ARG   9           HG3      ARG   9   2.406   6.356   3.616
   65    HD2  ARG   9           HD2      ARG   9   2.978   3.952   3.862
   66    HD3  ARG   9           HD3      ARG   9   4.668   4.327   3.493
   67    HE   ARG   9           HE       ARG   9   3.723   5.904   5.655
   68   HH11  ARG   9          HH11      ARG   9   4.810   2.629   4.939
   69   HH12  ARG   9          HH12      ARG   9   5.313   2.319   6.569
   70   HH21  ARG   9          HH21      ARG   9   4.356   5.467   7.783
   71   HH22  ARG   9          HH22      ARG   9   5.056   3.932   8.184
   72    H    LEU  10           H        LEU  10   0.487   5.615  -0.084
   73    HA   LEU  10           HA       LEU  10   1.478   4.516  -2.448
   74    HB2  LEU  10           HB2      LEU  10  -1.414   5.257  -1.835
   75    HB3  LEU  10           HB3      LEU  10  -0.908   4.187  -3.134
   76    HG   LEU  10           HG       LEU  10  -0.628   3.640  -0.156
   77   HD11  LEU  10          HD11      LEU  10  -2.923   3.447  -0.915
   78   HD12  LEU  10          HD12      LEU  10  -2.256   1.868  -0.515
   79   HD13  LEU  10          HD13      LEU  10  -2.429   2.349  -2.204
   80   HD21  LEU  10          HD21      LEU  10   1.265   2.673  -1.344
   81   HD22  LEU  10          HD22      LEU  10   0.174   1.882  -2.486
   82   HD23  LEU  10          HD23      LEU  10   0.167   1.414  -0.783
   83    H    LYS  11           H        LYS  11  -0.251   7.608  -1.969
   84    HA   LYS  11           HA       LYS  11  -0.449   8.261  -4.741
   85    HB2  LYS  11           HB2      LYS  11  -1.083  10.523  -3.979
   86    HB3  LYS  11           HB3      LYS  11  -1.969   9.254  -3.149
   87    HG2  LYS  11           HG2      LYS  11  -0.624   9.532  -1.150
   88    HG3  LYS  11           HG3      LYS  11   0.430  10.683  -1.974
   89    HD2  LYS  11           HD2      LYS  11  -1.155  11.838  -0.483
   90    HD3  LYS  11           HD3      LYS  11  -1.417  12.288  -2.166
   91    HE2  LYS  11           HE2      LYS  11  -3.384  10.848  -2.284
   92    HE3  LYS  11           HE3      LYS  11  -3.077  10.242  -0.653
   93    HZ1  LYS  11           HZ1      LYS  11  -4.809  11.982  -0.726
   94    HZ2  LYS  11           HZ2      LYS  11  -3.669  13.090  -1.297
   95    HZ3  LYS  11           HZ3      LYS  11  -3.497  12.424   0.244
   96    H    LYS  12           H        LYS  12   1.973   8.966  -2.263
   97    HA   LYS  12           HA       LYS  12   3.489  10.816  -3.857
   98    HB2  LYS  12           HB2      LYS  12   3.484  10.833  -1.340
   99    HB3  LYS  12           HB3      LYS  12   4.347   9.294  -1.357
  100    HG2  LYS  12           HG2      LYS  12   6.174  10.489  -2.711
  101    HG3  LYS  12           HG3      LYS  12   5.345  11.998  -2.316
  102    HD2  LYS  12           HD2      LYS  12   5.680  11.527   0.109
  103    HD3  LYS  12           HD3      LYS  12   6.505  10.019  -0.310
  104    HE2  LYS  12           HE2      LYS  12   8.230  11.346  -1.525
  105    HE3  LYS  12           HE3      LYS  12   7.434  12.831  -1.000
  106    HZ1  LYS  12           HZ1      LYS  12   9.321  12.272   0.407
  107    HZ2  LYS  12           HZ2      LYS  12   8.628  10.779   0.793
  108    HZ3  LYS  12           HZ3      LYS  12   7.882  12.209   1.294
  109    H    LEU  13           H        LEU  13   3.548   7.340  -3.299
  110    HA   LEU  13           HA       LEU  13   6.184   6.862  -4.309
  111    HB2  LEU  13           HB2      LEU  13   3.844   4.964  -3.808
  112    HB3  LEU  13           HB3      LEU  13   5.437   4.421  -4.310
  113    HG   LEU  13           HG       LEU  13   4.851   5.875  -1.700
  114   HD11  LEU  13          HD11      LEU  13   3.852   3.645  -1.661
  115   HD12  LEU  13          HD12      LEU  13   5.228   3.742  -0.564
  116   HD13  LEU  13          HD13      LEU  13   5.398   2.922  -2.121
  117   HD21  LEU  13          HD21      LEU  13   7.399   4.546  -2.641
  118   HD22  LEU  13          HD22      LEU  13   7.118   5.282  -1.059
  119   HD23  LEU  13          HD23      LEU  13   7.115   6.283  -2.505
  120    H    GLY  14           H        GLY  14   2.998   7.186  -5.695
  121    HA2  GLY  14           HA2      GLY  14   2.220   7.226  -7.843
  122    HA3  GLY  14           HA3      GLY  14   3.868   7.621  -8.307
  123    H    MET  15           H        MET  15   2.399   4.689  -6.939
  124    HA   MET  15           HA       MET  15   3.812   2.968  -8.780
  125    HB2  MET  15           HB2      MET  15   2.761   1.172  -7.388
  126    HB3  MET  15           HB3      MET  15   3.653   2.337  -6.419
  127    HG2  MET  15           HG2      MET  15   1.509   3.447  -5.821
  128    HG3  MET  15           HG3      MET  15   0.645   2.239  -6.766
  129    HE1  MET  15           HE1      MET  15   3.839   1.404  -4.577
  130    HE2  MET  15           HE2      MET  15   3.080   1.131  -3.010
  131    HE3  MET  15           HE3      MET  15   3.089   2.748  -3.710
  132    H    SER  16           H        SER  16   2.195   0.962  -9.366
  133    HA   SER  16           HA       SER  16   0.279   1.732 -11.270
  134    HB2  SER  16           HB2      SER  16   0.487  -0.876  -9.687
  135    HB3  SER  16           HB3      SER  16  -0.441  -0.663 -11.170
  136    HG   SER  16           HG       SER  16   2.343  -0.131 -11.069
  137    H    GLU  17           H        GLU  17  -1.917   2.183 -11.084
  138    HA   GLU  17           HA       GLU  17  -2.992   3.006  -8.600
  139    HB2  GLU  17           HB2      GLU  17  -3.627   3.661 -11.104
  140    HB3  GLU  17           HB3      GLU  17  -4.777   2.346 -10.962
  141    HG2  GLU  17           HG2      GLU  17  -4.699   4.665  -9.002
  142    HG3  GLU  17           HG3      GLU  17  -5.620   4.725 -10.500
  143    H    GLU  18           H        GLU  18  -3.143   0.020 -10.432
  144    HA   GLU  18           HA       GLU  18  -4.994  -1.437  -8.873
  145    HB2  GLU  18           HB2      GLU  18  -4.368  -2.186 -11.094
  146    HB3  GLU  18           HB3      GLU  18  -2.669  -2.271 -10.649
  147    HG2  GLU  18           HG2      GLU  18  -3.243  -4.154  -9.067
  148    HG3  GLU  18           HG3      GLU  18  -4.893  -4.108  -9.688
  149    H    CYS  19           H        CYS  19  -1.517  -0.774  -8.484
  150    HA   CYS  19           HA       CYS  19  -0.848  -2.887  -6.717
  151    HB2  CYS  19           HB2      CYS  19   0.847  -1.252  -7.880
  152    HB3  CYS  19           HB3      CYS  19   0.468  -0.143  -6.583
  153    H    ARG  20           H        ARG  20  -1.866   0.480  -6.213
  154    HA   ARG  20           HA       ARG  20  -1.973   0.791  -3.474
  155    HB2  ARG  20           HB2      ARG  20  -4.114   1.618  -5.480
  156    HB3  ARG  20           HB3      ARG  20  -3.904   2.314  -3.874
  157    HG2  ARG  20           HG2      ARG  20  -1.984   3.498  -4.508
  158    HG3  ARG  20           HG3      ARG  20  -1.731   2.506  -5.955
  159    HD2  ARG  20           HD2      ARG  20  -2.779   4.842  -6.318
  160    HD3  ARG  20           HD3      ARG  20  -3.545   3.453  -7.081
  161    HE   ARG  20           HE       ARG  20  -5.362   3.620  -5.707
  162   HH11  ARG  20          HH11      ARG  20  -3.037   6.142  -4.859
  163   HH12  ARG  20          HH12      ARG  20  -4.183   7.044  -3.914
  164   HH21  ARG  20          HH21      ARG  20  -6.829   4.777  -4.415
  165   HH22  ARG  20          HH22      ARG  20  -6.340   6.262  -3.662
  166    H    GLN  21           H        GLN  21  -4.473  -0.521  -5.626
  167    HA   GLN  21           HA       GLN  21  -6.480  -0.829  -3.725
  168    HB2  GLN  21           HB2      GLN  21  -6.101  -2.270  -6.380
  169    HB3  GLN  21           HB3      GLN  21  -7.613  -2.222  -5.470
  170    HG2  GLN  21           HG2      GLN  21  -7.726   0.205  -5.753
  171    HG3  GLN  21           HG3      GLN  21  -6.178   0.196  -6.598
  172   HE21  GLN  21          HE21      GLN  21  -6.948   1.022  -8.513
  173   HE22  GLN  21          HE22      GLN  21  -8.061   0.194  -9.543
  174    H    ARG  22           H        ARG  22  -3.937  -2.965  -4.843
  175    HA   ARG  22           HA       ARG  22  -4.683  -5.355  -3.483
  176    HB2  ARG  22           HB2      ARG  22  -2.031  -4.391  -4.639
  177    HB3  ARG  22           HB3      ARG  22  -2.274  -6.009  -3.992
  178    HG2  ARG  22           HG2      ARG  22  -3.972  -6.456  -5.714
  179    HG3  ARG  22           HG3      ARG  22  -3.769  -4.823  -6.352
  180    HD2  ARG  22           HD2      ARG  22  -1.526  -5.311  -7.087
  181    HD3  ARG  22           HD3      ARG  22  -1.507  -6.852  -6.224
  182    HE   ARG  22           HE       ARG  22  -3.623  -6.828  -8.103
  183   HH11  ARG  22          HH11      ARG  22  -0.093  -7.046  -8.023
  184   HH12  ARG  22          HH12      ARG  22   0.001  -7.944  -9.503
  185   HH21  ARG  22          HH21      ARG  22  -3.483  -8.010 -10.025
  186   HH22  ARG  22          HH22      ARG  22  -1.938  -8.495 -10.647
  187    H    LEU  23           H        LEU  23  -2.688  -2.557  -2.656
  188    HA   LEU  23           HA       LEU  23  -1.428  -3.746  -0.343
  189    HB2  LEU  23           HB2      LEU  23  -1.510  -0.934  -1.470
  190    HB3  LEU  23           HB3      LEU  23  -0.514  -1.397  -0.106
  191    HG   LEU  23           HG       LEU  23  -0.315  -2.621  -2.876
  192   HD11  LEU  23          HD11      LEU  23   1.486  -0.579  -1.600
  193   HD12  LEU  23          HD12      LEU  23   0.399  -0.333  -2.970
  194   HD13  LEU  23          HD13      LEU  23   1.782  -1.411  -3.130
  195   HD21  LEU  23          HD21      LEU  23   1.484  -2.998  -0.475
  196   HD22  LEU  23          HD22      LEU  23   1.748  -3.649  -2.096
  197   HD23  LEU  23          HD23      LEU  23   0.363  -4.185  -1.152
  198    H    GLU  24           H        GLU  24  -3.877  -1.213  -0.804
  199    HA   GLU  24           HA       GLU  24  -4.766  -0.829   1.782
  200    HB2  GLU  24           HB2      GLU  24  -6.333  -0.831  -0.835
  201    HB3  GLU  24           HB3      GLU  24  -6.974  -0.216   0.689
  202    HG2  GLU  24           HG2      GLU  24  -5.348   1.572   0.740
  203    HG3  GLU  24           HG3      GLU  24  -4.456   0.871  -0.611
  204    H    LYS  25           H        LYS  25  -5.498  -3.456  -0.499
  205    HA   LYS  25           HA       LYS  25  -7.481  -4.811   1.019
  206    HB2  LYS  25           HB2      LYS  25  -7.186  -5.272  -1.357
  207    HB3  LYS  25           HB3      LYS  25  -5.528  -5.780  -1.100
  208    HG2  LYS  25           HG2      LYS  25  -6.907  -7.728  -1.505
  209    HG3  LYS  25           HG3      LYS  25  -6.324  -7.763   0.160
  210    HD2  LYS  25           HD2      LYS  25  -8.685  -8.455   0.027
  211    HD3  LYS  25           HD3      LYS  25  -8.520  -6.968   0.964
  212    HE2  LYS  25           HE2      LYS  25  -9.334  -5.643  -0.902
  213    HE3  LYS  25           HE3      LYS  25  -9.309  -7.048  -1.965
  214    HZ1  LYS  25           HZ1      LYS  25 -11.041  -8.057  -0.682
  215    HZ2  LYS  25           HZ2      LYS  25 -11.537  -6.519  -1.165
  216    HZ3  LYS  25           HZ3      LYS  25 -11.037  -6.785   0.427
  217    H    MET  26           H        MET  26  -3.932  -5.178   0.825
  218    HA   MET  26           HA       MET  26  -3.677  -7.290   2.710
  219    HB2  MET  26           HB2      MET  26  -1.660  -5.178   1.856
  220    HB3  MET  26           HB3      MET  26  -1.268  -6.593   2.823
  221    HG2  MET  26           HG2      MET  26  -2.455  -6.862   0.067
  222    HG3  MET  26           HG3      MET  26  -0.730  -6.640   0.317
  223    HE1  MET  26           HE1      MET  26  -3.114 -10.488   1.273
  224    HE2  MET  26           HE2      MET  26  -3.697  -9.136   0.302
  225    HE3  MET  26           HE3      MET  26  -3.588  -8.983   2.055
  226    H    CYS  27           H        CYS  27  -3.844  -3.805   3.003
  227    HA   CYS  27           HA       CYS  27  -2.966  -3.499   5.681
  228    HB2  CYS  27           HB2      CYS  27  -2.961  -1.554   4.291
  229    HB3  CYS  27           HB3      CYS  27  -4.642  -1.779   3.827
  230    H    LYS  28           H        LYS  28  -6.176  -3.993   4.240
  231    HA   LYS  28           HA       LYS  28  -7.616  -3.677   6.727
  232    HB2  LYS  28           HB2      LYS  28  -8.552  -4.702   4.008
  233    HB3  LYS  28           HB3      LYS  28  -9.609  -4.277   5.354
  234    HG2  LYS  28           HG2      LYS  28  -9.110  -1.953   5.152
  235    HG3  LYS  28           HG3      LYS  28  -7.726  -2.264   4.097
  236    HD2  LYS  28           HD2      LYS  28  -9.393  -3.215   2.406
  237    HD3  LYS  28           HD3      LYS  28 -10.676  -2.565   3.430
  238    HE2  LYS  28           HE2      LYS  28  -8.466  -0.946   2.116
  239    HE3  LYS  28           HE3      LYS  28 -10.136  -1.056   1.554
  240    HZ1  LYS  28           HZ1      LYS  28  -9.857   0.945   2.800
  241    HZ2  LYS  28           HZ2      LYS  28  -9.204   0.116   4.116
  242    HZ3  LYS  28           HZ3      LYS  28 -10.827  -0.096   3.704
  243    H    GLU  29           H        GLU  29  -7.287  -6.402   4.418
  244    HA   GLU  29           HA       GLU  29  -8.378  -8.266   6.395
  245    HB2  GLU  29           HB2      GLU  29  -7.815  -8.639   3.424
  246    HB3  GLU  29           HB3      GLU  29  -8.632  -9.806   4.466
  247    HG2  GLU  29           HG2      GLU  29 -10.383  -8.027   4.910
  248    HG3  GLU  29           HG3      GLU  29  -9.609  -7.054   3.661
  249    H    GLY  30           H        GLY  30  -5.406  -7.234   6.087
  250    HA2  GLY  30           HA2      GLY  30  -4.272  -9.790   7.029
  251    HA3  GLY  30           HA3      GLY  30  -3.418  -8.902   5.765
  252    H    THR  31           H        THR  31  -1.998  -7.407   6.404
  253    HA   THR  31           HA       THR  31  -2.263  -5.971   8.960
  254    HB   THR  31           HB       THR  31   0.264  -6.269   9.323
  255    HG1  THR  31           HG1      THR  31   1.116  -8.197   8.264
  256   HG21  THR  31          HG21      THR  31  -1.351  -7.582  10.697
  257   HG22  THR  31          HG22      THR  31   0.138  -8.476  10.376
  258   HG23  THR  31          HG23      THR  31  -1.329  -8.854   9.471
  259    H    SER  32           H        SER  32  -1.721  -3.852   8.725
  260    HA   SER  32           HA       SER  32  -1.150  -2.727   6.177
  261    HB2  SER  32           HB2      SER  32  -2.451  -1.542   7.951
  262    HB3  SER  32           HB3      SER  32  -0.985  -1.414   8.926
  263    HG   SER  32           HG       SER  32  -0.069  -0.218   7.141
  264    H    GLU  33           H        GLU  33   0.842  -3.950   8.722
  265    HA   GLU  33           HA       GLU  33   3.276  -2.561   8.148
  266    HB2  GLU  33           HB2      GLU  33   2.798  -5.223   9.556
  267    HB3  GLU  33           HB3      GLU  33   4.308  -4.308   9.597
  268    HG2  GLU  33           HG2      GLU  33   3.250  -2.493  10.807
  269    HG3  GLU  33           HG3      GLU  33   1.659  -3.236  10.620
  270    H    ASP  34           H        ASP  34   1.966  -5.752   7.148
  271    HA   ASP  34           HA       ASP  34   4.140  -6.323   5.338
  272    HB2  ASP  34           HB2      ASP  34   1.446  -7.624   5.808
  273    HB3  ASP  34           HB3      ASP  34   2.380  -8.055   4.382
  274    H    ALA  35           H        ALA  35   1.174  -4.535   5.121
  275    HA   ALA  35           HA       ALA  35   0.936  -4.494   2.266
  276    HB1  ALA  35           HB1      ALA  35  -0.699  -2.700   2.650
  277    HB2  ALA  35           HB2      ALA  35  -0.205  -2.600   4.343
  278    HB3  ALA  35           HB3      ALA  35  -0.982  -4.063   3.735
  279    H    GLU  36           H        GLU  36   2.434  -2.287   4.667
  280    HA   GLU  36           HA       GLU  36   3.360  -0.402   2.693
  281    HB2  GLU  36           HB2      GLU  36   4.600   0.675   4.481
  282    HB3  GLU  36           HB3      GLU  36   3.001   0.255   5.080
  283    HG2  GLU  36           HG2      GLU  36   3.873  -1.590   6.351
  284    HG3  GLU  36           HG3      GLU  36   5.459  -1.433   5.599
  285    H    ARG  37           H        ARG  37   4.647  -3.259   4.266
  286    HA   ARG  37           HA       ARG  37   7.292  -3.314   3.375
  287    HB2  ARG  37           HB2      ARG  37   6.406  -4.908   5.000
  288    HB3  ARG  37           HB3      ARG  37   5.277  -5.549   3.819
  289    HG2  ARG  37           HG2      ARG  37   7.225  -6.429   2.508
  290    HG3  ARG  37           HG3      ARG  37   8.288  -5.885   3.811
  291    HD2  ARG  37           HD2      ARG  37   7.136  -7.377   5.397
  292    HD3  ARG  37           HD3      ARG  37   6.012  -7.883   4.132
  293    HE   ARG  37           HE       ARG  37   8.741  -8.345   3.399
  294   HH11  ARG  37          HH11      ARG  37   6.105  -9.736   5.298
  295   HH12  ARG  37          HH12      ARG  37   6.730 -11.349   5.189
  296   HH21  ARG  37          HH21      ARG  37   9.558 -10.462   3.316
  297   HH22  ARG  37          HH22      ARG  37   8.689 -11.760   4.071
  298    H    MET  38           H        MET  38   4.333  -4.528   1.774
  299    HA   MET  38           HA       MET  38   5.710  -5.238  -0.652
  300    HB2  MET  38           HB2      MET  38   2.754  -5.120   0.037
  301    HB3  MET  38           HB3      MET  38   3.358  -5.637  -1.529
  302    HG2  MET  38           HG2      MET  38   3.966  -7.019   1.098
  303    HG3  MET  38           HG3      MET  38   2.715  -7.510  -0.035
  304    HE1  MET  38           HE1      MET  38   7.204  -8.407  -0.347
  305    HE2  MET  38           HE2      MET  38   6.264  -8.131   1.120
  306    HE3  MET  38           HE3      MET  38   6.675  -6.777   0.066
  307    H    ALA  39           H        ALA  39   4.204  -2.338   0.572
  308    HA   ALA  39           HA       ALA  39   3.626  -1.036  -1.890
  309    HB1  ALA  39           HB1      ALA  39   2.665  -0.295   0.256
  310    HB2  ALA  39           HB2      ALA  39   3.496   1.031  -0.559
  311    HB3  ALA  39           HB3      ALA  39   4.265   0.212   0.808
  312    H    ARG  40           H        ARG  40   6.434  -0.952   0.255
  313    HA   ARG  40           HA       ARG  40   7.972   0.777  -1.488
  314    HB2  ARG  40           HB2      ARG  40   9.732   0.585   0.203
  315    HB3  ARG  40           HB3      ARG  40   8.185   0.962   0.953
  316    HG2  ARG  40           HG2      ARG  40   7.950  -1.477   1.544
  317    HG3  ARG  40           HG3      ARG  40   9.584  -1.736   0.926
  318    HD2  ARG  40           HD2      ARG  40  10.480  -0.191   2.626
  319    HD3  ARG  40           HD3      ARG  40   8.844   0.122   3.225
  320    HE   ARG  40           HE       ARG  40  10.188  -2.517   3.334
  321   HH11  ARG  40          HH11      ARG  40   8.042  -0.150   4.818
  322   HH12  ARG  40          HH12      ARG  40   7.729  -1.130   6.217
  323   HH21  ARG  40          HH21      ARG  40   9.720  -3.821   5.127
  324   HH22  ARG  40          HH22      ARG  40   8.687  -3.215   6.380
  325    H    ASN  41           H        ASN  41   7.237  -2.447  -1.631
  326    HA   ASN  41           HA       ASN  41   9.604  -3.038  -3.323
  327    HB2  ASN  41           HB2      ASN  41   8.101  -4.917  -1.440
  328    HB3  ASN  41           HB3      ASN  41   9.129  -5.506  -2.745
  329   HD21  ASN  41          HD21      ASN  41   9.109  -3.796   0.300
  330   HD22  ASN  41          HD22      ASN  41  10.783  -3.976   0.634
  331    H    CYS  42           H        CYS  42   6.686  -2.017  -3.647
  332    HA   CYS  42           HA       CYS  42   5.305  -3.830  -5.345
  333    HB2  CYS  42           HB2      CYS  42   4.094  -1.983  -4.325
  334    HB3  CYS  42           HB3      CYS  42   5.148  -0.790  -5.077
  335    H    GLU  43           H        GLU  43   7.199  -0.926  -6.082
  336    HA   GLU  43           HA       GLU  43   8.287  -2.069  -8.531
  337    HB2  GLU  43           HB2      GLU  43   6.689   0.552  -8.497
  338    HB3  GLU  43           HB3      GLU  43   7.722   0.038  -9.831
  339    HG2  GLU  43           HG2      GLU  43   6.306  -1.908 -10.235
  340    HG3  GLU  43           HG3      GLU  43   5.310  -1.512  -8.840
  341    H    SER  44           H        SER  44   7.953   1.019  -6.783
  342    HA   SER  44           HA       SER  44  10.851   1.440  -6.779
  343    HB2  SER  44           HB2      SER  44  10.179   3.697  -5.816
  344    HB3  SER  44           HB3      SER  44   9.580   3.365  -7.438
  345    HG   SER  44           HG       SER  44   7.979   2.765  -5.191
  Start of MODEL    3
    1    H1   ALA   1           H1       ALA   1  -4.342   6.742  12.730
    2    H2   ALA   1           H2       ALA   1  -5.896   6.472  13.329
    3    H3   ALA   1           H3       ALA   1  -5.440   8.022  12.839
    4    HA   ALA   1           HA       ALA   1  -6.850   7.019  11.184
    5    HB1  ALA   1           HB1      ALA   1  -5.355   7.338   9.235
    6    HB2  ALA   1           HB2      ALA   1  -3.950   7.236  10.295
    7    HB3  ALA   1           HB3      ALA   1  -5.081   8.578  10.460
    8    HA   PRO   2           HA       PRO   2  -6.547   2.545  10.959
    9    HB2  PRO   2           HB2      PRO   2  -8.138   2.675   8.442
   10    HB3  PRO   2           HB3      PRO   2  -8.553   1.926   9.994
   11    HG2  PRO   2           HG2      PRO   2  -9.783   4.159   9.200
   12    HG3  PRO   2           HG3      PRO   2  -9.357   3.912  10.912
   13    HD2  PRO   2           HD2      PRO   2  -7.891   5.543   8.831
   14    HD3  PRO   2           HD3      PRO   2  -8.320   5.978  10.506
   15    H    CYS   3           H        CYS   3  -6.423   3.947   7.646
   16    HA   CYS   3           HA       CYS   3  -3.839   2.652   7.110
   17    HB2  CYS   3           HB2      CYS   3  -5.872   1.129   6.495
   18    HB3  CYS   3           HB3      CYS   3  -6.153   2.262   5.179
   19    H    GLU   4           H        GLU   4  -5.138   5.418   7.354
   20    HA   GLU   4           HA       GLU   4  -5.224   6.656   4.783
   21    HB2  GLU   4           HB2      GLU   4  -4.873   7.898   7.551
   22    HB3  GLU   4           HB3      GLU   4  -5.245   8.794   6.084
   23    HG2  GLU   4           HG2      GLU   4  -7.040   6.637   7.230
   24    HG3  GLU   4           HG3      GLU   4  -7.207   8.351   7.602
   25    H    ASP   5           H        ASP   5  -2.780   6.322   7.285
   26    HA   ASP   5           HA       ASP   5  -0.763   8.000   6.275
   27    HB2  ASP   5           HB2      ASP   5  -0.783   7.169   8.582
   28    HB3  ASP   5           HB3      ASP   5  -0.602   5.514   8.023
   29    H    LEU   6           H        LEU   6  -1.596   4.626   5.654
   30    HA   LEU   6           HA       LEU   6   0.675   3.964   4.046
   31    HB2  LEU   6           HB2      LEU   6  -0.729   2.220   5.125
   32    HB3  LEU   6           HB3      LEU   6  -2.104   2.724   4.162
   33    HG   LEU   6           HG       LEU   6  -0.724   2.089   2.073
   34   HD11  LEU   6          HD11      LEU   6   1.481   2.021   3.074
   35   HD12  LEU   6          HD12      LEU   6   1.073   0.472   2.344
   36   HD13  LEU   6          HD13      LEU   6   1.005   0.662   4.098
   37   HD21  LEU   6          HD21      LEU   6  -1.329  -0.259   2.184
   38   HD22  LEU   6          HD22      LEU   6  -2.601   0.747   2.881
   39   HD23  LEU   6          HD23      LEU   6  -1.513  -0.156   3.938
   40    H    LYS   7           H        LYS   7  -2.677   4.936   3.399
   41    HA   LYS   7           HA       LYS   7  -2.662   4.593   0.622
   42    HB2  LYS   7           HB2      LYS   7  -4.698   4.598   2.010
   43    HB3  LYS   7           HB3      LYS   7  -4.462   6.303   2.385
   44    HG2  LYS   7           HG2      LYS   7  -6.212   5.868   0.656
   45    HG3  LYS   7           HG3      LYS   7  -4.920   6.944   0.115
   46    HD2  LYS   7           HD2      LYS   7  -3.858   5.072  -1.099
   47    HD3  LYS   7           HD3      LYS   7  -5.121   3.977  -0.529
   48    HE2  LYS   7           HE2      LYS   7  -5.562   6.398  -2.286
   49    HE3  LYS   7           HE3      LYS   7  -5.496   4.727  -2.847
   50    HZ1  LYS   7           HZ1      LYS   7  -7.419   4.247  -1.418
   51    HZ2  LYS   7           HZ2      LYS   7  -7.768   5.400  -2.598
   52    HZ3  LYS   7           HZ3      LYS   7  -7.514   5.885  -0.998
   53    H    GLU   8           H        GLU   8  -1.917   7.411   2.630
   54    HA   GLU   8           HA       GLU   8  -1.795   9.250   0.463
   55    HB2  GLU   8           HB2      GLU   8  -0.872  10.852   2.036
   56    HB3  GLU   8           HB3      GLU   8  -2.226  10.000   2.752
   57    HG2  GLU   8           HG2      GLU   8  -0.805  10.033   4.548
   58    HG3  GLU   8           HG3      GLU   8  -0.330   8.501   3.825
   59    H    ARG   9           H        ARG   9   0.594   7.071   1.934
   60    HA   ARG   9           HA       ARG   9   2.911   7.915   0.541
   61    HB2  ARG   9           HB2      ARG   9   2.133   5.033   1.175
   62    HB3  ARG   9           HB3      ARG   9   3.755   5.606   0.802
   63    HG2  ARG   9           HG2      ARG   9   3.901   6.783   2.887
   64    HG3  ARG   9           HG3      ARG   9   2.194   6.497   3.235
   65    HD2  ARG   9           HD2      ARG   9   2.696   4.030   3.278
   66    HD3  ARG   9           HD3      ARG   9   4.407   4.426   3.105
   67    HE   ARG   9           HE       ARG   9   2.957   5.614   5.357
   68   HH11  ARG   9          HH11      ARG   9   5.220   3.160   4.260
   69   HH12  ARG   9          HH12      ARG   9   5.834   2.836   5.844
   70   HH21  ARG   9          HH21      ARG   9   3.774   5.178   7.444
   71   HH22  ARG   9          HH22      ARG   9   5.005   3.995   7.657
   72    H    LEU  10           H        LEU  10   0.298   5.706  -0.329
   73    HA   LEU  10           HA       LEU  10   1.391   4.566  -2.645
   74    HB2  LEU  10           HB2      LEU  10  -1.577   4.928  -2.079
   75    HB3  LEU  10           HB3      LEU  10  -0.838   3.702  -3.097
   76    HG   LEU  10           HG       LEU  10  -0.754   3.881  -0.072
   77   HD11  LEU  10          HD11      LEU  10  -2.805   2.933  -0.962
   78   HD12  LEU  10          HD12      LEU  10  -1.867   1.736  -0.078
   79   HD13  LEU  10          HD13      LEU  10  -1.880   1.714  -1.844
   80   HD21  LEU  10          HD21      LEU  10   0.611   1.838  -0.048
   81   HD22  LEU  10          HD22      LEU  10   1.462   3.199  -0.769
   82   HD23  LEU  10          HD23      LEU  10   0.789   1.936  -1.804
   83    H    LYS  11           H        LYS  11  -0.663   7.419  -2.208
   84    HA   LYS  11           HA       LYS  11  -0.907   8.069  -5.006
   85    HB2  LYS  11           HB2      LYS  11  -1.507   9.697  -2.514
   86    HB3  LYS  11           HB3      LYS  11  -1.936  10.181  -4.150
   87    HG2  LYS  11           HG2      LYS  11  -3.468   8.273  -4.346
   88    HG3  LYS  11           HG3      LYS  11  -2.990   7.700  -2.744
   89    HD2  LYS  11           HD2      LYS  11  -5.161   8.902  -2.658
   90    HD3  LYS  11           HD3      LYS  11  -3.924   9.727  -1.709
   91    HE2  LYS  11           HE2      LYS  11  -3.592  11.322  -3.600
   92    HE3  LYS  11           HE3      LYS  11  -4.895  10.516  -4.476
   93    HZ1  LYS  11           HZ1      LYS  11  -5.218  11.815  -1.820
   94    HZ2  LYS  11           HZ2      LYS  11  -6.446  11.163  -2.784
   95    HZ3  LYS  11           HZ3      LYS  11  -5.611  12.539  -3.296
   96    H    LYS  12           H        LYS  12   1.068   9.226  -2.281
   97    HA   LYS  12           HA       LYS  12   2.102  11.595  -3.484
   98    HB2  LYS  12           HB2      LYS  12   1.979  11.283  -1.065
   99    HB3  LYS  12           HB3      LYS  12   3.085   9.918  -1.151
  100    HG2  LYS  12           HG2      LYS  12   4.888  11.495  -1.916
  101    HG3  LYS  12           HG3      LYS  12   3.762  12.836  -1.684
  102    HD2  LYS  12           HD2      LYS  12   4.757  10.923   0.450
  103    HD3  LYS  12           HD3      LYS  12   5.240  12.609   0.257
  104    HE2  LYS  12           HE2      LYS  12   2.902  13.321   0.729
  105    HE3  LYS  12           HE3      LYS  12   2.439  11.631   0.945
  106    HZ1  LYS  12           HZ1      LYS  12   4.068  11.535   2.785
  107    HZ2  LYS  12           HZ2      LYS  12   2.793  12.594   3.068
  108    HZ3  LYS  12           HZ3      LYS  12   4.312  13.199   2.636
  109    H    LEU  13           H        LEU  13   3.402   8.347  -3.068
  110    HA   LEU  13           HA       LEU  13   5.929   8.896  -4.334
  111    HB2  LEU  13           HB2      LEU  13   4.660   6.253  -3.518
  112    HB3  LEU  13           HB3      LEU  13   6.340   6.475  -3.981
  113    HG   LEU  13           HG       LEU  13   5.021   7.662  -1.505
  114   HD11  LEU  13          HD11      LEU  13   6.391   6.074  -0.218
  115   HD12  LEU  13          HD12      LEU  13   6.952   5.335  -1.724
  116   HD13  LEU  13          HD13      LEU  13   5.245   5.260  -1.282
  117   HD21  LEU  13          HD21      LEU  13   7.921   7.764  -2.372
  118   HD22  LEU  13          HD22      LEU  13   7.282   8.315  -0.820
  119   HD23  LEU  13          HD23      LEU  13   6.787   9.116  -2.306
  120    H    GLY  14           H        GLY  14   2.764   7.776  -5.248
  121    HA2  GLY  14           HA2      GLY  14   1.772   7.612  -7.279
  122    HA3  GLY  14           HA3      GLY  14   3.218   8.312  -7.986
  123    H    MET  15           H        MET  15   2.147   5.219  -6.509
  124    HA   MET  15           HA       MET  15   3.669   3.651  -8.442
  125    HB2  MET  15           HB2      MET  15   2.907   1.725  -7.078
  126    HB3  MET  15           HB3      MET  15   3.686   2.944  -6.084
  127    HG2  MET  15           HG2      MET  15   1.416   3.760  -5.408
  128    HG3  MET  15           HG3      MET  15   0.717   2.435  -6.319
  129    HE1  MET  15           HE1      MET  15   3.246   3.233  -3.316
  130    HE2  MET  15           HE2      MET  15   4.108   2.024  -4.274
  131    HE3  MET  15           HE3      MET  15   3.468   1.602  -2.686
  132    H    SER  16           H        SER  16   2.101   1.552  -9.047
  133    HA   SER  16           HA       SER  16   0.207   2.544 -10.927
  134    HB2  SER  16           HB2      SER  16   0.661  -0.304  -9.930
  135    HB3  SER  16           HB3      SER  16  -0.248   0.143 -11.378
  136    HG   SER  16           HG       SER  16   2.507   0.670 -10.900
  137    H    GLU  17           H        GLU  17  -2.061   2.392 -10.909
  138    HA   GLU  17           HA       GLU  17  -3.474   2.769  -8.518
  139    HB2  GLU  17           HB2      GLU  17  -4.323   3.506 -10.695
  140    HB3  GLU  17           HB3      GLU  17  -4.462   1.840 -11.241
  141    HG2  GLU  17           HG2      GLU  17  -6.296   1.397  -9.768
  142    HG3  GLU  17           HG3      GLU  17  -6.040   2.894  -8.874
  143    H    GLU  18           H        GLU  18  -2.845  -0.148 -10.424
  144    HA   GLU  18           HA       GLU  18  -4.367  -2.007  -8.976
  145    HB2  GLU  18           HB2      GLU  18  -3.434  -2.564 -11.178
  146    HB3  GLU  18           HB3      GLU  18  -1.791  -2.433 -10.554
  147    HG2  GLU  18           HG2      GLU  18  -2.224  -4.375  -9.047
  148    HG3  GLU  18           HG3      GLU  18  -3.853  -4.505  -9.697
  149    H    CYS  19           H        CYS  19  -1.049  -0.744  -8.494
  150    HA   CYS  19           HA       CYS  19  -0.147  -2.629  -6.602
  151    HB2  CYS  19           HB2      CYS  19   1.311  -0.823  -7.746
  152    HB3  CYS  19           HB3      CYS  19   0.591   0.337  -6.656
  153    H    ARG  20           H        ARG  20  -1.717   0.555  -6.217
  154    HA   ARG  20           HA       ARG  20  -1.772   0.730  -3.431
  155    HB2  ARG  20           HB2      ARG  20  -3.981   1.725  -5.289
  156    HB3  ARG  20           HB3      ARG  20  -3.578   2.330  -3.683
  157    HG2  ARG  20           HG2      ARG  20  -1.415   3.148  -4.585
  158    HG3  ARG  20           HG3      ARG  20  -1.929   2.634  -6.202
  159    HD2  ARG  20           HD2      ARG  20  -3.472   4.530  -4.424
  160    HD3  ARG  20           HD3      ARG  20  -2.375   5.053  -5.712
  161    HE   ARG  20           HE       ARG  20  -4.618   3.275  -6.385
  162   HH11  ARG  20          HH11      ARG  20  -3.222   6.513  -6.566
  163   HH12  ARG  20          HH12      ARG  20  -4.344   7.061  -7.765
  164   HH21  ARG  20          HH21      ARG  20  -6.164   4.063  -7.855
  165   HH22  ARG  20          HH22      ARG  20  -6.017   5.660  -8.498
  166    H    GLN  21           H        GLN  21  -4.238  -0.501  -5.684
  167    HA   GLN  21           HA       GLN  21  -6.244  -0.962  -3.821
  168    HB2  GLN  21           HB2      GLN  21  -5.764  -2.211  -6.562
  169    HB3  GLN  21           HB3      GLN  21  -7.223  -2.523  -5.622
  170    HG2  GLN  21           HG2      GLN  21  -7.786  -0.137  -5.662
  171    HG3  GLN  21           HG3      GLN  21  -6.305   0.213  -6.552
  172   HE21  GLN  21          HE21      GLN  21  -6.160  -0.424  -8.748
  173   HE22  GLN  21          HE22      GLN  21  -7.575  -0.768  -9.677
  174    H    ARG  22           H        ARG  22  -3.583  -2.996  -4.889
  175    HA   ARG  22           HA       ARG  22  -4.219  -5.408  -3.552
  176    HB2  ARG  22           HB2      ARG  22  -1.577  -4.176  -4.443
  177    HB3  ARG  22           HB3      ARG  22  -1.676  -5.782  -3.754
  178    HG2  ARG  22           HG2      ARG  22  -3.137  -6.491  -5.594
  179    HG3  ARG  22           HG3      ARG  22  -3.047  -4.877  -6.297
  180    HD2  ARG  22           HD2      ARG  22  -0.663  -5.149  -6.715
  181    HD3  ARG  22           HD3      ARG  22  -0.647  -6.691  -5.848
  182    HE   ARG  22           HE       ARG  22  -2.483  -6.653  -8.057
  183   HH11  ARG  22          HH11      ARG  22   0.900  -7.173  -7.184
  184   HH12  ARG  22          HH12      ARG  22   1.228  -8.167  -8.567
  185   HH21  ARG  22          HH21      ARG  22  -2.052  -7.983  -9.853
  186   HH22  ARG  22          HH22      ARG  22  -0.459  -8.626 -10.088
  187    H    LEU  23           H        LEU  23  -2.425  -2.483  -2.594
  188    HA   LEU  23           HA       LEU  23  -1.253  -3.643  -0.241
  189    HB2  LEU  23           HB2      LEU  23  -1.419  -0.778  -1.225
  190    HB3  LEU  23           HB3      LEU  23  -0.394  -1.317   0.080
  191    HG   LEU  23           HG       LEU  23  -0.192  -2.224  -2.798
  192   HD11  LEU  23          HD11      LEU  23   1.647  -0.420  -1.253
  193   HD12  LEU  23          HD12      LEU  23   0.570   0.044  -2.573
  194   HD13  LEU  23          HD13      LEU  23   1.925  -1.036  -2.885
  195   HD21  LEU  23          HD21      LEU  23   0.445  -4.022  -1.301
  196   HD22  LEU  23          HD22      LEU  23   1.596  -2.961  -0.483
  197   HD23  LEU  23          HD23      LEU  23   1.835  -3.397  -2.177
  198    H    GLU  24           H        GLU  24  -3.722  -1.106  -0.744
  199    HA   GLU  24           HA       GLU  24  -4.612  -0.686   1.832
  200    HB2  GLU  24           HB2      GLU  24  -6.280  -0.833  -0.709
  201    HB3  GLU  24           HB3      GLU  24  -6.830  -0.123   0.807
  202    HG2  GLU  24           HG2      GLU  24  -5.117   1.630   0.620
  203    HG3  GLU  24           HG3      GLU  24  -4.514   0.888  -0.868
  204    H    LYS  25           H        LYS  25  -5.411  -3.291  -0.436
  205    HA   LYS  25           HA       LYS  25  -7.548  -4.430   1.045
  206    HB2  LYS  25           HB2      LYS  25  -7.273  -4.786  -1.365
  207    HB3  LYS  25           HB3      LYS  25  -5.746  -5.623  -1.097
  208    HG2  LYS  25           HG2      LYS  25  -6.911  -7.461   0.029
  209    HG3  LYS  25           HG3      LYS  25  -8.448  -6.604  -0.109
  210    HD2  LYS  25           HD2      LYS  25  -6.769  -7.589  -2.445
  211    HD3  LYS  25           HD3      LYS  25  -8.203  -8.397  -1.811
  212    HE2  LYS  25           HE2      LYS  25  -9.568  -6.417  -2.409
  213    HE3  LYS  25           HE3      LYS  25  -8.128  -5.628  -3.058
  214    HZ1  LYS  25           HZ1      LYS  25  -9.399  -6.627  -4.822
  215    HZ2  LYS  25           HZ2      LYS  25  -9.354  -8.140  -4.072
  216    HZ3  LYS  25           HZ3      LYS  25  -7.932  -7.449  -4.666
  217    H    MET  26           H        MET  26  -4.044  -5.053   0.938
  218    HA   MET  26           HA       MET  26  -4.077  -7.291   2.744
  219    HB2  MET  26           HB2      MET  26  -1.791  -5.426   1.984
  220    HB3  MET  26           HB3      MET  26  -1.612  -6.918   2.899
  221    HG2  MET  26           HG2      MET  26  -2.544  -8.152   0.917
  222    HG3  MET  26           HG3      MET  26  -2.474  -6.638   0.019
  223    HE1  MET  26           HE1      MET  26   1.278  -8.749   1.723
  224    HE2  MET  26           HE2      MET  26  -0.359  -9.362   1.945
  225    HE3  MET  26           HE3      MET  26   0.145  -7.876   2.754
  226    H    CYS  27           H        CYS  27  -3.899  -3.848   3.069
  227    HA   CYS  27           HA       CYS  27  -3.039  -3.659   5.776
  228    HB2  CYS  27           HB2      CYS  27  -2.770  -1.853   4.175
  229    HB3  CYS  27           HB3      CYS  27  -4.507  -1.751   3.941
  230    H    LYS  28           H        LYS  28  -6.215  -3.711   4.207
  231    HA   LYS  28           HA       LYS  28  -7.683  -3.108   6.653
  232    HB2  LYS  28           HB2      LYS  28  -8.643  -3.737   3.820
  233    HB3  LYS  28           HB3      LYS  28  -9.681  -3.215   5.147
  234    HG2  LYS  28           HG2      LYS  28  -8.536  -1.058   5.236
  235    HG3  LYS  28           HG3      LYS  28  -7.411  -1.577   3.980
  236    HD2  LYS  28           HD2      LYS  28  -9.363  -1.800   2.405
  237    HD3  LYS  28           HD3      LYS  28 -10.412  -1.135   3.660
  238    HE2  LYS  28           HE2      LYS  28  -9.047   0.936   3.647
  239    HE3  LYS  28           HE3      LYS  28  -8.061   0.248   2.350
  240    HZ1  LYS  28           HZ1      LYS  28 -10.988   0.763   2.162
  241    HZ2  LYS  28           HZ2      LYS  28  -9.987   0.196   0.925
  242    HZ3  LYS  28           HZ3      LYS  28  -9.785   1.762   1.523
  243    H    GLU  29           H        GLU  29  -7.179  -5.773   4.401
  244    HA   GLU  29           HA       GLU  29  -8.488  -7.692   6.256
  245    HB2  GLU  29           HB2      GLU  29  -7.918  -8.022   3.271
  246    HB3  GLU  29           HB3      GLU  29  -8.827  -9.132   4.296
  247    HG2  GLU  29           HG2      GLU  29 -10.624  -7.548   4.549
  248    HG3  GLU  29           HG3      GLU  29  -9.688  -6.276   3.775
  249    H    GLY  30           H        GLY  30  -6.352  -7.280   7.364
  250    HA2  GLY  30           HA2      GLY  30  -4.670  -9.294   7.661
  251    HA3  GLY  30           HA3      GLY  30  -3.973  -8.570   6.212
  252    H    THR  31           H        THR  31  -2.209  -7.406   6.779
  253    HA   THR  31           HA       THR  31  -2.378  -5.552   9.091
  254    HB   THR  31           HB       THR  31   0.036  -5.970   9.561
  255    HG1  THR  31           HG1      THR  31   1.092  -7.669   8.495
  256   HG21  THR  31          HG21      THR  31  -0.170  -8.196  10.599
  257   HG22  THR  31          HG22      THR  31  -1.589  -8.552   9.612
  258   HG23  THR  31          HG23      THR  31  -1.661  -7.278  10.831
  259    H    SER  32           H        SER  32  -1.693  -3.505   8.679
  260    HA   SER  32           HA       SER  32  -0.902  -2.566   6.113
  261    HB2  SER  32           HB2      SER  32  -0.429  -0.422   7.393
  262    HB3  SER  32           HB3      SER  32  -2.052  -1.074   7.627
  263    HG   SER  32           HG       SER  32  -1.636  -1.239   9.660
  264    H    GLU  33           H        GLU  33   0.780  -3.957   8.752
  265    HA   GLU  33           HA       GLU  33   3.414  -3.020   8.454
  266    HB2  GLU  33           HB2      GLU  33   2.483  -5.792   9.342
  267    HB3  GLU  33           HB3      GLU  33   4.036  -5.049   9.723
  268    HG2  GLU  33           HG2      GLU  33   2.972  -3.385  11.129
  269    HG3  GLU  33           HG3      GLU  33   1.369  -3.908  10.612
  270    H    ASP  34           H        ASP  34   1.777  -5.900   7.087
  271    HA   ASP  34           HA       ASP  34   3.983  -6.528   5.329
  272    HB2  ASP  34           HB2      ASP  34   1.239  -7.746   5.734
  273    HB3  ASP  34           HB3      ASP  34   2.265  -8.255   4.394
  274    H    ALA  35           H        ALA  35   1.094  -4.636   5.110
  275    HA   ALA  35           HA       ALA  35   0.852  -4.510   2.280
  276    HB1  ALA  35           HB1      ALA  35   0.015  -2.446   4.346
  277    HB2  ALA  35           HB2      ALA  35  -0.952  -3.824   3.809
  278    HB3  ALA  35           HB3      ALA  35  -0.541  -2.540   2.672
  279    H    GLU  36           H        GLU  36   2.639  -2.478   4.631
  280    HA   GLU  36           HA       GLU  36   3.721  -0.728   2.609
  281    HB2  GLU  36           HB2      GLU  36   5.041   0.290   4.373
  282    HB3  GLU  36           HB3      GLU  36   3.392   0.050   4.937
  283    HG2  GLU  36           HG2      GLU  36   4.137  -1.967   6.182
  284    HG3  GLU  36           HG3      GLU  36   5.791  -1.656   5.654
  285    H    ARG  37           H        ARG  37   4.792  -3.690   4.208
  286    HA   ARG  37           HA       ARG  37   7.399  -3.915   3.173
  287    HB2  ARG  37           HB2      ARG  37   5.306  -6.022   3.800
  288    HB3  ARG  37           HB3      ARG  37   6.898  -6.459   3.200
  289    HG2  ARG  37           HG2      ARG  37   7.949  -5.461   5.163
  290    HG3  ARG  37           HG3      ARG  37   6.372  -4.944   5.769
  291    HD2  ARG  37           HD2      ARG  37   5.655  -7.289   5.953
  292    HD3  ARG  37           HD3      ARG  37   7.202  -7.830   5.292
  293    HE   ARG  37           HE       ARG  37   7.940  -6.376   7.460
  294   HH11  ARG  37          HH11      ARG  37   5.619  -9.012   7.088
  295   HH12  ARG  37          HH12      ARG  37   5.857  -9.603   8.700
  296   HH21  ARG  37          HH21      ARG  37   8.279  -7.182   9.546
  297   HH22  ARG  37          HH22      ARG  37   7.382  -8.556  10.111
  298    H    MET  38           H        MET  38   4.257  -4.856   1.736
  299    HA   MET  38           HA       MET  38   5.397  -5.826  -0.714
  300    HB2  MET  38           HB2      MET  38   2.548  -5.158   0.097
  301    HB3  MET  38           HB3      MET  38   2.955  -5.729  -1.514
  302    HG2  MET  38           HG2      MET  38   3.503  -7.284   1.020
  303    HG3  MET  38           HG3      MET  38   2.071  -7.479   0.025
  304    HE1  MET  38           HE1      MET  38   5.454  -8.903   0.798
  305    HE2  MET  38           HE2      MET  38   6.095  -7.625  -0.234
  306    HE3  MET  38           HE3      MET  38   6.190  -9.310  -0.750
  307    H    ALA  39           H        ALA  39   4.336  -2.719   0.481
  308    HA   ALA  39           HA       ALA  39   3.901  -1.389  -1.989
  309    HB1  ALA  39           HB1      ALA  39   4.026   0.678  -0.656
  310    HB2  ALA  39           HB2      ALA  39   4.704  -0.225   0.704
  311    HB3  ALA  39           HB3      ALA  39   3.053  -0.546   0.165
  312    H    ARG  40           H        ARG  40   6.714  -1.618   0.145
  313    HA   ARG  40           HA       ARG  40   8.414   0.023  -1.456
  314    HB2  ARG  40           HB2      ARG  40  10.155  -0.508   0.124
  315    HB3  ARG  40           HB3      ARG  40   8.659  -0.247   1.007
  316    HG2  ARG  40           HG2      ARG  40   8.395  -2.767   1.112
  317    HG3  ARG  40           HG3      ARG  40  10.032  -2.894   0.461
  318    HD2  ARG  40           HD2      ARG  40  10.162  -3.100   2.855
  319    HD3  ARG  40           HD3      ARG  40  10.825  -1.520   2.420
  320    HE   ARG  40           HE       ARG  40   8.063  -1.303   3.007
  321   HH11  ARG  40          HH11      ARG  40  11.147  -1.719   4.676
  322   HH12  ARG  40          HH12      ARG  40  10.567  -1.005   6.148
  323   HH21  ARG  40          HH21      ARG  40   7.319  -0.436   4.942
  324   HH22  ARG  40          HH22      ARG  40   8.383  -0.275   6.295
  325    H    ASN  41           H        ASN  41   7.612  -3.371  -1.436
  326    HA   ASN  41           HA       ASN  41   9.806  -4.051  -3.285
  327    HB2  ASN  41           HB2      ASN  41   7.856  -5.760  -1.702
  328    HB3  ASN  41           HB3      ASN  41   8.781  -6.440  -3.038
  329   HD21  ASN  41          HD21      ASN  41   8.964  -5.232   0.211
  330   HD22  ASN  41          HD22      ASN  41  10.595  -5.691   0.502
  331    H    CYS  42           H        CYS  42   6.647  -2.959  -3.463
  332    HA   CYS  42           HA       CYS  42   5.810  -4.245  -5.902
  333    HB2  CYS  42           HB2      CYS  42   4.141  -3.263  -4.373
  334    HB3  CYS  42           HB3      CYS  42   4.865  -1.671  -4.552
  335    H    GLU  43           H        GLU  43   6.769  -0.878  -5.179
  336    HA   GLU  43           HA       GLU  43   8.271  -0.601  -7.669
  337    HB2  GLU  43           HB2      GLU  43   5.724   0.985  -7.097
  338    HB3  GLU  43           HB3      GLU  43   6.928   1.510  -8.267
  339    HG2  GLU  43           HG2      GLU  43   6.474  -0.314  -9.729
  340    HG3  GLU  43           HG3      GLU  43   5.586  -1.192  -8.487
  341    H    SER  44           H        SER  44   6.730   1.333  -5.104
  342    HA   SER  44           HA       SER  44   9.178   2.972  -4.856
  343    HB2  SER  44           HB2      SER  44   6.288   3.660  -4.168
  344    HB3  SER  44           HB3      SER  44   7.670   4.760  -4.088
  345    HG   SER  44           HG       SER  44   7.727   3.771  -6.491
  Start of MODEL    4
    1    H1   ALA   1           H1       ALA   1  -4.482   5.328  13.510
    2    H2   ALA   1           H2       ALA   1  -6.111   4.924  13.685
    3    H3   ALA   1           H3       ALA   1  -5.649   6.545  13.635
    4    HA   ALA   1           HA       ALA   1  -6.631   5.849  11.550
    5    HB1  ALA   1           HB1      ALA   1  -4.798   6.690  10.090
    6    HB2  ALA   1           HB2      ALA   1  -3.657   6.466  11.417
    7    HB3  ALA   1           HB3      ALA   1  -4.958   7.647  11.564
    8    HA   PRO   2           HA       PRO   2  -5.647   1.489  10.806
    9    HB2  PRO   2           HB2      PRO   2  -7.425   0.996   8.776
   10    HB3  PRO   2           HB3      PRO   2  -7.916   1.171  10.473
   11    HG2  PRO   2           HG2      PRO   2  -8.089   3.168   8.247
   12    HG3  PRO   2           HG3      PRO   2  -9.249   2.823   9.549
   13    HD2  PRO   2           HD2      PRO   2  -7.504   4.951   9.595
   14    HD3  PRO   2           HD3      PRO   2  -8.171   4.191  11.057
   15    H    CYS   3           H        CYS   3  -6.163   3.283   7.708
   16    HA   CYS   3           HA       CYS   3  -3.628   2.191   6.649
   17    HB2  CYS   3           HB2      CYS   3  -6.326   2.083   5.245
   18    HB3  CYS   3           HB3      CYS   3  -4.788   1.597   4.530
   19    H    GLU   4           H        GLU   4  -4.397   4.845   7.647
   20    HA   GLU   4           HA       GLU   4  -4.883   6.557   5.362
   21    HB2  GLU   4           HB2      GLU   4  -4.214   7.249   8.257
   22    HB3  GLU   4           HB3      GLU   4  -4.741   8.402   7.027
   23    HG2  GLU   4           HG2      GLU   4  -6.354   6.084   8.146
   24    HG3  GLU   4           HG3      GLU   4  -6.611   7.804   8.464
   25    H    ASP   5           H        ASP   5  -2.145   5.994   7.586
   26    HA   ASP   5           HA       ASP   5  -0.217   7.619   6.349
   27    HB2  ASP   5           HB2      ASP   5   0.133   6.574   8.579
   28    HB3  ASP   5           HB3      ASP   5   0.204   4.981   7.833
   29    H    LEU   6           H        LEU   6  -1.125   4.255   5.816
   30    HA   LEU   6           HA       LEU   6   0.680   3.627   3.746
   31    HB2  LEU   6           HB2      LEU   6  -0.535   1.966   5.091
   32    HB3  LEU   6           HB3      LEU   6  -2.052   2.476   4.384
   33    HG   LEU   6           HG       LEU   6  -0.039   1.555   2.376
   34   HD11  LEU   6          HD11      LEU   6  -1.202  -0.452   4.315
   35   HD12  LEU   6          HD12      LEU   6   0.501  -0.008   4.170
   36   HD13  LEU   6          HD13      LEU   6  -0.309  -0.824   2.835
   37   HD21  LEU   6          HD21      LEU   6  -1.978   0.359   1.429
   38   HD22  LEU   6          HD22      LEU   6  -2.358   2.056   1.719
   39   HD23  LEU   6          HD23      LEU   6  -2.953   0.819   2.829
   40    H    LYS   7           H        LYS   7  -2.585   5.081   3.702
   41    HA   LYS   7           HA       LYS   7  -2.929   4.864   0.868
   42    HB2  LYS   7           HB2      LYS   7  -4.836   5.036   2.539
   43    HB3  LYS   7           HB3      LYS   7  -4.472   6.751   2.698
   44    HG2  LYS   7           HG2      LYS   7  -5.046   7.156   0.379
   45    HG3  LYS   7           HG3      LYS   7  -5.169   5.430   0.054
   46    HD2  LYS   7           HD2      LYS   7  -7.399   6.197   0.184
   47    HD3  LYS   7           HD3      LYS   7  -7.107   5.379   1.715
   48    HE2  LYS   7           HE2      LYS   7  -6.865   8.382   1.412
   49    HE3  LYS   7           HE3      LYS   7  -8.396   7.594   1.779
   50    HZ1  LYS   7           HZ1      LYS   7  -7.416   6.691   3.793
   51    HZ2  LYS   7           HZ2      LYS   7  -7.304   8.376   3.781
   52    HZ3  LYS   7           HZ3      LYS   7  -5.942   7.438   3.451
   53    H    GLU   8           H        GLU   8  -1.696   7.361   2.997
   54    HA   GLU   8           HA       GLU   8  -1.225   9.358   1.031
   55    HB2  GLU   8           HB2      GLU   8   0.188   8.830   3.668
   56    HB3  GLU   8           HB3      GLU   8   0.435  10.273   2.684
   57    HG2  GLU   8           HG2      GLU   8  -2.194   9.416   3.925
   58    HG3  GLU   8           HG3      GLU   8  -1.115  10.648   4.576
   59    H    ARG   9           H        ARG   9   0.598   6.503   2.023
   60    HA   ARG   9           HA       ARG   9   2.959   7.069   0.492
   61    HB2  ARG   9           HB2      ARG   9   1.869   4.463   1.635
   62    HB3  ARG   9           HB3      ARG   9   3.429   4.582   0.815
   63    HG2  ARG   9           HG2      ARG   9   4.251   6.127   2.502
   64    HG3  ARG   9           HG3      ARG   9   2.670   6.177   3.285
   65    HD2  ARG   9           HD2      ARG   9   2.889   3.797   3.896
   66    HD3  ARG   9           HD3      ARG   9   4.452   3.717   3.072
   67    HE   ARG   9           HE       ARG   9   3.846   5.191   5.553
   68   HH11  ARG   9          HH11      ARG   9   6.262   3.958   3.287
   69   HH12  ARG   9          HH12      ARG   9   7.591   4.301   4.347
   70   HH21  ARG   9          HH21      ARG   9   5.611   5.690   6.893
   71   HH22  ARG   9          HH22      ARG   9   7.218   5.278   6.387
   72    H    LEU  10           H        LEU  10  -0.147   5.572  -0.242
   73    HA   LEU  10           HA       LEU  10   0.500   4.375  -2.720
   74    HB2  LEU  10           HB2      LEU  10  -2.172   5.622  -1.982
   75    HB3  LEU  10           HB3      LEU  10  -1.891   4.411  -3.225
   76    HG   LEU  10           HG       LEU  10  -1.683   4.006  -0.219
   77   HD11  LEU  10          HD11      LEU  10  -3.588   2.525  -0.472
   78   HD12  LEU  10          HD12      LEU  10  -3.652   2.864  -2.204
   79   HD13  LEU  10          HD13      LEU  10  -3.972   4.149  -1.037
   80   HD21  LEU  10          HD21      LEU  10   0.021   2.633  -1.295
   81   HD22  LEU  10          HD22      LEU  10  -1.179   1.962  -2.401
   82   HD23  LEU  10          HD23      LEU  10  -1.281   1.628  -0.670
   83    H    LYS  11           H        LYS  11  -0.644   7.667  -1.917
   84    HA   LYS  11           HA       LYS  11  -0.553   8.565  -4.658
   85    HB2  LYS  11           HB2      LYS  11  -1.200  10.764  -3.811
   86    HB3  LYS  11           HB3      LYS  11  -2.216   9.510  -3.112
   87    HG2  LYS  11           HG2      LYS  11  -1.022   9.648  -1.001
   88    HG3  LYS  11           HG3      LYS  11   0.131  10.793  -1.683
   89    HD2  LYS  11           HD2      LYS  11  -2.850  11.372  -1.436
   90    HD3  LYS  11           HD3      LYS  11  -1.676  11.785  -0.185
   91    HE2  LYS  11           HE2      LYS  11  -2.038  13.767  -1.461
   92    HE3  LYS  11           HE3      LYS  11  -0.454  13.162  -1.930
   93    HZ1  LYS  11           HZ1      LYS  11  -2.963  12.780  -3.475
   94    HZ2  LYS  11           HZ2      LYS  11  -1.423  12.268  -3.950
   95    HZ3  LYS  11           HZ3      LYS  11  -1.766  13.916  -3.822
   96    H    LYS  12           H        LYS  12   1.678   8.679  -1.913
   97    HA   LYS  12           HA       LYS  12   3.357  10.799  -2.891
   98    HB2  LYS  12           HB2      LYS  12   3.100   9.904  -0.431
   99    HB3  LYS  12           HB3      LYS  12   4.277   8.685  -0.891
  100    HG2  LYS  12           HG2      LYS  12   4.810  11.671  -1.097
  101    HG3  LYS  12           HG3      LYS  12   5.159  10.736   0.356
  102    HD2  LYS  12           HD2      LYS  12   6.801   9.394  -0.848
  103    HD3  LYS  12           HD3      LYS  12   6.362  10.158  -2.376
  104    HE2  LYS  12           HE2      LYS  12   7.622  11.581  -0.006
  105    HE3  LYS  12           HE3      LYS  12   8.467  11.070  -1.466
  106    HZ1  LYS  12           HZ1      LYS  12   7.007  12.554  -2.751
  107    HZ2  LYS  12           HZ2      LYS  12   7.923  13.393  -1.610
  108    HZ3  LYS  12           HZ3      LYS  12   6.288  13.090  -1.319
  109    H    LEU  13           H        LEU  13   3.521   7.259  -2.964
  110    HA   LEU  13           HA       LEU  13   5.950   7.149  -4.516
  111    HB2  LEU  13           HB2      LEU  13   3.924   5.080  -3.612
  112    HB3  LEU  13           HB3      LEU  13   5.140   4.655  -4.804
  113    HG   LEU  13           HG       LEU  13   6.946   5.117  -3.197
  114   HD11  LEU  13          HD11      LEU  13   5.957   6.905  -1.891
  115   HD12  LEU  13          HD12      LEU  13   6.519   5.606  -0.842
  116   HD13  LEU  13          HD13      LEU  13   4.794   5.782  -1.185
  117   HD21  LEU  13          HD21      LEU  13   6.021   2.855  -3.269
  118   HD22  LEU  13          HD22      LEU  13   4.839   3.279  -2.027
  119   HD23  LEU  13          HD23      LEU  13   6.564   3.259  -1.640
  120    H    GLY  14           H        GLY  14   2.609   7.625  -5.218
  121    HA2  GLY  14           HA2      GLY  14   1.376   7.813  -7.138
  122    HA3  GLY  14           HA3      GLY  14   2.900   8.221  -7.929
  123    H    MET  15           H        MET  15   1.520   5.272  -6.476
  124    HA   MET  15           HA       MET  15   3.117   3.600  -8.155
  125    HB2  MET  15           HB2      MET  15   2.159   1.790  -6.758
  126    HB3  MET  15           HB3      MET  15   2.830   3.101  -5.804
  127    HG2  MET  15           HG2      MET  15   0.520   3.957  -5.437
  128    HG3  MET  15           HG3      MET  15  -0.101   2.577  -6.325
  129    HE1  MET  15           HE1      MET  15   2.242   3.501  -3.203
  130    HE2  MET  15           HE2      MET  15   3.086   2.199  -4.044
  131    HE3  MET  15           HE3      MET  15   2.364   1.907  -2.460
  132    H    SER  16           H        SER  16   1.976   1.472  -8.938
  133    HA   SER  16           HA       SER  16   0.309   2.042 -11.139
  134    HB2  SER  16           HB2      SER  16   0.743  -0.633  -9.730
  135    HB3  SER  16           HB3      SER  16   0.159  -0.414 -11.381
  136    HG   SER  16           HG       SER  16   2.736   0.089 -10.325
  137    H    GLU  17           H        GLU  17  -1.914   1.503 -11.514
  138    HA   GLU  17           HA       GLU  17  -3.689   2.062  -9.368
  139    HB2  GLU  17           HB2      GLU  17  -3.942   2.136 -12.160
  140    HB3  GLU  17           HB3      GLU  17  -4.942   0.760 -11.752
  141    HG2  GLU  17           HG2      GLU  17  -6.345   2.710 -11.821
  142    HG3  GLU  17           HG3      GLU  17  -6.199   2.194 -10.138
  143    H    GLU  18           H        GLU  18  -2.366  -0.904 -10.667
  144    HA   GLU  18           HA       GLU  18  -4.087  -2.685  -9.238
  145    HB2  GLU  18           HB2      GLU  18  -2.712  -3.462 -11.146
  146    HB3  GLU  18           HB3      GLU  18  -1.241  -3.041 -10.276
  147    HG2  GLU  18           HG2      GLU  18  -1.980  -4.766  -8.509
  148    HG3  GLU  18           HG3      GLU  18  -3.180  -5.294  -9.687
  149    H    CYS  19           H        CYS  19  -1.098  -0.925  -8.494
  150    HA   CYS  19           HA       CYS  19  -0.203  -2.529  -6.347
  151    HB2  CYS  19           HB2      CYS  19   1.150  -0.747  -7.675
  152    HB3  CYS  19           HB3      CYS  19   0.362   0.444  -6.668
  153    H    ARG  20           H        ARG  20  -1.911   0.615  -6.370
  154    HA   ARG  20           HA       ARG  20  -2.161   0.741  -3.554
  155    HB2  ARG  20           HB2      ARG  20  -3.963   2.584  -4.178
  156    HB3  ARG  20           HB3      ARG  20  -2.251   2.862  -4.402
  157    HG2  ARG  20           HG2      ARG  20  -3.439   3.762  -6.257
  158    HG3  ARG  20           HG3      ARG  20  -2.501   2.377  -6.810
  159    HD2  ARG  20           HD2      ARG  20  -4.783   2.526  -7.805
  160    HD3  ARG  20           HD3      ARG  20  -4.490   1.018  -6.941
  161    HE   ARG  20           HE       ARG  20  -6.124   1.553  -5.465
  162   HH11  ARG  20          HH11      ARG  20  -5.441   4.456  -7.377
  163   HH12  ARG  20          HH12      ARG  20  -6.786   5.335  -6.722
  164   HH21  ARG  20          HH21      ARG  20  -7.836   2.806  -4.585
  165   HH22  ARG  20          HH22      ARG  20  -8.114   4.413  -5.171
  166    H    GLN  21           H        GLN  21  -4.319  -0.633  -6.001
  167    HA   GLN  21           HA       GLN  21  -6.576  -0.987  -4.256
  168    HB2  GLN  21           HB2      GLN  21  -5.844  -2.299  -6.904
  169    HB3  GLN  21           HB3      GLN  21  -7.322  -2.690  -6.021
  170    HG2  GLN  21           HG2      GLN  21  -7.953  -0.270  -6.140
  171    HG3  GLN  21           HG3      GLN  21  -6.561   0.001  -7.188
  172   HE21  GLN  21          HE21      GLN  21  -6.613  -0.914  -9.317
  173   HE22  GLN  21          HE22      GLN  21  -8.083  -1.433 -10.042
  174    H    ARG  22           H        ARG  22  -3.754  -2.927  -5.070
  175    HA   ARG  22           HA       ARG  22  -4.443  -5.284  -3.660
  176    HB2  ARG  22           HB2      ARG  22  -1.806  -4.069  -4.558
  177    HB3  ARG  22           HB3      ARG  22  -1.821  -5.517  -3.563
  178    HG2  ARG  22           HG2      ARG  22  -3.192  -6.654  -5.312
  179    HG3  ARG  22           HG3      ARG  22  -3.035  -5.216  -6.325
  180    HD2  ARG  22           HD2      ARG  22  -0.647  -5.522  -6.497
  181    HD3  ARG  22           HD3      ARG  22  -0.658  -6.795  -5.274
  182    HE   ARG  22           HE       ARG  22  -2.240  -7.335  -7.642
  183   HH11  ARG  22          HH11      ARG  22   0.938  -7.720  -6.158
  184   HH12  ARG  22          HH12      ARG  22   1.373  -9.063  -7.164
  185   HH21  ARG  22          HH21      ARG  22  -1.674  -9.141  -8.897
  186   HH22  ARG  22          HH22      ARG  22  -0.111  -9.868  -8.718
  187    H    LEU  23           H        LEU  23  -2.705  -2.313  -2.737
  188    HA   LEU  23           HA       LEU  23  -1.733  -3.394  -0.279
  189    HB2  LEU  23           HB2      LEU  23  -1.641  -0.615  -1.459
  190    HB3  LEU  23           HB3      LEU  23  -0.822  -1.072   0.016
  191    HG   LEU  23           HG       LEU  23  -0.290  -2.205  -2.746
  192   HD11  LEU  23          HD11      LEU  23   1.438  -0.424  -1.040
  193   HD12  LEU  23          HD12      LEU  23   0.559   0.044  -2.499
  194   HD13  LEU  23          HD13      LEU  23   1.876  -1.121  -2.605
  195   HD21  LEU  23          HD21      LEU  23   0.043  -3.975  -1.120
  196   HD22  LEU  23          HD22      LEU  23   1.074  -2.930  -0.140
  197   HD23  LEU  23          HD23      LEU  23   1.596  -3.433  -1.749
  198    H    GLU  24           H        GLU  24  -4.345  -1.091  -1.076
  199    HA   GLU  24           HA       GLU  24  -5.187  -0.511   1.549
  200    HB2  GLU  24           HB2      GLU  24  -6.660  -0.654  -1.101
  201    HB3  GLU  24           HB3      GLU  24  -7.540  -0.309   0.383
  202    HG2  GLU  24           HG2      GLU  24  -5.159   1.344  -0.494
  203    HG3  GLU  24           HG3      GLU  24  -6.793   1.676  -1.069
  204    H    LYS  25           H        LYS  25  -5.816  -3.284  -0.568
  205    HA   LYS  25           HA       LYS  25  -7.773  -4.579   1.098
  206    HB2  LYS  25           HB2      LYS  25  -7.727  -5.091  -1.277
  207    HB3  LYS  25           HB3      LYS  25  -6.045  -5.591  -1.196
  208    HG2  LYS  25           HG2      LYS  25  -6.652  -7.580   0.093
  209    HG3  LYS  25           HG3      LYS  25  -8.338  -7.066   0.150
  210    HD2  LYS  25           HD2      LYS  25  -6.790  -7.798  -2.369
  211    HD3  LYS  25           HD3      LYS  25  -7.942  -8.844  -1.537
  212    HE2  LYS  25           HE2      LYS  25  -8.583  -6.192  -2.877
  213    HE3  LYS  25           HE3      LYS  25  -8.965  -7.800  -3.498
  214    HZ1  LYS  25           HZ1      LYS  25 -10.867  -6.717  -2.415
  215    HZ2  LYS  25           HZ2      LYS  25 -10.024  -6.687  -0.947
  216    HZ3  LYS  25           HZ3      LYS  25 -10.444  -8.164  -1.653
  217    H    MET  26           H        MET  26  -4.293  -4.917   0.645
  218    HA   MET  26           HA       MET  26  -3.876  -7.134   2.357
  219    HB2  MET  26           HB2      MET  26  -1.948  -5.008   1.352
  220    HB3  MET  26           HB3      MET  26  -1.459  -6.446   2.237
  221    HG2  MET  26           HG2      MET  26  -2.827  -6.435  -0.464
  222    HG3  MET  26           HG3      MET  26  -1.103  -6.662  -0.193
  223    HE1  MET  26           HE1      MET  26  -1.160  -8.519   2.455
  224    HE2  MET  26           HE2      MET  26  -0.087  -8.785   1.082
  225    HE3  MET  26           HE3      MET  26  -1.072 -10.110   1.703
  226    H    CYS  27           H        CYS  27  -4.049  -3.677   2.851
  227    HA   CYS  27           HA       CYS  27  -2.825  -3.596   5.434
  228    HB2  CYS  27           HB2      CYS  27  -2.835  -1.608   4.017
  229    HB3  CYS  27           HB3      CYS  27  -4.595  -1.582   4.017
  230    H    LYS  28           H        LYS  28  -6.209  -3.695   4.299
  231    HA   LYS  28           HA       LYS  28  -7.239  -3.318   7.024
  232    HB2  LYS  28           HB2      LYS  28  -8.830  -3.752   4.459
  233    HB3  LYS  28           HB3      LYS  28  -9.434  -3.110   5.987
  234    HG2  LYS  28           HG2      LYS  28  -8.070  -1.091   5.706
  235    HG3  LYS  28           HG3      LYS  28  -7.371  -1.747   4.225
  236    HD2  LYS  28           HD2      LYS  28  -9.940  -1.859   3.479
  237    HD3  LYS  28           HD3      LYS  28 -10.120  -0.615   4.717
  238    HE2  LYS  28           HE2      LYS  28  -8.352  -0.502   2.248
  239    HE3  LYS  28           HE3      LYS  28  -9.809   0.444   2.555
  240    HZ1  LYS  28           HZ1      LYS  28  -7.859   1.770   2.932
  241    HZ2  LYS  28           HZ2      LYS  28  -7.236   0.644   4.022
  242    HZ3  LYS  28           HZ3      LYS  28  -8.629   1.508   4.410
  243    H    GLU  29           H        GLU  29  -7.421  -5.746   4.433
  244    HA   GLU  29           HA       GLU  29  -8.809  -7.697   6.087
  245    HB2  GLU  29           HB2      GLU  29  -7.839  -7.870   3.200
  246    HB3  GLU  29           HB3      GLU  29  -8.880  -9.052   3.999
  247    HG2  GLU  29           HG2      GLU  29 -10.640  -7.358   4.251
  248    HG3  GLU  29           HG3      GLU  29  -9.591  -6.141   3.521
  249    H    GLY  30           H        GLY  30  -5.629  -6.818   5.799
  250    HA2  GLY  30           HA2      GLY  30  -4.761  -9.397   6.989
  251    HA3  GLY  30           HA3      GLY  30  -3.768  -8.591   5.774
  252    H    THR  31           H        THR  31  -2.382  -7.021   6.421
  253    HA   THR  31           HA       THR  31  -2.817  -5.445   8.847
  254    HB   THR  31           HB       THR  31  -0.317  -5.774   9.510
  255    HG1  THR  31           HG1      THR  31  -0.612  -7.678   7.532
  256   HG21  THR  31          HG21      THR  31  -2.147  -6.647  10.927
  257   HG22  THR  31          HG22      THR  31  -0.750  -7.729  10.924
  258   HG23  THR  31          HG23      THR  31  -2.178  -8.128   9.966
  259    H    SER  32           H        SER  32  -1.950  -3.406   8.685
  260    HA   SER  32           HA       SER  32  -1.099  -2.278   6.270
  261    HB2  SER  32           HB2      SER  32  -2.070  -0.937   8.111
  262    HB3  SER  32           HB3      SER  32  -0.659  -1.255   9.116
  263    HG   SER  32           HG       SER  32   0.582  -0.168   7.410
  264    H    GLU  33           H        GLU  33   0.675  -3.780   8.888
  265    HA   GLU  33           HA       GLU  33   3.278  -2.842   8.593
  266    HB2  GLU  33           HB2      GLU  33   2.483  -5.698   9.303
  267    HB3  GLU  33           HB3      GLU  33   3.967  -4.866   9.778
  268    HG2  GLU  33           HG2      GLU  33   2.708  -3.378  11.235
  269    HG3  GLU  33           HG3      GLU  33   1.180  -4.070  10.677
  270    H    ASP  34           H        ASP  34   1.779  -5.700   7.163
  271    HA   ASP  34           HA       ASP  34   4.031  -6.528   5.630
  272    HB2  ASP  34           HB2      ASP  34   2.426  -8.177   6.373
  273    HB3  ASP  34           HB3      ASP  34   1.094  -7.332   5.588
  274    H    ALA  35           H        ALA  35   1.080  -4.718   4.934
  275    HA   ALA  35           HA       ALA  35   1.303  -4.695   2.106
  276    HB1  ALA  35           HB1      ALA  35  -0.518  -3.068   2.208
  277    HB2  ALA  35           HB2      ALA  35  -0.235  -2.841   3.939
  278    HB3  ALA  35           HB3      ALA  35  -0.799  -4.400   3.332
  279    H    GLU  36           H        GLU  36   2.478  -2.414   4.576
  280    HA   GLU  36           HA       GLU  36   3.312  -0.395   2.689
  281    HB2  GLU  36           HB2      GLU  36   4.392   0.711   4.613
  282    HB3  GLU  36           HB3      GLU  36   2.736   0.240   4.999
  283    HG2  GLU  36           HG2      GLU  36   3.656  -1.792   6.146
  284    HG3  GLU  36           HG3      GLU  36   5.278  -1.162   5.856
  285    H    ARG  37           H        ARG  37   4.806  -3.167   4.281
  286    HA   ARG  37           HA       ARG  37   7.453  -2.796   3.274
  287    HB2  ARG  37           HB2      ARG  37   5.999  -5.293   4.230
  288    HB3  ARG  37           HB3      ARG  37   7.675  -5.306   3.686
  289    HG2  ARG  37           HG2      ARG  37   8.221  -3.656   5.476
  290    HG3  ARG  37           HG3      ARG  37   6.563  -3.805   6.071
  291    HD2  ARG  37           HD2      ARG  37   8.517  -6.116   5.818
  292    HD3  ARG  37           HD3      ARG  37   8.244  -5.211   7.308
  293    HE   ARG  37           HE       ARG  37   6.281  -6.970   5.953
  294   HH11  ARG  37          HH11      ARG  37   7.346  -5.321   8.908
  295   HH12  ARG  37          HH12      ARG  37   6.160  -6.102   9.911
  296   HH21  ARG  37          HH21      ARG  37   4.729  -7.979   7.308
  297   HH22  ARG  37          HH22      ARG  37   4.685  -7.604   9.002
  298    H    MET  38           H        MET  38   4.504  -4.213   1.941
  299    HA   MET  38           HA       MET  38   5.804  -5.250  -0.424
  300    HB2  MET  38           HB2      MET  38   2.865  -4.929   0.277
  301    HB3  MET  38           HB3      MET  38   3.417  -5.587  -1.255
  302    HG2  MET  38           HG2      MET  38   4.072  -6.808   1.442
  303    HG3  MET  38           HG3      MET  38   2.718  -7.303   0.437
  304    HE1  MET  38           HE1      MET  38   6.445  -7.867   1.270
  305    HE2  MET  38           HE2      MET  38   6.719  -6.701  -0.025
  306    HE3  MET  38           HE3      MET  38   7.160  -8.394  -0.251
  307    H    ALA  39           H        ALA  39   4.364  -2.223   0.565
  308    HA   ALA  39           HA       ALA  39   4.025  -1.012  -1.977
  309    HB1  ALA  39           HB1      ALA  39   3.051  -0.087   0.086
  310    HB2  ALA  39           HB2      ALA  39   4.020   1.126  -0.753
  311    HB3  ALA  39           HB3      ALA  39   4.662   0.320   0.684
  312    H    ARG  40           H        ARG  40   6.782  -1.143   0.243
  313    HA   ARG  40           HA       ARG  40   8.497   0.489  -1.415
  314    HB2  ARG  40           HB2      ARG  40  10.160   0.228   0.307
  315    HB3  ARG  40           HB3      ARG  40   8.608   0.496   1.091
  316    HG2  ARG  40           HG2      ARG  40   8.441  -1.933   1.558
  317    HG3  ARG  40           HG3      ARG  40  10.011  -2.183   0.794
  318    HD2  ARG  40           HD2      ARG  40  10.991  -0.615   2.550
  319    HD3  ARG  40           HD3      ARG  40   9.416  -0.656   3.355
  320    HE   ARG  40           HE       ARG  40  10.637  -3.235   2.803
  321   HH11  ARG  40          HH11      ARG  40  10.178  -0.713   5.231
  322   HH12  ARG  40          HH12      ARG  40  10.566  -1.761   6.558
  323   HH21  ARG  40          HH21      ARG  40  11.126  -4.589   4.538
  324   HH22  ARG  40          HH22      ARG  40  11.106  -3.970   6.162
  325    H    ASN  41           H        ASN  41   7.447  -2.482  -2.019
  326    HA   ASN  41           HA       ASN  41   9.906  -3.230  -3.497
  327    HB2  ASN  41           HB2      ASN  41   7.949  -5.044  -2.030
  328    HB3  ASN  41           HB3      ASN  41   8.920  -5.647  -3.370
  329   HD21  ASN  41          HD21      ASN  41   9.020  -4.464  -0.084
  330   HD22  ASN  41          HD22      ASN  41  10.606  -5.035   0.274
  331    H    CYS  42           H        CYS  42   6.539  -2.546  -3.528
  332    HA   CYS  42           HA       CYS  42   5.580  -4.039  -5.717
  333    HB2  CYS  42           HB2      CYS  42   4.135  -2.910  -4.042
  334    HB3  CYS  42           HB3      CYS  42   4.627  -1.346  -4.660
  335    H    GLU  43           H        GLU  43   6.787  -0.714  -5.518
  336    HA   GLU  43           HA       GLU  43   6.844  -0.479  -8.467
  337    HB2  GLU  43           HB2      GLU  43   7.034   1.734  -6.376
  338    HB3  GLU  43           HB3      GLU  43   6.891   1.943  -8.121
  339    HG2  GLU  43           HG2      GLU  43   4.800   0.746  -6.290
  340    HG3  GLU  43           HG3      GLU  43   4.771   2.372  -6.971
  341    H    SER  44           H        SER  44   8.695   0.464  -5.571
  342    HA   SER  44           HA       SER  44  11.256   0.024  -6.963
  343    HB2  SER  44           HB2      SER  44  10.577   2.617  -5.496
  344    HB3  SER  44           HB3      SER  44  12.096   2.231  -6.305
  345    HG   SER  44           HG       SER  44  10.420   1.877  -8.168
  Start of MODEL    5
    1    H1   ALA   1           H1       ALA   1  -3.319   7.439  12.203
    2    H2   ALA   1           H2       ALA   1  -2.614   6.379  11.092
    3    H3   ALA   1           H3       ALA   1  -3.282   5.782  12.519
    4    HA   ALA   1           HA       ALA   1  -5.463   6.375  11.850
    5    HB1  ALA   1           HB1      ALA   1  -4.869   8.433  10.639
    6    HB2  ALA   1           HB2      ALA   1  -5.878   7.392   9.635
    7    HB3  ALA   1           HB3      ALA   1  -4.138   7.477   9.345
    8    HA   PRO   2           HA       PRO   2  -5.311   2.238  10.268
    9    HB2  PRO   2           HB2      PRO   2  -7.930   1.774   9.602
   10    HB3  PRO   2           HB3      PRO   2  -7.389   1.957  11.286
   11    HG2  PRO   2           HG2      PRO   2  -8.686   4.004   9.492
   12    HG3  PRO   2           HG3      PRO   2  -9.029   3.628  11.198
   13    HD2  PRO   2           HD2      PRO   2  -7.476   5.746  10.454
   14    HD3  PRO   2           HD3      PRO   2  -7.216   4.865  11.975
   15    H    CYS   3           H        CYS   3  -4.002   2.344   8.466
   16    HA   CYS   3           HA       CYS   3  -3.338   2.001   6.351
   17    HB2  CYS   3           HB2      CYS   3  -6.274   1.627   5.653
   18    HB3  CYS   3           HB3      CYS   3  -4.902   1.111   4.673
   19    H    GLU   4           H        GLU   4  -4.716   4.743   7.291
   20    HA   GLU   4           HA       GLU   4  -5.415   5.980   4.756
   21    HB2  GLU   4           HB2      GLU   4  -5.267   7.139   7.561
   22    HB3  GLU   4           HB3      GLU   4  -5.882   7.999   6.154
   23    HG2  GLU   4           HG2      GLU   4  -7.092   5.441   7.267
   24    HG3  GLU   4           HG3      GLU   4  -7.651   7.065   7.665
   25    H    ASP   5           H        ASP   5  -2.830   6.251   7.212
   26    HA   ASP   5           HA       ASP   5  -1.306   8.334   6.038
   27    HB2  ASP   5           HB2      ASP   5  -0.106   5.959   7.546
   28    HB3  ASP   5           HB3      ASP   5   0.580   7.575   7.371
   29    H    LEU   6           H        LEU   6  -1.365   4.872   5.611
   30    HA   LEU   6           HA       LEU   6   0.825   4.604   3.834
   31    HB2  LEU   6           HB2      LEU   6  -0.164   2.819   5.291
   32    HB3  LEU   6           HB3      LEU   6  -1.573   2.785   4.255
   33    HG   LEU   6           HG       LEU   6   1.025   2.300   2.841
   34   HD11  LEU   6          HD11      LEU   6   1.237  -0.028   3.573
   35   HD12  LEU   6          HD12      LEU   6  -0.044   0.217   4.764
   36   HD13  LEU   6          HD13      LEU   6   1.484   1.088   4.915
   37   HD21  LEU   6          HD21      LEU   6  -1.648   0.837   2.773
   38   HD22  LEU   6          HD22      LEU   6  -0.289   0.557   1.680
   39   HD23  LEU   6          HD23      LEU   6  -1.131   2.105   1.656
   40    H    LYS   7           H        LYS   7  -2.709   4.799   3.361
   41    HA   LYS   7           HA       LYS   7  -2.862   4.514   0.582
   42    HB2  LYS   7           HB2      LYS   7  -4.804   4.351   2.058
   43    HB3  LYS   7           HB3      LYS   7  -4.657   6.049   2.486
   44    HG2  LYS   7           HG2      LYS   7  -5.141   6.609   0.059
   45    HG3  LYS   7           HG3      LYS   7  -5.478   4.895  -0.205
   46    HD2  LYS   7           HD2      LYS   7  -7.569   6.118   0.163
   47    HD3  LYS   7           HD3      LYS   7  -7.284   4.992   1.494
   48    HE2  LYS   7           HE2      LYS   7  -6.416   6.883   2.871
   49    HE3  LYS   7           HE3      LYS   7  -6.756   7.988   1.539
   50    HZ1  LYS   7           HZ1      LYS   7  -8.742   6.382   3.037
   51    HZ2  LYS   7           HZ2      LYS   7  -9.101   7.410   1.744
   52    HZ3  LYS   7           HZ3      LYS   7  -8.487   8.044   3.186
   53    H    GLU   8           H        GLU   8  -2.488   7.469   2.546
   54    HA   GLU   8           HA       GLU   8  -2.689   9.274   0.326
   55    HB2  GLU   8           HB2      GLU   8  -2.212  11.048   1.889
   56    HB3  GLU   8           HB3      GLU   8  -3.321   9.918   2.658
   57    HG2  GLU   8           HG2      GLU   8  -1.423   8.933   3.909
   58    HG3  GLU   8           HG3      GLU   8  -0.336  10.104   3.167
   59    H    ARG   9           H        ARG   9  -0.076   7.522   1.871
   60    HA   ARG   9           HA       ARG   9   2.044   8.934   0.532
   61    HB2  ARG   9           HB2      ARG   9   1.960   6.275   1.981
   62    HB3  ARG   9           HB3      ARG   9   3.423   6.874   1.194
   63    HG2  ARG   9           HG2      ARG   9   3.372   8.887   2.631
   64    HG3  ARG   9           HG3      ARG   9   1.913   8.286   3.421
   65    HD2  ARG   9           HD2      ARG   9   3.786   7.803   4.843
   66    HD3  ARG   9           HD3      ARG   9   3.208   6.283   4.157
   67    HE   ARG   9           HE       ARG   9   5.345   7.440   2.621
   68   HH11  ARG   9          HH11      ARG   9   4.675   5.453   5.445
   69   HH12  ARG   9          HH12      ARG   9   6.224   4.683   5.415
   70   HH21  ARG   9          HH21      ARG   9   7.368   6.433   2.617
   71   HH22  ARG   9          HH22      ARG   9   7.757   5.239   3.808
   72    H    LEU  10           H        LEU  10  -0.082   6.231  -0.287
   73    HA   LEU  10           HA       LEU  10   1.416   5.086  -2.400
   74    HB2  LEU  10           HB2      LEU  10  -1.617   5.178  -2.163
   75    HB3  LEU  10           HB3      LEU  10  -0.689   4.074  -3.171
   76    HG   LEU  10           HG       LEU  10  -0.814   4.110  -0.139
   77   HD11  LEU  10          HD11      LEU  10  -1.785   1.900  -0.334
   78   HD12  LEU  10          HD12      LEU  10  -1.705   2.003  -2.092
   79   HD13  LEU  10          HD13      LEU  10  -2.751   3.101  -1.191
   80   HD21  LEU  10          HD21      LEU  10   1.483   3.599  -0.784
   81   HD22  LEU  10          HD22      LEU  10   0.913   2.329  -1.870
   82   HD23  LEU  10          HD23      LEU  10   0.684   2.173  -0.127
   83    H    LYS  11           H        LYS  11  -0.950   7.718  -2.363
   84    HA   LYS  11           HA       LYS  11  -0.749   8.269  -5.194
   85    HB2  LYS  11           HB2      LYS  11  -2.140  10.260  -4.702
   86    HB3  LYS  11           HB3      LYS  11  -2.836   8.784  -4.042
   87    HG2  LYS  11           HG2      LYS  11  -2.010   9.381  -1.797
   88    HG3  LYS  11           HG3      LYS  11  -1.289  10.856  -2.440
   89    HD2  LYS  11           HD2      LYS  11  -4.263  10.199  -2.395
   90    HD3  LYS  11           HD3      LYS  11  -3.429  11.281  -1.278
   91    HE2  LYS  11           HE2      LYS  11  -3.711  11.706  -4.279
   92    HE3  LYS  11           HE3      LYS  11  -4.616  12.553  -3.023
   93    HZ1  LYS  11           HZ1      LYS  11  -2.739  13.833  -3.881
   94    HZ2  LYS  11           HZ2      LYS  11  -1.671  12.646  -3.335
   95    HZ3  LYS  11           HZ3      LYS  11  -2.590  13.527  -2.227
   96    H    LYS  12           H        LYS  12   0.945   9.288  -2.301
   97    HA   LYS  12           HA       LYS  12   1.979  11.777  -3.249
   98    HB2  LYS  12           HB2      LYS  12   1.810  11.456  -0.875
   99    HB3  LYS  12           HB3      LYS  12   2.698   9.947  -0.938
  100    HG2  LYS  12           HG2      LYS  12   4.046  11.686   0.095
  101    HG3  LYS  12           HG3      LYS  12   4.779  11.149  -1.418
  102    HD2  LYS  12           HD2      LYS  12   3.836  13.169  -2.557
  103    HD3  LYS  12           HD3      LYS  12   3.182  13.713  -1.007
  104    HE2  LYS  12           HE2      LYS  12   5.435  13.920  -0.092
  105    HE3  LYS  12           HE3      LYS  12   6.133  13.237  -1.562
  106    HZ1  LYS  12           HZ1      LYS  12   5.270  15.147  -2.778
  107    HZ2  LYS  12           HZ2      LYS  12   6.351  15.603  -1.564
  108    HZ3  LYS  12           HZ3      LYS  12   4.688  15.813  -1.337
  109    H    LEU  13           H        LEU  13   3.425   8.481  -3.034
  110    HA   LEU  13           HA       LEU  13   5.785   9.376  -4.510
  111    HB2  LEU  13           HB2      LEU  13   6.883   7.473  -3.871
  112    HB3  LEU  13           HB3      LEU  13   5.738   7.604  -2.556
  113    HG   LEU  13           HG       LEU  13   5.524   5.668  -4.905
  114   HD11  LEU  13          HD11      LEU  13   7.345   5.109  -3.385
  115   HD12  LEU  13          HD12      LEU  13   6.038   3.935  -3.250
  116   HD13  LEU  13          HD13      LEU  13   6.243   5.175  -2.005
  117   HD21  LEU  13          HD21      LEU  13   3.681   4.614  -3.691
  118   HD22  LEU  13          HD22      LEU  13   3.297   6.294  -4.059
  119   HD23  LEU  13          HD23      LEU  13   3.785   5.842  -2.424
  120    H    GLY  14           H        GLY  14   2.730   7.905  -5.085
  121    HA2  GLY  14           HA2      GLY  14   1.564   7.515  -6.997
  122    HA3  GLY  14           HA3      GLY  14   2.803   8.415  -7.858
  123    H    MET  15           H        MET  15   2.065   5.223  -6.474
  124    HA   MET  15           HA       MET  15   4.065   3.899  -8.153
  125    HB2  MET  15           HB2      MET  15   3.438   1.911  -6.802
  126    HB3  MET  15           HB3      MET  15   3.963   3.259  -5.817
  127    HG2  MET  15           HG2      MET  15   1.342   3.715  -5.648
  128    HG3  MET  15           HG3      MET  15   1.264   1.986  -5.996
  129    HE1  MET  15           HE1      MET  15   3.809   0.881  -2.978
  130    HE2  MET  15           HE2      MET  15   4.405   1.598  -4.474
  131    HE3  MET  15           HE3      MET  15   3.168   0.341  -4.527
  132    H    SER  16           H        SER  16   2.810   1.475  -8.709
  133    HA   SER  16           HA       SER  16   1.088   1.977 -10.876
  134    HB2  SER  16           HB2      SER  16   1.311  -0.561  -9.193
  135    HB3  SER  16           HB3      SER  16   0.587  -0.458 -10.798
  136    HG   SER  16           HG       SER  16   3.053   0.592 -10.854
  137    H    GLU  17           H        GLU  17  -1.146   2.106 -11.050
  138    HA   GLU  17           HA       GLU  17  -2.609   3.112  -8.858
  139    HB2  GLU  17           HB2      GLU  17  -2.964   3.464 -11.423
  140    HB3  GLU  17           HB3      GLU  17  -3.894   1.982 -11.373
  141    HG2  GLU  17           HG2      GLU  17  -4.560   4.357  -9.611
  142    HG3  GLU  17           HG3      GLU  17  -5.157   4.226 -11.262
  143    H    GLU  18           H        GLU  18  -2.503  -0.053 -10.402
  144    HA   GLU  18           HA       GLU  18  -4.478  -1.295  -8.766
  145    HB2  GLU  18           HB2      GLU  18  -3.831  -2.114 -11.032
  146    HB3  GLU  18           HB3      GLU  18  -2.254  -2.580 -10.403
  147    HG2  GLU  18           HG2      GLU  18  -3.414  -4.181  -8.844
  148    HG3  GLU  18           HG3      GLU  18  -4.944  -3.766  -9.617
  149    H    CYS  19           H        CYS  19  -1.005  -0.717  -8.382
  150    HA   CYS  19           HA       CYS  19  -0.292  -2.677  -6.500
  151    HB2  CYS  19           HB2      CYS  19   1.318  -0.858  -7.523
  152    HB3  CYS  19           HB3      CYS  19   0.717   0.197  -6.272
  153    H    ARG  20           H        ARG  20  -1.613   0.577  -6.067
  154    HA   ARG  20           HA       ARG  20  -1.868   0.821  -3.320
  155    HB2  ARG  20           HB2      ARG  20  -3.994   1.642  -5.347
  156    HB3  ARG  20           HB3      ARG  20  -3.702   2.375  -3.768
  157    HG2  ARG  20           HG2      ARG  20  -1.807   3.539  -4.530
  158    HG3  ARG  20           HG3      ARG  20  -1.589   2.477  -5.930
  159    HD2  ARG  20           HD2      ARG  20  -2.579   4.779  -6.433
  160    HD3  ARG  20           HD3      ARG  20  -3.459   3.374  -7.050
  161    HE   ARG  20           HE       ARG  20  -5.108   3.645  -5.411
  162   HH11  ARG  20          HH11      ARG  20  -2.825   6.326  -5.377
  163   HH12  ARG  20          HH12      ARG  20  -3.899   7.367  -4.500
  164   HH21  ARG  20          HH21      ARG  20  -6.470   4.995  -4.257
  165   HH22  ARG  20          HH22      ARG  20  -5.979   6.606  -3.861
  166    H    GLN  21           H        GLN  21  -4.177  -0.519  -5.669
  167    HA   GLN  21           HA       GLN  21  -6.338  -0.993  -3.992
  168    HB2  GLN  21           HB2      GLN  21  -5.576  -2.538  -6.505
  169    HB3  GLN  21           HB3      GLN  21  -7.186  -2.474  -5.783
  170    HG2  GLN  21           HG2      GLN  21  -7.359  -0.100  -6.300
  171    HG3  GLN  21           HG3      GLN  21  -5.705  -0.084  -6.920
  172   HE21  GLN  21          HE21      GLN  21  -6.219   0.523  -8.963
  173   HE22  GLN  21          HE22      GLN  21  -7.111  -0.443 -10.080
  174    H    ARG  22           H        ARG  22  -3.535  -2.934  -4.792
  175    HA   ARG  22           HA       ARG  22  -4.244  -5.346  -3.431
  176    HB2  ARG  22           HB2      ARG  22  -1.561  -4.229  -4.360
  177    HB3  ARG  22           HB3      ARG  22  -1.796  -5.867  -3.765
  178    HG2  ARG  22           HG2      ARG  22  -3.271  -6.386  -5.643
  179    HG3  ARG  22           HG3      ARG  22  -3.173  -4.718  -6.220
  180    HD2  ARG  22           HD2      ARG  22  -0.792  -4.990  -6.700
  181    HD3  ARG  22           HD3      ARG  22  -0.803  -6.613  -5.999
  182    HE   ARG  22           HE       ARG  22  -1.831  -5.797  -8.609
  183   HH11  ARG  22          HH11      ARG  22  -1.671  -8.371  -6.218
  184   HH12  ARG  22          HH12      ARG  22  -2.082  -9.613  -7.350
  185   HH21  ARG  22          HH21      ARG  22  -2.321  -7.447 -10.084
  186   HH22  ARG  22          HH22      ARG  22  -2.452  -9.091  -9.546
  187    H    LEU  23           H        LEU  23  -2.316  -2.448  -2.573
  188    HA   LEU  23           HA       LEU  23  -1.179  -3.549  -0.201
  189    HB2  LEU  23           HB2      LEU  23  -1.408  -0.675  -1.132
  190    HB3  LEU  23           HB3      LEU  23  -0.382  -1.224   0.170
  191    HG   LEU  23           HG       LEU  23  -0.087  -1.868  -2.770
  192   HD11  LEU  23          HD11      LEU  23   0.719   0.324  -2.184
  193   HD12  LEU  23          HD12      LEU  23   2.048  -0.748  -2.614
  194   HD13  LEU  23          HD13      LEU  23   1.741  -0.367  -0.918
  195   HD21  LEU  23          HD21      LEU  23   0.441  -3.890  -1.531
  196   HD22  LEU  23          HD22      LEU  23   1.547  -2.986  -0.494
  197   HD23  LEU  23          HD23      LEU  23   1.905  -3.180  -2.211
  198    H    GLU  24           H        GLU  24  -3.599  -0.970  -0.672
  199    HA   GLU  24           HA       GLU  24  -4.394  -0.480   1.917
  200    HB2  GLU  24           HB2      GLU  24  -6.125  -0.515  -0.597
  201    HB3  GLU  24           HB3      GLU  24  -6.584   0.252   0.924
  202    HG2  GLU  24           HG2      GLU  24  -4.771   1.872   0.704
  203    HG3  GLU  24           HG3      GLU  24  -4.174   1.053  -0.742
  204    H    LYS  25           H        LYS  25  -5.355  -3.080  -0.264
  205    HA   LYS  25           HA       LYS  25  -7.531  -4.100   1.261
  206    HB2  LYS  25           HB2      LYS  25  -7.107  -4.368  -1.224
  207    HB3  LYS  25           HB3      LYS  25  -5.861  -5.546  -0.828
  208    HG2  LYS  25           HG2      LYS  25  -7.564  -7.000   0.205
  209    HG3  LYS  25           HG3      LYS  25  -8.810  -5.798  -0.141
  210    HD2  LYS  25           HD2      LYS  25  -8.904  -7.561  -1.818
  211    HD3  LYS  25           HD3      LYS  25  -8.368  -6.063  -2.580
  212    HE2  LYS  25           HE2      LYS  25  -7.048  -7.969  -3.406
  213    HE3  LYS  25           HE3      LYS  25  -6.014  -6.873  -2.489
  214    HZ1  LYS  25           HZ1      LYS  25  -5.647  -9.218  -1.959
  215    HZ2  LYS  25           HZ2      LYS  25  -7.232  -9.342  -1.405
  216    HZ3  LYS  25           HZ3      LYS  25  -6.144  -8.333  -0.609
  217    H    MET  26           H        MET  26  -4.107  -5.140   0.867
  218    HA   MET  26           HA       MET  26  -4.169  -7.354   2.632
  219    HB2  MET  26           HB2      MET  26  -1.796  -5.618   1.823
  220    HB3  MET  26           HB3      MET  26  -1.662  -7.146   2.686
  221    HG2  MET  26           HG2      MET  26  -2.807  -8.229   0.698
  222    HG3  MET  26           HG3      MET  26  -2.605  -6.700  -0.144
  223    HE1  MET  26           HE1      MET  26  -0.769  -9.809   1.443
  224    HE2  MET  26           HE2      MET  26  -0.106  -8.485   2.408
  225    HE3  MET  26           HE3      MET  26   0.923  -9.341   1.263
  226    H    CYS  27           H        CYS  27  -3.700  -3.931   3.133
  227    HA   CYS  27           HA       CYS  27  -2.674  -3.914   5.757
  228    HB2  CYS  27           HB2      CYS  27  -2.591  -1.953   4.272
  229    HB3  CYS  27           HB3      CYS  27  -4.346  -1.835   4.297
  230    H    LYS  28           H        LYS  28  -5.974  -4.083   4.488
  231    HA   LYS  28           HA       LYS  28  -7.275  -3.712   7.069
  232    HB2  LYS  28           HB2      LYS  28  -8.434  -4.553   4.384
  233    HB3  LYS  28           HB3      LYS  28  -9.363  -4.018   5.786
  234    HG2  LYS  28           HG2      LYS  28  -8.535  -1.777   5.582
  235    HG3  LYS  28           HG3      LYS  28  -7.321  -2.265   4.396
  236    HD2  LYS  28           HD2      LYS  28  -9.241  -2.895   2.841
  237    HD3  LYS  28           HD3      LYS  28 -10.337  -2.139   4.008
  238    HE2  LYS  28           HE2      LYS  28  -8.043  -0.743   2.576
  239    HE3  LYS  28           HE3      LYS  28  -9.749  -0.608   2.147
  240    HZ1  LYS  28           HZ1      LYS  28  -8.596   0.213   4.762
  241    HZ2  LYS  28           HZ2      LYS  28 -10.194   0.428   4.252
  242    HZ3  LYS  28           HZ3      LYS  28  -8.943   1.260   3.482
  243    H    GLU  29           H        GLU  29  -6.880  -6.371   4.715
  244    HA   GLU  29           HA       GLU  29  -8.208  -8.429   6.096
  245    HB2  GLU  29           HB2      GLU  29  -5.875  -8.640   4.145
  246    HB3  GLU  29           HB3      GLU  29  -6.908  -9.982   4.636
  247    HG2  GLU  29           HG2      GLU  29  -8.837  -8.914   3.568
  248    HG3  GLU  29           HG3      GLU  29  -7.849  -7.522   3.125
  249    H    GLY  30           H        GLY  30  -4.703  -7.963   5.721
  250    HA2  GLY  30           HA2      GLY  30  -4.138  -9.388   8.228
  251    HA3  GLY  30           HA3      GLY  30  -2.972  -8.899   7.002
  252    H    THR  31           H        THR  31  -1.640  -7.402   7.758
  253    HA   THR  31           HA       THR  31  -2.707  -5.161   9.386
  254    HB   THR  31           HB       THR  31  -0.571  -5.029  10.582
  255    HG1  THR  31           HG1      THR  31   0.186  -7.088   8.798
  256   HG21  THR  31          HG21      THR  31  -1.577  -7.901  10.621
  257   HG22  THR  31          HG22      THR  31  -2.239  -6.569  11.572
  258   HG23  THR  31          HG23      THR  31  -0.597  -7.139  11.875
  259    H    SER  32           H        SER  32  -1.282  -3.215   9.196
  260    HA   SER  32           HA       SER  32  -0.891  -2.449   6.503
  261    HB2  SER  32           HB2      SER  32   0.112  -0.359   7.511
  262    HB3  SER  32           HB3      SER  32  -1.477  -0.771   8.160
  263    HG   SER  32           HG       SER  32  -0.425  -1.692   9.956
  264    H    GLU  33           H        GLU  33   1.215  -3.919   8.878
  265    HA   GLU  33           HA       GLU  33   3.747  -3.371   7.759
  266    HB2  GLU  33           HB2      GLU  33   2.813  -5.708   9.471
  267    HB3  GLU  33           HB3      GLU  33   4.504  -5.405   9.054
  268    HG2  GLU  33           HG2      GLU  33   4.397  -3.218  10.178
  269    HG3  GLU  33           HG3      GLU  33   2.709  -3.509  10.591
  270    H    ASP  34           H        ASP  34   1.269  -5.676   6.828
  271    HA   ASP  34           HA       ASP  34   2.846  -7.197   4.971
  272    HB2  ASP  34           HB2      ASP  34  -0.165  -6.663   5.068
  273    HB3  ASP  34           HB3      ASP  34   0.596  -7.750   3.909
  274    H    ALA  35           H        ALA  35   0.730  -4.361   4.710
  275    HA   ALA  35           HA       ALA  35   0.714  -4.111   1.896
  276    HB1  ALA  35           HB1      ALA  35   0.126  -2.053   4.045
  277    HB2  ALA  35           HB2      ALA  35  -1.027  -3.198   3.356
  278    HB3  ALA  35           HB3      ALA  35  -0.342  -1.923   2.346
  279    H    GLU  36           H        GLU  36   2.607  -2.369   4.383
  280    HA   GLU  36           HA       GLU  36   3.951  -0.626   2.568
  281    HB2  GLU  36           HB2      GLU  36   5.371  -0.069   4.548
  282    HB3  GLU  36           HB3      GLU  36   3.651   0.014   4.890
  283    HG2  GLU  36           HG2      GLU  36   4.118  -1.224   6.724
  284    HG3  GLU  36           HG3      GLU  36   4.190  -2.579   5.638
  285    H    ARG  37           H        ARG  37   4.683  -3.783   3.957
  286    HA   ARG  37           HA       ARG  37   7.362  -4.088   3.079
  287    HB2  ARG  37           HB2      ARG  37   6.187  -5.508   4.785
  288    HB3  ARG  37           HB3      ARG  37   5.224  -6.218   3.496
  289    HG2  ARG  37           HG2      ARG  37   7.415  -7.033   2.468
  290    HG3  ARG  37           HG3      ARG  37   8.211  -6.517   3.963
  291    HD2  ARG  37           HD2      ARG  37   6.059  -8.637   3.636
  292    HD3  ARG  37           HD3      ARG  37   7.728  -8.872   4.161
  293    HE   ARG  37           HE       ARG  37   7.028  -7.410   6.149
  294   HH11  ARG  37          HH11      ARG  37   4.838  -9.652   4.561
  295   HH12  ARG  37          HH12      ARG  37   3.873  -9.902   5.975
  296   HH21  ARG  37          HH21      ARG  37   5.743  -7.725   7.992
  297   HH22  ARG  37          HH22      ARG  37   4.386  -8.806   7.933
  298    H    MET  38           H        MET  38   4.224  -4.686   1.659
  299    HA   MET  38           HA       MET  38   5.271  -5.881  -0.781
  300    HB2  MET  38           HB2      MET  38   2.460  -5.074   0.033
  301    HB3  MET  38           HB3      MET  38   2.846  -5.761  -1.540
  302    HG2  MET  38           HG2      MET  38   3.297  -7.157   1.113
  303    HG3  MET  38           HG3      MET  38   1.918  -7.416   0.052
  304    HE1  MET  38           HE1      MET  38   6.064  -9.312  -0.346
  305    HE2  MET  38           HE2      MET  38   5.235  -8.801   1.124
  306    HE3  MET  38           HE3      MET  38   5.956  -7.599   0.052
  307    H    ALA  39           H        ALA  39   4.521  -2.673   0.335
  308    HA   ALA  39           HA       ALA  39   4.327  -1.338  -2.173
  309    HB1  ALA  39           HB1      ALA  39   3.592  -0.290  -0.064
  310    HB2  ALA  39           HB2      ALA  39   4.780   0.722  -0.889
  311    HB3  ALA  39           HB3      ALA  39   5.261  -0.247   0.508
  312    H    ARG  40           H        ARG  40   7.024  -1.919   0.064
  313    HA   ARG  40           HA       ARG  40   9.054  -0.978  -1.789
  314    HB2  ARG  40           HB2      ARG  40  10.661  -1.681   0.015
  315    HB3  ARG  40           HB3      ARG  40   9.431  -0.547   0.564
  316    HG2  ARG  40           HG2      ARG  40   8.153  -2.529   1.493
  317    HG3  ARG  40           HG3      ARG  40   9.554  -3.529   1.115
  318    HD2  ARG  40           HD2      ARG  40  10.927  -2.361   2.697
  319    HD3  ARG  40           HD3      ARG  40   9.733  -1.077   2.897
  320    HE   ARG  40           HE       ARG  40   8.268  -2.782   3.964
  321   HH11  ARG  40          HH11      ARG  40  11.757  -3.313   4.016
  322   HH12  ARG  40          HH12      ARG  40  11.690  -4.317   5.430
  323   HH21  ARG  40          HH21      ARG  40   8.217  -4.099   5.794
  324   HH22  ARG  40          HH22      ARG  40   9.687  -4.762   6.435
  325    H    ASN  41           H        ASN  41   7.239  -3.734  -1.749
  326    HA   ASN  41           HA       ASN  41   9.286  -5.246  -3.282
  327    HB2  ASN  41           HB2      ASN  41   7.060  -6.249  -1.480
  328    HB3  ASN  41           HB3      ASN  41   7.632  -7.260  -2.799
  329   HD21  ASN  41          HD21      ASN  41   9.577  -5.169  -0.650
  330   HD22  ASN  41          HD22      ASN  41  10.494  -6.455   0.023
  331    H    CYS  42           H        CYS  42   7.126  -3.090  -3.946
  332    HA   CYS  42           HA       CYS  42   5.443  -4.569  -5.867
  333    HB2  CYS  42           HB2      CYS  42   4.436  -2.833  -4.329
  334    HB3  CYS  42           HB3      CYS  42   5.385  -1.606  -5.152
  335    H    GLU  43           H        GLU  43   6.782  -1.305  -6.290
  336    HA   GLU  43           HA       GLU  43   8.756  -2.052  -8.261
  337    HB2  GLU  43           HB2      GLU  43   7.571  -0.307  -9.935
  338    HB3  GLU  43           HB3      GLU  43   7.150  -2.007  -9.943
  339    HG2  GLU  43           HG2      GLU  43   5.135  -0.663 -10.099
  340    HG3  GLU  43           HG3      GLU  43   5.151  -1.552  -8.583
  341    H    SER  44           H        SER  44   7.897  -0.334  -5.712
  342    HA   SER  44           HA       SER  44   9.144   2.233  -6.343
  343    HB2  SER  44           HB2      SER  44   7.783   1.191  -3.817
  344    HB3  SER  44           HB3      SER  44   8.395   2.835  -4.027
  345    HG   SER  44           HG       SER  44   6.326   1.567  -5.512
  Start of MODEL    6
    1    H1   ALA   1           H1       ALA   1  -3.562   9.412  11.919
    2    H2   ALA   1           H2       ALA   1  -2.710   8.264  11.016
    3    H3   ALA   1           H3       ALA   1  -3.288   7.871  12.556
    4    HA   ALA   1           HA       ALA   1  -5.546   8.060  11.823
    5    HB1  ALA   1           HB1      ALA   1  -6.056   8.483   9.445
    6    HB2  ALA   1           HB2      ALA   1  -4.336   8.683   9.109
    7    HB3  ALA   1           HB3      ALA   1  -5.169   9.834  10.156
    8    HA   PRO   2           HA       PRO   2  -4.901   3.667  11.369
    9    HB2  PRO   2           HB2      PRO   2  -7.454   2.793  10.768
   10    HB3  PRO   2           HB3      PRO   2  -6.975   3.360  12.378
   11    HG2  PRO   2           HG2      PRO   2  -8.397   4.862  10.203
   12    HG3  PRO   2           HG3      PRO   2  -8.758   4.788  11.945
   13    HD2  PRO   2           HD2      PRO   2  -7.435   6.889  10.886
   14    HD3  PRO   2           HD3      PRO   2  -7.046   6.270  12.506
   15    H    CYS   3           H        CYS   3  -3.503   3.641   9.569
   16    HA   CYS   3           HA       CYS   3  -2.706   2.887   7.603
   17    HB2  CYS   3           HB2      CYS   3  -4.203   0.958   8.023
   18    HB3  CYS   3           HB3      CYS   3  -5.484   1.754   7.118
   19    H    GLU   4           H        GLU   4  -4.570   5.409   7.835
   20    HA   GLU   4           HA       GLU   4  -5.421   5.932   5.116
   21    HB2  GLU   4           HB2      GLU   4  -6.566   6.694   7.293
   22    HB3  GLU   4           HB3      GLU   4  -5.281   7.870   7.468
   23    HG2  GLU   4           HG2      GLU   4  -7.139   7.767   5.082
   24    HG3  GLU   4           HG3      GLU   4  -7.480   8.708   6.528
   25    H    ASP   5           H        ASP   5  -2.835   6.941   7.333
   26    HA   ASP   5           HA       ASP   5  -1.398   8.690   5.640
   27    HB2  ASP   5           HB2      ASP   5  -0.196   6.838   7.756
   28    HB3  ASP   5           HB3      ASP   5   0.530   8.303   7.113
   29    H    LEU   6           H        LEU   6  -1.275   5.191   6.113
   30    HA   LEU   6           HA       LEU   6   0.921   4.548   4.461
   31    HB2  LEU   6           HB2      LEU   6  -0.122   3.048   6.153
   32    HB3  LEU   6           HB3      LEU   6  -1.541   2.871   5.140
   33    HG   LEU   6           HG       LEU   6   1.189   1.992   4.117
   34   HD11  LEU   6          HD11      LEU   6   0.902   0.924   6.304
   35   HD12  LEU   6          HD12      LEU   6   0.818  -0.250   4.999
   36   HD13  LEU   6          HD13      LEU   6  -0.663   0.282   5.803
   37   HD21  LEU   6          HD21      LEU   6  -1.612   0.981   3.475
   38   HD22  LEU   6          HD22      LEU   6  -0.104   0.379   2.778
   39   HD23  LEU   6          HD23      LEU   6  -0.625   2.028   2.452
   40    H    LYS   7           H        LYS   7  -2.574   4.514   3.821
   41    HA   LYS   7           HA       LYS   7  -2.716   3.947   1.118
   42    HB2  LYS   7           HB2      LYS   7  -4.685   4.123   2.534
   43    HB3  LYS   7           HB3      LYS   7  -4.371   5.823   2.844
   44    HG2  LYS   7           HG2      LYS   7  -4.751   6.200   0.329
   45    HG3  LYS   7           HG3      LYS   7  -5.364   4.546   0.287
   46    HD2  LYS   7           HD2      LYS   7  -7.221   6.134   0.505
   47    HD3  LYS   7           HD3      LYS   7  -7.098   5.147   1.963
   48    HE2  LYS   7           HE2      LYS   7  -6.026   6.960   3.163
   49    HE3  LYS   7           HE3      LYS   7  -5.933   7.936   1.699
   50    HZ1  LYS   7           HZ1      LYS   7  -7.747   8.619   3.149
   51    HZ2  LYS   7           HZ2      LYS   7  -8.454   7.085   3.022
   52    HZ3  LYS   7           HZ3      LYS   7  -8.328   8.073   1.656
   53    H    GLU   8           H        GLU   8  -2.169   7.090   2.672
   54    HA   GLU   8           HA       GLU   8  -2.105   8.623   0.257
   55    HB2  GLU   8           HB2      GLU   8  -1.284   9.275   3.104
   56    HB3  GLU   8           HB3      GLU   8  -1.193  10.442   1.788
   57    HG2  GLU   8           HG2      GLU   8  -3.685   9.096   2.846
   58    HG3  GLU   8           HG3      GLU   8  -3.228  10.785   3.055
   59    H    ARG   9           H        ARG   9   0.371   6.928   2.108
   60    HA   ARG   9           HA       ARG   9   2.694   7.995   0.913
   61    HB2  ARG   9           HB2      ARG   9   2.085   5.176   1.885
   62    HB3  ARG   9           HB3      ARG   9   3.661   5.630   1.254
   63    HG2  ARG   9           HG2      ARG   9   4.035   7.166   3.069
   64    HG3  ARG   9           HG3      ARG   9   2.381   6.955   3.659
   65    HD2  ARG   9           HD2      ARG   9   2.800   4.755   4.417
   66    HD3  ARG   9           HD3      ARG   9   4.256   4.587   3.432
   67    HE   ARG   9           HE       ARG   9   4.867   6.613   5.131
   68   HH11  ARG   9          HH11      ARG   9   3.840   3.271   5.613
   69   HH12  ARG   9          HH12      ARG   9   4.665   3.109   7.129
   70   HH21  ARG   9          HH21      ARG   9   5.980   6.356   7.126
   71   HH22  ARG   9          HH22      ARG   9   5.871   4.849   7.979
   72    H    LEU  10           H        LEU  10   0.496   5.410  -0.058
   73    HA   LEU  10           HA       LEU  10   1.917   4.344  -2.237
   74    HB2  LEU  10           HB2      LEU  10  -1.119   4.334  -2.003
   75    HB3  LEU  10           HB3      LEU  10  -0.096   3.132  -2.773
   76    HG   LEU  10           HG       LEU  10  -0.366   3.628   0.208
   77   HD11  LEU  10          HD11      LEU  10  -1.292   1.273  -1.446
   78   HD12  LEU  10          HD12      LEU  10  -2.317   2.526  -0.743
   79   HD13  LEU  10          HD13      LEU  10  -1.424   1.429   0.307
   80   HD21  LEU  10          HD21      LEU  10   1.391   1.581  -1.183
   81   HD22  LEU  10          HD22      LEU  10   1.068   1.639   0.550
   82   HD23  LEU  10          HD23      LEU  10   1.934   2.961  -0.226
   83    H    LYS  11           H        LYS  11  -0.662   6.729  -2.081
   84    HA   LYS  11           HA       LYS  11  -1.010   7.153  -4.888
   85    HB2  LYS  11           HB2      LYS  11  -1.832   8.847  -2.485
   86    HB3  LYS  11           HB3      LYS  11  -2.419   9.084  -4.131
   87    HG2  LYS  11           HG2      LYS  11  -3.638   7.029  -4.110
   88    HG3  LYS  11           HG3      LYS  11  -2.815   6.467  -2.653
   89    HD2  LYS  11           HD2      LYS  11  -5.136   7.195  -2.179
   90    HD3  LYS  11           HD3      LYS  11  -3.952   8.162  -1.302
   91    HE2  LYS  11           HE2      LYS  11  -4.190   9.960  -2.992
   92    HE3  LYS  11           HE3      LYS  11  -5.395   8.992  -3.845
   93    HZ1  LYS  11           HZ1      LYS  11  -6.792   9.077  -1.882
   94    HZ2  LYS  11           HZ2      LYS  11  -6.424  10.638  -2.412
   95    HZ3  LYS  11           HZ3      LYS  11  -5.634   9.993  -1.061
   96    H    LYS  12           H        LYS  12   0.720   8.917  -2.317
   97    HA   LYS  12           HA       LYS  12   1.619  11.138  -3.844
   98    HB2  LYS  12           HB2      LYS  12   1.576  11.072  -1.343
   99    HB3  LYS  12           HB3      LYS  12   2.880   9.883  -1.357
  100    HG2  LYS  12           HG2      LYS  12   4.342  11.598  -2.478
  101    HG3  LYS  12           HG3      LYS  12   3.044  12.779  -2.284
  102    HD2  LYS  12           HD2      LYS  12   3.184  12.571   0.159
  103    HD3  LYS  12           HD3      LYS  12   4.400  11.298  -0.002
  104    HE2  LYS  12           HE2      LYS  12   5.947  12.921  -1.059
  105    HE3  LYS  12           HE3      LYS  12   4.736  14.192  -0.871
  106    HZ1  LYS  12           HZ1      LYS  12   6.420  14.237   0.882
  107    HZ2  LYS  12           HZ2      LYS  12   5.978  12.678   1.366
  108    HZ3  LYS  12           HZ3      LYS  12   4.876  13.954   1.517
  109    H    LEU  13           H        LEU  13   2.901   7.941  -3.242
  110    HA   LEU  13           HA       LEU  13   5.602   8.418  -4.073
  111    HB2  LEU  13           HB2      LEU  13   4.651   6.677  -2.421
  112    HB3  LEU  13           HB3      LEU  13   4.190   5.720  -3.809
  113    HG   LEU  13           HG       LEU  13   7.094   6.511  -3.368
  114   HD11  LEU  13          HD11      LEU  13   5.749   4.089  -2.107
  115   HD12  LEU  13          HD12      LEU  13   6.294   5.530  -1.241
  116   HD13  LEU  13          HD13      LEU  13   7.471   4.489  -2.044
  117   HD21  LEU  13          HD21      LEU  13   6.523   5.496  -5.547
  118   HD22  LEU  13          HD22      LEU  13   5.866   4.079  -4.727
  119   HD23  LEU  13          HD23      LEU  13   7.586   4.453  -4.605
  120    H    GLY  14           H        GLY  14   2.621   7.530  -5.629
  121    HA2  GLY  14           HA2      GLY  14   2.025   7.562  -7.839
  122    HA3  GLY  14           HA3      GLY  14   3.655   8.082  -8.236
  123    H    MET  15           H        MET  15   2.393   5.140  -6.684
  124    HA   MET  15           HA       MET  15   3.827   3.387  -8.477
  125    HB2  MET  15           HB2      MET  15   2.862   1.603  -7.027
  126    HB3  MET  15           HB3      MET  15   3.715   2.827  -6.106
  127    HG2  MET  15           HG2      MET  15   1.473   3.868  -5.582
  128    HG3  MET  15           HG3      MET  15   0.726   2.470  -6.336
  129    HE1  MET  15           HE1      MET  15   3.503   1.899  -2.646
  130    HE2  MET  15           HE2      MET  15   3.390   3.448  -3.483
  131    HE3  MET  15           HE3      MET  15   4.113   2.057  -4.293
  132    H    SER  16           H        SER  16   2.325   1.393  -9.184
  133    HA   SER  16           HA       SER  16   0.527   2.240 -11.175
  134    HB2  SER  16           HB2      SER  16   0.628  -0.507  -9.850
  135    HB3  SER  16           HB3      SER  16   0.023  -0.132 -11.466
  136    HG   SER  16           HG       SER  16   2.144   0.487 -12.040
  137    H    GLU  17           H        GLU  17  -1.801   2.048 -11.309
  138    HA   GLU  17           HA       GLU  17  -3.295   2.749  -8.987
  139    HB2  GLU  17           HB2      GLU  17  -4.282   1.669 -11.674
  140    HB3  GLU  17           HB3      GLU  17  -5.314   2.372 -10.429
  141    HG2  GLU  17           HG2      GLU  17  -3.981   4.509 -10.667
  142    HG3  GLU  17           HG3      GLU  17  -3.189   3.777 -12.061
  143    H    GLU  18           H        GLU  18  -2.668  -0.340 -10.599
  144    HA   GLU  18           HA       GLU  18  -4.384  -1.869  -8.900
  145    HB2  GLU  18           HB2      GLU  18  -3.590  -2.702 -11.116
  146    HB3  GLU  18           HB3      GLU  18  -1.931  -2.722 -10.528
  147    HG2  GLU  18           HG2      GLU  18  -2.652  -4.442  -8.806
  148    HG3  GLU  18           HG3      GLU  18  -4.221  -4.490  -9.609
  149    H    CYS  19           H        CYS  19  -1.107  -0.598  -8.580
  150    HA   CYS  19           HA       CYS  19  -0.090  -2.415  -6.654
  151    HB2  CYS  19           HB2      CYS  19   1.356  -0.817  -7.957
  152    HB3  CYS  19           HB3      CYS  19   0.648   0.511  -7.076
  153    H    ARG  20           H        ARG  20  -1.494   0.887  -6.302
  154    HA   ARG  20           HA       ARG  20  -1.511   0.793  -3.469
  155    HB2  ARG  20           HB2      ARG  20  -3.173   2.802  -3.679
  156    HB3  ARG  20           HB3      ARG  20  -1.510   2.988  -4.168
  157    HG2  ARG  20           HG2      ARG  20  -2.827   4.189  -5.711
  158    HG3  ARG  20           HG3      ARG  20  -2.236   2.763  -6.551
  159    HD2  ARG  20           HD2      ARG  20  -4.642   3.388  -7.021
  160    HD3  ARG  20           HD3      ARG  20  -4.370   1.732  -6.502
  161    HE   ARG  20           HE       ARG  20  -5.384   2.179  -4.458
  162   HH11  ARG  20          HH11      ARG  20  -5.658   4.944  -6.633
  163   HH12  ARG  20          HH12      ARG  20  -6.945   5.672  -5.725
  164   HH21  ARG  20          HH21      ARG  20  -7.062   3.190  -3.273
  165   HH22  ARG  20          HH22      ARG  20  -7.741   4.690  -3.839
  166    H    GLN  21           H        GLN  21  -4.036  -0.026  -5.839
  167    HA   GLN  21           HA       GLN  21  -6.166  -0.480  -4.024
  168    HB2  GLN  21           HB2      GLN  21  -5.588  -1.467  -6.829
  169    HB3  GLN  21           HB3      GLN  21  -7.000  -2.052  -5.956
  170    HG2  GLN  21           HG2      GLN  21  -7.894   0.208  -5.786
  171    HG3  GLN  21           HG3      GLN  21  -6.434   0.873  -6.519
  172   HE21  GLN  21          HE21      GLN  21  -6.207   0.786  -8.745
  173   HE22  GLN  21          HE22      GLN  21  -7.444   0.276  -9.825
  174    H    ARG  22           H        ARG  22  -3.451  -2.486  -4.959
  175    HA   ARG  22           HA       ARG  22  -4.339  -4.932  -3.738
  176    HB2  ARG  22           HB2      ARG  22  -1.687  -3.916  -4.817
  177    HB3  ARG  22           HB3      ARG  22  -1.749  -5.426  -3.922
  178    HG2  ARG  22           HG2      ARG  22  -3.358  -6.340  -5.565
  179    HG3  ARG  22           HG3      ARG  22  -3.274  -4.831  -6.477
  180    HD2  ARG  22           HD2      ARG  22  -0.969  -5.207  -7.048
  181    HD3  ARG  22           HD3      ARG  22  -0.841  -6.551  -5.907
  182    HE   ARG  22           HE       ARG  22  -2.848  -7.163  -7.769
  183   HH11  ARG  22          HH11      ARG  22   0.653  -6.778  -7.735
  184   HH12  ARG  22          HH12      ARG  22   0.900  -7.887  -9.047
  185   HH21  ARG  22          HH21      ARG  22  -2.499  -8.625  -9.458
  186   HH22  ARG  22          HH22      ARG  22  -0.887  -8.937 -10.024
  187    H    LEU  23           H        LEU  23  -2.316  -2.197  -2.722
  188    HA   LEU  23           HA       LEU  23  -1.223  -3.510  -0.411
  189    HB2  LEU  23           HB2      LEU  23  -1.109  -0.650  -1.398
  190    HB3  LEU  23           HB3      LEU  23  -0.181  -1.253  -0.045
  191    HG   LEU  23           HG       LEU  23   0.040  -2.321  -2.875
  192   HD11  LEU  23          HD11      LEU  23   0.850  -0.036  -2.796
  193   HD12  LEU  23          HD12      LEU  23   2.185  -1.165  -3.018
  194   HD13  LEU  23          HD13      LEU  23   1.904  -0.432  -1.436
  195   HD21  LEU  23          HD21      LEU  23   1.778  -2.888  -0.461
  196   HD22  LEU  23          HD22      LEU  23   2.038  -3.490  -2.103
  197   HD23  LEU  23          HD23      LEU  23   0.617  -4.001  -1.196
  198    H    GLU  24           H        GLU  24  -3.565  -0.850  -0.881
  199    HA   GLU  24           HA       GLU  24  -4.320  -0.329   1.756
  200    HB2  GLU  24           HB2      GLU  24  -6.073  -0.406  -0.735
  201    HB3  GLU  24           HB3      GLU  24  -6.550   0.338   0.788
  202    HG2  GLU  24           HG2      GLU  24  -4.952   2.086   0.559
  203    HG3  GLU  24           HG3      GLU  24  -4.099   1.251  -0.743
  204    H    LYS  25           H        LYS  25  -5.316  -2.870  -0.461
  205    HA   LYS  25           HA       LYS  25  -7.333  -4.065   1.167
  206    HB2  LYS  25           HB2      LYS  25  -7.158  -4.257  -1.346
  207    HB3  LYS  25           HB3      LYS  25  -5.777  -5.326  -1.127
  208    HG2  LYS  25           HG2      LYS  25  -7.244  -6.929   0.091
  209    HG3  LYS  25           HG3      LYS  25  -8.618  -5.856  -0.187
  210    HD2  LYS  25           HD2      LYS  25  -8.624  -7.686  -1.819
  211    HD3  LYS  25           HD3      LYS  25  -8.354  -6.145  -2.635
  212    HE2  LYS  25           HE2      LYS  25  -6.915  -7.964  -3.505
  213    HE3  LYS  25           HE3      LYS  25  -5.976  -6.625  -2.845
  214    HZ1  LYS  25           HZ1      LYS  25  -5.624  -7.923  -0.827
  215    HZ2  LYS  25           HZ2      LYS  25  -5.083  -8.781  -2.180
  216    HZ3  LYS  25           HZ3      LYS  25  -6.548  -9.195  -1.447
  217    H    MET  26           H        MET  26  -3.888  -4.814   0.585
  218    HA   MET  26           HA       MET  26  -3.589  -7.087   2.239
  219    HB2  MET  26           HB2      MET  26  -1.609  -4.896   1.495
  220    HB3  MET  26           HB3      MET  26  -1.142  -6.310   2.422
  221    HG2  MET  26           HG2      MET  26  -2.429  -6.745  -0.245
  222    HG3  MET  26           HG3      MET  26  -0.766  -6.173  -0.187
  223    HE1  MET  26           HE1      MET  26  -2.148 -10.316   1.378
  224    HE2  MET  26           HE2      MET  26  -3.180  -9.222   0.457
  225    HE3  MET  26           HE3      MET  26  -2.745  -8.833   2.122
  226    H    CYS  27           H        CYS  27  -3.685  -3.675   2.946
  227    HA   CYS  27           HA       CYS  27  -2.775  -3.777   5.646
  228    HB2  CYS  27           HB2      CYS  27  -2.738  -1.753   4.176
  229    HB3  CYS  27           HB3      CYS  27  -4.492  -1.662   4.305
  230    H    LYS  28           H        LYS  28  -5.957  -4.120   4.124
  231    HA   LYS  28           HA       LYS  28  -7.462  -3.887   6.595
  232    HB2  LYS  28           HB2      LYS  28  -8.497  -5.042   3.966
  233    HB3  LYS  28           HB3      LYS  28  -9.447  -4.383   5.292
  234    HG2  LYS  28           HG2      LYS  28  -7.711  -2.866   3.340
  235    HG3  LYS  28           HG3      LYS  28  -9.467  -2.830   3.454
  236    HD2  LYS  28           HD2      LYS  28  -9.336  -1.651   5.598
  237    HD3  LYS  28           HD3      LYS  28  -7.576  -1.800   5.609
  238    HE2  LYS  28           HE2      LYS  28  -7.466  -0.391   3.558
  239    HE3  LYS  28           HE3      LYS  28  -9.222  -0.201   3.609
  240    HZ1  LYS  28           HZ1      LYS  28  -9.027   0.917   5.720
  241    HZ2  LYS  28           HZ2      LYS  28  -8.023   1.683   4.596
  242    HZ3  LYS  28           HZ3      LYS  28  -7.358   0.657   5.763
  243    H    GLU  29           H        GLU  29  -6.538  -6.500   4.361
  244    HA   GLU  29           HA       GLU  29  -7.847  -8.665   5.644
  245    HB2  GLU  29           HB2      GLU  29  -5.473  -8.668   3.724
  246    HB3  GLU  29           HB3      GLU  29  -6.429 -10.088   4.141
  247    HG2  GLU  29           HG2      GLU  29  -8.364  -9.222   3.038
  248    HG3  GLU  29           HG3      GLU  29  -7.628  -7.633   2.837
  249    H    GLY  30           H        GLY  30  -4.356  -7.891   5.435
  250    HA2  GLY  30           HA2      GLY  30  -3.722  -9.720   7.648
  251    HA3  GLY  30           HA3      GLY  30  -2.579  -8.935   6.564
  252    H    THR  31           H        THR  31  -1.711  -7.006   7.096
  253    HA   THR  31           HA       THR  31  -2.645  -5.446   9.403
  254    HB   THR  31           HB       THR  31  -0.349  -5.319  10.371
  255    HG1  THR  31           HG1      THR  31   0.478  -7.432   8.680
  256   HG21  THR  31          HG21      THR  31  -1.785  -7.099  11.323
  257   HG22  THR  31          HG22      THR  31  -0.091  -7.584  11.320
  258   HG23  THR  31          HG23      THR  31  -1.195  -8.238  10.109
  259    H    SER  32           H        SER  32  -1.473  -3.342   9.452
  260    HA   SER  32           HA       SER  32  -0.983  -2.092   6.954
  261    HB2  SER  32           HB2      SER  32  -0.071  -0.197   8.367
  262    HB3  SER  32           HB3      SER  32  -1.667  -0.741   8.869
  263    HG   SER  32           HG       SER  32   0.803  -1.467  10.081
  264    H    GLU  33           H        GLU  33   1.004  -3.996   9.079
  265    HA   GLU  33           HA       GLU  33   3.585  -3.254   8.156
  266    HB2  GLU  33           HB2      GLU  33   2.884  -6.036   9.178
  267    HB3  GLU  33           HB3      GLU  33   4.424  -5.193   9.291
  268    HG2  GLU  33           HG2      GLU  33   1.899  -4.675  10.871
  269    HG3  GLU  33           HG3      GLU  33   3.453  -5.244  11.472
  270    H    ASP  34           H        ASP  34   1.229  -5.713   7.091
  271    HA   ASP  34           HA       ASP  34   2.732  -6.992   5.075
  272    HB2  ASP  34           HB2      ASP  34  -0.273  -6.564   5.333
  273    HB3  ASP  34           HB3      ASP  34   0.421  -7.467   3.991
  274    H    ALA  35           H        ALA  35   0.637  -4.170   4.963
  275    HA   ALA  35           HA       ALA  35   0.566  -3.818   2.162
  276    HB1  ALA  35           HB1      ALA  35  -1.115  -2.889   3.653
  277    HB2  ALA  35           HB2      ALA  35  -0.377  -1.612   2.685
  278    HB3  ALA  35           HB3      ALA  35   0.082  -1.818   4.379
  279    H    GLU  36           H        GLU  36   2.540  -2.127   4.678
  280    HA   GLU  36           HA       GLU  36   4.023  -0.591   2.767
  281    HB2  GLU  36           HB2      GLU  36   5.484   0.070   4.629
  282    HB3  GLU  36           HB3      GLU  36   3.791   0.197   5.086
  283    HG2  GLU  36           HG2      GLU  36   3.923  -1.779   6.454
  284    HG3  GLU  36           HG3      GLU  36   5.519  -2.176   5.826
  285    H    ARG  37           H        ARG  37   4.517  -3.721   4.284
  286    HA   ARG  37           HA       ARG  37   7.173  -4.304   3.591
  287    HB2  ARG  37           HB2      ARG  37   6.041  -5.811   5.084
  288    HB3  ARG  37           HB3      ARG  37   4.733  -6.085   3.946
  289    HG2  ARG  37           HG2      ARG  37   6.170  -8.062   4.137
  290    HG3  ARG  37           HG3      ARG  37   6.224  -7.398   2.504
  291    HD2  ARG  37           HD2      ARG  37   8.385  -6.268   3.103
  292    HD3  ARG  37           HD3      ARG  37   8.334  -7.095   4.664
  293    HE   ARG  37           HE       ARG  37   8.132  -9.147   2.982
  294   HH11  ARG  37          HH11      ARG  37  10.390  -6.448   2.969
  295   HH12  ARG  37          HH12      ARG  37  11.660  -7.366   2.222
  296   HH21  ARG  37          HH21      ARG  37   9.799 -10.339   2.051
  297   HH22  ARG  37          HH22      ARG  37  11.320  -9.577   1.701
  298    H    MET  38           H        MET  38   4.158  -4.870   1.776
  299    HA   MET  38           HA       MET  38   5.556  -5.959  -0.504
  300    HB2  MET  38           HB2      MET  38   2.642  -5.165  -0.137
  301    HB3  MET  38           HB3      MET  38   3.284  -5.998  -1.546
  302    HG2  MET  38           HG2      MET  38   3.505  -7.202   1.212
  303    HG3  MET  38           HG3      MET  38   2.049  -7.373   0.244
  304    HE1  MET  38           HE1      MET  38   5.628  -8.703   0.944
  305    HE2  MET  38           HE2      MET  38   6.054  -7.781  -0.499
  306    HE3  MET  38           HE3      MET  38   6.060  -9.543  -0.547
  307    H    ALA  39           H        ALA  39   4.394  -2.816   0.542
  308    HA   ALA  39           HA       ALA  39   4.080  -1.477  -1.903
  309    HB1  ALA  39           HB1      ALA  39   4.234   0.601  -0.614
  310    HB2  ALA  39           HB2      ALA  39   4.903  -0.287   0.761
  311    HB3  ALA  39           HB3      ALA  39   3.248  -0.594   0.233
  312    H    ARG  40           H        ARG  40   6.938  -1.828   0.127
  313    HA   ARG  40           HA       ARG  40   8.660  -0.103  -1.376
  314    HB2  ARG  40           HB2      ARG  40  10.474  -1.109   0.056
  315    HB3  ARG  40           HB3      ARG  40   9.119  -0.438   0.953
  316    HG2  ARG  40           HG2      ARG  40   8.197  -2.797   1.139
  317    HG3  ARG  40           HG3      ARG  40   9.726  -3.363   0.463
  318    HD2  ARG  40           HD2      ARG  40   9.692  -3.505   2.932
  319    HD3  ARG  40           HD3      ARG  40  10.947  -2.403   2.356
  320    HE   ARG  40           HE       ARG  40   9.312  -0.568   2.858
  321   HH11  ARG  40          HH11      ARG  40   9.135  -3.563   4.731
  322   HH12  ARG  40          HH12      ARG  40   8.408  -2.776   6.096
  323   HH21  ARG  40          HH21      ARG  40   8.358   0.400   4.619
  324   HH22  ARG  40          HH22      ARG  40   7.963  -0.527   6.034
  325    H    ASN  41           H        ASN  41   7.551  -3.265  -2.033
  326    HA   ASN  41           HA       ASN  41   9.513  -3.529  -4.228
  327    HB2  ASN  41           HB2      ASN  41   9.503  -6.033  -3.893
  328    HB3  ASN  41           HB3      ASN  41  10.279  -5.142  -2.596
  329   HD21  ASN  41          HD21      ASN  41   9.497  -5.362  -0.533
  330   HD22  ASN  41          HD22      ASN  41   8.150  -6.352  -0.114
  331    H    CYS  42           H        CYS  42   6.630  -2.601  -3.913
  332    HA   CYS  42           HA       CYS  42   5.033  -4.526  -5.406
  333    HB2  CYS  42           HB2      CYS  42   3.939  -3.158  -3.699
  334    HB3  CYS  42           HB3      CYS  42   4.458  -1.682  -4.497
  335    H    GLU  43           H        GLU  43   6.830  -1.598  -5.982
  336    HA   GLU  43           HA       GLU  43   6.375  -1.807  -8.889
  337    HB2  GLU  43           HB2      GLU  43   6.780   0.835  -8.751
  338    HB3  GLU  43           HB3      GLU  43   5.181   0.142  -8.552
  339    HG2  GLU  43           HG2      GLU  43   5.578   1.895  -6.916
  340    HG3  GLU  43           HG3      GLU  43   5.342   0.342  -6.130
  341    H    SER  44           H        SER  44   8.580  -1.388  -6.242
  342    HA   SER  44           HA       SER  44  10.917  -0.848  -7.862
  343    HB2  SER  44           HB2      SER  44  10.631  -1.589  -4.912
  344    HB3  SER  44           HB3      SER  44  12.146  -1.114  -5.686
  345    HG   SER  44           HG       SER  44   9.791   0.474  -5.475
  Start of MODEL    7
    1    H1   ALA   1           H1       ALA   1  -4.967   5.715  14.237
    2    H2   ALA   1           H2       ALA   1  -4.398   4.193  13.776
    3    H3   ALA   1           H3       ALA   1  -6.057   4.486  13.857
    4    HA   ALA   1           HA       ALA   1  -5.950   6.034  12.063
    5    HB1  ALA   1           HB1      ALA   1  -3.854   6.359  10.816
    6    HB2  ALA   1           HB2      ALA   1  -2.994   5.352  11.985
    7    HB3  ALA   1           HB3      ALA   1  -3.692   6.892  12.490
    8    HA   PRO   2           HA       PRO   2  -6.470   1.779  10.376
    9    HB2  PRO   2           HB2      PRO   2  -9.006   2.547   9.192
   10    HB3  PRO   2           HB3      PRO   2  -8.744   1.556  10.634
   11    HG2  PRO   2           HG2      PRO   2  -9.884   4.078  10.661
   12    HG3  PRO   2           HG3      PRO   2  -9.133   3.283  12.058
   13    HD2  PRO   2           HD2      PRO   2  -7.971   5.393  10.255
   14    HD3  PRO   2           HD3      PRO   2  -7.790   5.182  12.013
   15    H    CYS   3           H        CYS   3  -4.649   2.458   9.019
   16    HA   CYS   3           HA       CYS   3  -3.610   2.364   7.041
   17    HB2  CYS   3           HB2      CYS   3  -6.365   1.637   5.990
   18    HB3  CYS   3           HB3      CYS   3  -4.860   1.428   5.088
   19    H    GLU   4           H        GLU   4  -5.190   4.935   7.856
   20    HA   GLU   4           HA       GLU   4  -5.846   6.292   5.427
   21    HB2  GLU   4           HB2      GLU   4  -5.959   8.330   6.912
   22    HB3  GLU   4           HB3      GLU   4  -6.939   6.978   7.468
   23    HG2  GLU   4           HG2      GLU   4  -5.185   6.390   9.114
   24    HG3  GLU   4           HG3      GLU   4  -4.227   7.774   8.584
   25    H    ASP   5           H        ASP   5  -3.036   6.284   7.597
   26    HA   ASP   5           HA       ASP   5  -1.396   8.141   6.244
   27    HB2  ASP   5           HB2      ASP   5  -0.730   5.793   8.086
   28    HB3  ASP   5           HB3      ASP   5   0.508   6.872   7.437
   29    H    LEU   6           H        LEU   6  -1.642   4.598   6.092
   30    HA   LEU   6           HA       LEU   6   0.473   4.128   4.295
   31    HB2  LEU   6           HB2      LEU   6  -0.432   2.391   5.760
   32    HB3  LEU   6           HB3      LEU   6  -1.974   2.451   4.938
   33    HG   LEU   6           HG       LEU   6   0.363   1.749   3.185
   34   HD11  LEU   6          HD11      LEU   6   0.472  -0.581   3.893
   35   HD12  LEU   6          HD12      LEU   6  -0.626  -0.246   5.235
   36   HD13  LEU   6          HD13      LEU   6   0.975   0.501   5.193
   37   HD21  LEU   6          HD21      LEU   6  -2.421   0.544   3.463
   38   HD22  LEU   6          HD22      LEU   6  -1.239   0.124   2.219
   39   HD23  LEU   6          HD23      LEU   6  -1.925   1.747   2.268
   40    H    LYS   7           H        LYS   7  -3.008   4.498   3.782
   41    HA   LYS   7           HA       LYS   7  -3.257   3.912   1.089
   42    HB2  LYS   7           HB2      LYS   7  -5.200   4.158   2.470
   43    HB3  LYS   7           HB3      LYS   7  -4.798   5.822   2.873
   44    HG2  LYS   7           HG2      LYS   7  -5.345   6.556   0.614
   45    HG3  LYS   7           HG3      LYS   7  -5.587   4.885   0.095
   46    HD2  LYS   7           HD2      LYS   7  -7.726   6.085   0.507
   47    HD3  LYS   7           HD3      LYS   7  -7.537   4.658   1.525
   48    HE2  LYS   7           HE2      LYS   7  -6.784   6.192   3.392
   49    HE3  LYS   7           HE3      LYS   7  -7.182   7.563   2.350
   50    HZ1  LYS   7           HZ1      LYS   7  -8.979   7.055   3.860
   51    HZ2  LYS   7           HZ2      LYS   7  -9.070   5.471   3.286
   52    HZ3  LYS   7           HZ3      LYS   7  -9.468   6.761   2.271
   53    H    GLU   8           H        GLU   8  -2.689   7.139   2.557
   54    HA   GLU   8           HA       GLU   8  -2.534   8.448   0.012
   55    HB2  GLU   8           HB2      GLU   8  -1.781   9.417   2.793
   56    HB3  GLU   8           HB3      GLU   8  -1.809  10.441   1.353
   57    HG2  GLU   8           HG2      GLU   8  -4.170   8.988   2.584
   58    HG3  GLU   8           HG3      GLU   8  -3.868  10.727   2.633
   59    H    ARG   9           H        ARG   9  -0.163   6.995   2.168
   60    HA   ARG   9           HA       ARG   9   2.198   7.904   0.899
   61    HB2  ARG   9           HB2      ARG   9   1.628   5.319   2.400
   62    HB3  ARG   9           HB3      ARG   9   3.233   5.745   1.806
   63    HG2  ARG   9           HG2      ARG   9   3.305   7.700   3.250
   64    HG3  ARG   9           HG3      ARG   9   1.640   7.423   3.769
   65    HD2  ARG   9           HD2      ARG   9   2.366   5.225   4.734
   66    HD3  ARG   9           HD3      ARG   9   4.037   5.643   4.324
   67    HE   ARG   9           HE       ARG   9   3.299   7.762   5.780
   68   HH11  ARG   9          HH11      ARG   9   2.968   4.329   6.455
   69   HH12  ARG   9          HH12      ARG   9   3.052   4.538   8.173
   70   HH21  ARG   9          HH21      ARG   9   3.382   8.016   8.036
   71   HH22  ARG   9          HH22      ARG   9   3.285   6.622   9.066
   72    H    LEU  10           H        LEU  10  -0.177   5.452  -0.008
   73    HA   LEU  10           HA       LEU  10   1.405   3.949  -1.792
   74    HB2  LEU  10           HB2      LEU  10  -1.595   4.405  -1.944
   75    HB3  LEU  10           HB3      LEU  10  -0.707   3.121  -2.751
   76    HG   LEU  10           HG       LEU  10  -1.087   3.423   0.248
   77   HD11  LEU  10          HD11      LEU  10  -2.245   1.333  -1.600
   78   HD12  LEU  10          HD12      LEU  10  -3.119   2.694  -0.892
   79   HD13  LEU  10          HD13      LEU  10  -2.460   1.437   0.150
   80   HD21  LEU  10          HD21      LEU  10   0.391   1.238  -1.245
   81   HD22  LEU  10          HD22      LEU  10   0.026   1.244   0.483
   82   HD23  LEU  10          HD23      LEU  10   1.106   2.459  -0.189
   83    H    LYS  11           H        LYS  11  -0.736   6.777  -2.365
   84    HA   LYS  11           HA       LYS  11   0.015   6.991  -5.157
   85    HB2  LYS  11           HB2      LYS  11  -1.537   8.894  -3.361
   86    HB3  LYS  11           HB3      LYS  11  -1.208   9.211  -5.056
   87    HG2  LYS  11           HG2      LYS  11  -3.394   8.378  -5.065
   88    HG3  LYS  11           HG3      LYS  11  -2.415   7.002  -5.561
   89    HD2  LYS  11           HD2      LYS  11  -4.175   6.321  -3.991
   90    HD3  LYS  11           HD3      LYS  11  -2.574   6.057  -3.287
   91    HE2  LYS  11           HE2      LYS  11  -4.155   7.018  -1.650
   92    HE3  LYS  11           HE3      LYS  11  -2.802   8.103  -1.951
   93    HZ1  LYS  11           HZ1      LYS  11  -5.511   8.353  -3.140
   94    HZ2  LYS  11           HZ2      LYS  11  -4.229   9.425  -3.380
   95    HZ3  LYS  11           HZ3      LYS  11  -4.919   9.263  -1.845
   96    H    LYS  12           H        LYS  12   1.125   8.329  -2.123
   97    HA   LYS  12           HA       LYS  12   2.594  10.553  -3.067
   98    HB2  LYS  12           HB2      LYS  12   1.843  10.164  -0.693
   99    HB3  LYS  12           HB3      LYS  12   3.057   8.907  -0.536
  100    HG2  LYS  12           HG2      LYS  12   3.879  11.717  -1.268
  101    HG3  LYS  12           HG3      LYS  12   3.506  11.321   0.409
  102    HD2  LYS  12           HD2      LYS  12   5.290   9.642   0.456
  103    HD3  LYS  12           HD3      LYS  12   5.599   9.865  -1.266
  104    HE2  LYS  12           HE2      LYS  12   6.327  12.183  -0.828
  105    HE3  LYS  12           HE3      LYS  12   6.032  11.946   0.897
  106    HZ1  LYS  12           HZ1      LYS  12   7.988  10.444  -0.754
  107    HZ2  LYS  12           HZ2      LYS  12   7.694  10.196   0.892
  108    HZ3  LYS  12           HZ3      LYS  12   8.348  11.659   0.363
  109    H    LEU  13           H        LEU  13   3.409   7.143  -2.657
  110    HA   LEU  13           HA       LEU  13   6.206   7.376  -3.209
  111    HB2  LEU  13           HB2      LEU  13   4.320   4.992  -3.192
  112    HB3  LEU  13           HB3      LEU  13   6.045   4.840  -3.490
  113    HG   LEU  13           HG       LEU  13   4.817   5.910  -0.913
  114   HD11  LEU  13          HD11      LEU  13   6.085   3.205  -1.417
  115   HD12  LEU  13          HD12      LEU  13   4.365   3.519  -1.170
  116   HD13  LEU  13          HD13      LEU  13   5.506   3.820   0.138
  117   HD21  LEU  13          HD21      LEU  13   7.004   6.901  -1.330
  118   HD22  LEU  13          HD22      LEU  13   7.716   5.303  -1.582
  119   HD23  LEU  13          HD23      LEU  13   7.094   5.760   0.009
  120    H    GLY  14           H        GLY  14   3.368   7.279  -5.173
  121    HA2  GLY  14           HA2      GLY  14   3.048   7.524  -7.418
  122    HA3  GLY  14           HA3      GLY  14   4.781   7.779  -7.601
  123    H    MET  15           H        MET  15   3.009   5.001  -6.313
  124    HA   MET  15           HA       MET  15   4.584   3.088  -7.781
  125    HB2  MET  15           HB2      MET  15   3.299   1.406  -6.545
  126    HB3  MET  15           HB3      MET  15   3.838   2.680  -5.461
  127    HG2  MET  15           HG2      MET  15   1.590   3.667  -5.485
  128    HG3  MET  15           HG3      MET  15   1.049   2.427  -6.611
  129    HE1  MET  15           HE1      MET  15   2.608   3.044  -3.076
  130    HE2  MET  15           HE2      MET  15   3.527   1.627  -3.595
  131    HE3  MET  15           HE3      MET  15   2.350   1.489  -2.290
  132    H    SER  16           H        SER  16   3.061   1.069  -8.562
  133    HA   SER  16           HA       SER  16   1.630   1.841 -10.896
  134    HB2  SER  16           HB2      SER  16   1.732  -0.834  -9.443
  135    HB3  SER  16           HB3      SER  16   1.131  -0.589 -11.083
  136    HG   SER  16           HG       SER  16   3.122  -0.487 -11.799
  137    H    GLU  17           H        GLU  17  -0.609   1.819 -11.291
  138    HA   GLU  17           HA       GLU  17  -2.264   2.624  -9.147
  139    HB2  GLU  17           HB2      GLU  17  -2.764   2.100 -12.066
  140    HB3  GLU  17           HB3      GLU  17  -4.147   2.286 -10.991
  141    HG2  GLU  17           HG2      GLU  17  -3.598   4.423 -12.022
  142    HG3  GLU  17           HG3      GLU  17  -3.342   4.473 -10.266
  143    H    GLU  18           H        GLU  18  -1.638  -0.468 -10.492
  144    HA   GLU  18           HA       GLU  18  -3.949  -1.835  -9.506
  145    HB2  GLU  18           HB2      GLU  18  -2.551  -2.675 -11.408
  146    HB3  GLU  18           HB3      GLU  18  -1.206  -2.920 -10.294
  147    HG2  GLU  18           HG2      GLU  18  -2.626  -4.550  -9.023
  148    HG3  GLU  18           HG3      GLU  18  -3.877  -4.367 -10.251
  149    H    CYS  19           H        CYS  19  -0.827  -0.841  -8.205
  150    HA   CYS  19           HA       CYS  19  -0.568  -2.813  -6.172
  151    HB2  CYS  19           HB2      CYS  19   0.736  -0.099  -6.562
  152    HB3  CYS  19           HB3      CYS  19   1.105  -1.145  -5.206
  153    H    ARG  20           H        ARG  20  -1.703   0.623  -6.132
  154    HA   ARG  20           HA       ARG  20  -2.166   0.670  -3.316
  155    HB2  ARG  20           HB2      ARG  20  -3.961   2.465  -4.930
  156    HB3  ARG  20           HB3      ARG  20  -3.065   2.799  -3.460
  157    HG2  ARG  20           HG2      ARG  20  -1.929   4.128  -4.965
  158    HG3  ARG  20           HG3      ARG  20  -0.973   2.660  -5.083
  159    HD2  ARG  20           HD2      ARG  20  -1.464   3.605  -7.276
  160    HD3  ARG  20           HD3      ARG  20  -2.196   2.007  -7.051
  161    HE   ARG  20           HE       ARG  20  -4.326   3.022  -6.817
  162   HH11  ARG  20          HH11      ARG  20  -1.888   5.321  -7.896
  163   HH12  ARG  20          HH12      ARG  20  -3.060   6.430  -8.523
  164   HH21  ARG  20          HH21      ARG  20  -5.822   4.493  -7.633
  165   HH22  ARG  20          HH22      ARG  20  -5.277   5.964  -8.371
  166    H    GLN  21           H        GLN  21  -4.220  -0.243  -6.034
  167    HA   GLN  21           HA       GLN  21  -6.682  -0.543  -4.711
  168    HB2  GLN  21           HB2      GLN  21  -5.528  -1.893  -7.188
  169    HB3  GLN  21           HB3      GLN  21  -7.180  -2.194  -6.645
  170    HG2  GLN  21           HG2      GLN  21  -7.727   0.178  -6.908
  171    HG3  GLN  21           HG3      GLN  21  -6.072   0.537  -7.381
  172   HE21  GLN  21          HE21      GLN  21  -5.412   0.049  -9.487
  173   HE22  GLN  21          HE22      GLN  21  -6.515  -0.378 -10.733
  174    H    ARG  22           H        ARG  22  -3.921  -2.734  -5.035
  175    HA   ARG  22           HA       ARG  22  -5.181  -4.936  -3.624
  176    HB2  ARG  22           HB2      ARG  22  -2.429  -4.436  -4.757
  177    HB3  ARG  22           HB3      ARG  22  -2.571  -5.647  -3.497
  178    HG2  ARG  22           HG2      ARG  22  -2.692  -6.810  -5.564
  179    HG3  ARG  22           HG3      ARG  22  -4.316  -6.800  -4.885
  180    HD2  ARG  22           HD2      ARG  22  -4.902  -4.913  -6.418
  181    HD3  ARG  22           HD3      ARG  22  -3.290  -5.030  -7.128
  182    HE   ARG  22           HE       ARG  22  -5.554  -6.691  -7.686
  183   HH11  ARG  22          HH11      ARG  22  -2.027  -6.774  -7.607
  184   HH12  ARG  22          HH12      ARG  22  -1.927  -8.071  -8.752
  185   HH21  ARG  22          HH21      ARG  22  -5.381  -8.341  -9.206
  186   HH22  ARG  22          HH22      ARG  22  -3.822  -8.961  -9.661
  187    H    LEU  23           H        LEU  23  -2.947  -2.285  -2.749
  188    HA   LEU  23           HA       LEU  23  -2.055  -3.547  -0.341
  189    HB2  LEU  23           HB2      LEU  23  -1.595  -0.758  -1.419
  190    HB3  LEU  23           HB3      LEU  23  -0.777  -1.426  -0.022
  191    HG   LEU  23           HG       LEU  23  -0.559  -2.410  -2.878
  192   HD11  LEU  23          HD11      LEU  23   1.545  -1.157  -1.135
  193   HD12  LEU  23          HD12      LEU  23   0.712  -0.393  -2.493
  194   HD13  LEU  23          HD13      LEU  23   1.765  -1.778  -2.776
  195   HD21  LEU  23          HD21      LEU  23  -0.541  -4.326  -1.382
  196   HD22  LEU  23          HD22      LEU  23   0.753  -3.585  -0.423
  197   HD23  LEU  23          HD23      LEU  23   1.043  -4.059  -2.101
  198    H    GLU  24           H        GLU  24  -4.381  -1.052  -1.100
  199    HA   GLU  24           HA       GLU  24  -4.945  -0.154   1.515
  200    HB2  GLU  24           HB2      GLU  24  -5.953   0.323  -1.149
  201    HB3  GLU  24           HB3      GLU  24  -7.345  -0.058  -0.149
  202    HG2  GLU  24           HG2      GLU  24  -5.299   2.061   0.580
  203    HG3  GLU  24           HG3      GLU  24  -6.745   2.399  -0.372
  204    H    LYS  25           H        LYS  25  -6.008  -2.912  -0.365
  205    HA   LYS  25           HA       LYS  25  -8.025  -3.845   1.472
  206    HB2  LYS  25           HB2      LYS  25  -8.341  -4.456  -0.811
  207    HB3  LYS  25           HB3      LYS  25  -6.689  -5.025  -0.980
  208    HG2  LYS  25           HG2      LYS  25  -7.156  -7.024   0.296
  209    HG3  LYS  25           HG3      LYS  25  -8.747  -6.421   0.766
  210    HD2  LYS  25           HD2      LYS  25  -7.940  -7.031  -2.107
  211    HD3  LYS  25           HD3      LYS  25  -8.755  -8.185  -1.048
  212    HE2  LYS  25           HE2      LYS  25  -9.886  -5.481  -1.879
  213    HE3  LYS  25           HE3      LYS  25 -10.332  -7.039  -2.577
  214    HZ1  LYS  25           HZ1      LYS  25 -10.678  -6.334   0.285
  215    HZ2  LYS  25           HZ2      LYS  25 -11.226  -7.730  -0.484
  216    HZ3  LYS  25           HZ3      LYS  25 -11.896  -6.233  -0.880
  217    H    MET  26           H        MET  26  -4.623  -4.639   0.794
  218    HA   MET  26           HA       MET  26  -4.372  -6.895   2.489
  219    HB2  MET  26           HB2      MET  26  -2.258  -4.961   1.449
  220    HB3  MET  26           HB3      MET  26  -1.888  -6.463   2.293
  221    HG2  MET  26           HG2      MET  26  -3.324  -6.223  -0.363
  222    HG3  MET  26           HG3      MET  26  -1.650  -6.729  -0.128
  223    HE1  MET  26           HE1      MET  26  -1.903  -8.615   2.474
  224    HE2  MET  26           HE2      MET  26  -0.975  -9.070   1.045
  225    HE3  MET  26           HE3      MET  26  -2.162 -10.186   1.718
  226    H    CYS  27           H        CYS  27  -4.122  -3.458   3.048
  227    HA   CYS  27           HA       CYS  27  -2.765  -3.542   5.554
  228    HB2  CYS  27           HB2      CYS  27  -2.681  -1.565   4.090
  229    HB3  CYS  27           HB3      CYS  27  -4.417  -1.332   4.282
  230    H    LYS  28           H        LYS  28  -6.207  -3.323   4.586
  231    HA   LYS  28           HA       LYS  28  -7.247  -2.996   7.251
  232    HB2  LYS  28           HB2      LYS  28  -8.747  -4.114   4.835
  233    HB3  LYS  28           HB3      LYS  28  -9.453  -3.393   6.283
  234    HG2  LYS  28           HG2      LYS  28  -8.523  -1.196   5.633
  235    HG3  LYS  28           HG3      LYS  28  -7.814  -1.931   4.191
  236    HD2  LYS  28           HD2      LYS  28 -10.252  -2.670   3.621
  237    HD3  LYS  28           HD3      LYS  28 -10.744  -1.497   4.846
  238    HE2  LYS  28           HE2      LYS  28  -9.212  -0.934   2.286
  239    HE3  LYS  28           HE3      LYS  28 -10.877  -0.477   2.654
  240    HZ1  LYS  28           HZ1      LYS  28  -9.537   1.418   2.953
  241    HZ2  LYS  28           HZ2      LYS  28  -8.394   0.586   3.870
  242    HZ3  LYS  28           HZ3      LYS  28  -9.931   0.885   4.509
  243    H    GLU  29           H        GLU  29  -7.150  -5.698   4.955
  244    HA   GLU  29           HA       GLU  29  -8.217  -7.617   6.859
  245    HB2  GLU  29           HB2      GLU  29  -7.472  -7.909   3.914
  246    HB3  GLU  29           HB3      GLU  29  -8.303  -9.131   4.881
  247    HG2  GLU  29           HG2      GLU  29 -10.171  -7.527   5.247
  248    HG3  GLU  29           HG3      GLU  29  -9.359  -6.368   4.194
  249    H    GLY  30           H        GLY  30  -5.299  -6.465   6.793
  250    HA2  GLY  30           HA2      GLY  30  -4.157  -8.890   7.922
  251    HA3  GLY  30           HA3      GLY  30  -3.307  -8.230   6.526
  252    H    THR  31           H        THR  31  -1.594  -7.124   7.172
  253    HA   THR  31           HA       THR  31  -1.799  -5.282   9.481
  254    HB   THR  31           HB       THR  31   0.678  -5.744   9.863
  255    HG1  THR  31           HG1      THR  31   0.254  -8.120   8.360
  256   HG21  THR  31          HG21      THR  31  -1.010  -6.777  11.341
  257   HG22  THR  31          HG22      THR  31   0.345  -7.878  11.076
  258   HG23  THR  31          HG23      THR  31  -1.176  -8.128  10.217
  259    H    SER  32           H        SER  32  -0.771  -3.329   9.266
  260    HA   SER  32           HA       SER  32  -0.588  -2.263   6.628
  261    HB2  SER  32           HB2      SER  32   0.220  -0.937   9.250
  262    HB3  SER  32           HB3      SER  32  -0.248  -0.136   7.739
  263    HG   SER  32           HG       SER  32  -2.279  -1.551   8.168
  264    H    GLU  33           H        GLU  33   1.780  -3.330   9.049
  265    HA   GLU  33           HA       GLU  33   4.129  -2.226   7.895
  266    HB2  GLU  33           HB2      GLU  33   3.786  -4.672   9.684
  267    HB3  GLU  33           HB3      GLU  33   5.347  -3.959   9.267
  268    HG2  GLU  33           HG2      GLU  33   4.687  -1.853  10.379
  269    HG3  GLU  33           HG3      GLU  33   3.122  -2.556  10.798
  270    H    ASP  34           H        ASP  34   2.372  -5.234   7.303
  271    HA   ASP  34           HA       ASP  34   4.245  -6.401   5.466
  272    HB2  ASP  34           HB2      ASP  34   2.701  -7.908   6.533
  273    HB3  ASP  34           HB3      ASP  34   1.313  -6.934   6.065
  274    H    ALA  35           H        ALA  35   1.194  -4.586   5.119
  275    HA   ALA  35           HA       ALA  35   0.974  -4.763   2.319
  276    HB1  ALA  35           HB1      ALA  35  -0.174  -2.650   4.164
  277    HB2  ALA  35           HB2      ALA  35  -0.913  -4.211   3.796
  278    HB3  ALA  35           HB3      ALA  35  -0.725  -3.006   2.521
  279    H    GLU  36           H        GLU  36   2.620  -2.363   4.365
  280    HA   GLU  36           HA       GLU  36   3.307  -0.626   2.169
  281    HB2  GLU  36           HB2      GLU  36   4.619   0.660   3.729
  282    HB3  GLU  36           HB3      GLU  36   3.123   0.213   4.541
  283    HG2  GLU  36           HG2      GLU  36   4.274  -1.514   5.809
  284    HG3  GLU  36           HG3      GLU  36   5.773  -1.219   4.927
  285    H    ARG  37           H        ARG  37   4.832  -3.403   3.789
  286    HA   ARG  37           HA       ARG  37   7.379  -3.208   2.527
  287    HB2  ARG  37           HB2      ARG  37   7.088  -4.622   4.476
  288    HB3  ARG  37           HB3      ARG  37   5.909  -5.621   3.645
  289    HG2  ARG  37           HG2      ARG  37   7.520  -6.790   2.443
  290    HG3  ARG  37           HG3      ARG  37   8.658  -5.443   2.444
  291    HD2  ARG  37           HD2      ARG  37   7.998  -7.132   4.875
  292    HD3  ARG  37           HD3      ARG  37   9.398  -7.385   3.826
  293    HE   ARG  37           HE       ARG  37   8.934  -5.094   5.626
  294   HH11  ARG  37          HH11      ARG  37  11.152  -6.847   3.519
  295   HH12  ARG  37          HH12      ARG  37  12.533  -5.944   4.042
  296   HH21  ARG  37          HH21      ARG  37  10.749  -3.913   6.240
  297   HH22  ARG  37          HH22      ARG  37  12.303  -4.286   5.577
  298    H    MET  38           H        MET  38   4.276  -4.501   1.513
  299    HA   MET  38           HA       MET  38   5.139  -5.698  -0.932
  300    HB2  MET  38           HB2      MET  38   2.417  -4.577  -0.202
  301    HB3  MET  38           HB3      MET  38   2.754  -5.636  -1.564
  302    HG2  MET  38           HG2      MET  38   3.010  -6.382   1.358
  303    HG3  MET  38           HG3      MET  38   1.672  -6.805   0.297
  304    HE1  MET  38           HE1      MET  38   5.640  -9.004   0.680
  305    HE2  MET  38           HE2      MET  38   4.793  -8.036   1.891
  306    HE3  MET  38           HE3      MET  38   5.692  -7.245   0.594
  307    H    ALA  39           H        ALA  39   4.066  -2.432  -0.016
  308    HA   ALA  39           HA       ALA  39   4.206  -1.175  -2.551
  309    HB1  ALA  39           HB1      ALA  39   4.423   0.931  -1.294
  310    HB2  ALA  39           HB2      ALA  39   4.757   0.029   0.187
  311    HB3  ALA  39           HB3      ALA  39   3.177  -0.101  -0.587
  312    H    ARG  40           H        ARG  40   6.644  -1.884  -0.095
  313    HA   ARG  40           HA       ARG  40   8.823  -0.508  -1.306
  314    HB2  ARG  40           HB2      ARG  40   8.787  -2.720   0.789
  315    HB3  ARG  40           HB3      ARG  40  10.227  -1.809   0.331
  316    HG2  ARG  40           HG2      ARG  40   9.242   0.260   1.172
  317    HG3  ARG  40           HG3      ARG  40   7.727  -0.568   1.533
  318    HD2  ARG  40           HD2      ARG  40   8.946  -2.000   3.184
  319    HD3  ARG  40           HD3      ARG  40  10.419  -1.082   2.845
  320    HE   ARG  40           HE       ARG  40   8.051   0.376   3.791
  321   HH11  ARG  40          HH11      ARG  40  11.264  -0.854   4.529
  322   HH12  ARG  40          HH12      ARG  40  11.438   0.123   5.950
  323   HH21  ARG  40          HH21      ARG  40   8.282   1.615   5.673
  324   HH22  ARG  40          HH22      ARG  40   9.747   1.523   6.599
  325    H    ASN  41           H        ASN  41   7.248  -3.336  -2.325
  326    HA   ASN  41           HA       ASN  41   9.506  -3.798  -4.197
  327    HB2  ASN  41           HB2      ASN  41   9.043  -6.177  -4.340
  328    HB3  ASN  41           HB3      ASN  41   9.344  -5.757  -2.666
  329   HD21  ASN  41          HD21      ASN  41   7.679  -6.011  -1.166
  330   HD22  ASN  41          HD22      ASN  41   6.219  -6.855  -1.536
  331    H    CYS  42           H        CYS  42   6.831  -2.226  -4.123
  332    HA   CYS  42           HA       CYS  42   5.781  -3.081  -6.735
  333    HB2  CYS  42           HB2      CYS  42   4.029  -2.429  -5.165
  334    HB3  CYS  42           HB3      CYS  42   4.839  -0.898  -4.848
  335    H    GLU  43           H        GLU  43   6.834   0.077  -5.289
  336    HA   GLU  43           HA       GLU  43   7.786   0.862  -7.982
  337    HB2  GLU  43           HB2      GLU  43   7.472   3.145  -7.430
  338    HB3  GLU  43           HB3      GLU  43   6.049   2.317  -6.816
  339    HG2  GLU  43           HG2      GLU  43   8.398   3.319  -5.172
  340    HG3  GLU  43           HG3      GLU  43   6.821   4.093  -5.297
  341    H    SER  44           H        SER  44   8.855   0.592  -4.597
  342    HA   SER  44           HA       SER  44  11.460   1.715  -4.987
  343    HB2  SER  44           HB2      SER  44  10.417  -0.180  -2.841
  344    HB3  SER  44           HB3      SER  44  12.007   0.582  -2.802
  345    HG   SER  44           HG       SER  44   9.727   2.169  -3.149
  Start of MODEL    8
    1    H1   ALA   1           H1       ALA   1  -3.044   6.231  11.001
    2    H2   ALA   1           H2       ALA   1  -3.687   5.517  12.392
    3    H3   ALA   1           H3       ALA   1  -3.642   7.202  12.247
    4    HA   ALA   1           HA       ALA   1  -5.862   6.324  11.884
    5    HB1  ALA   1           HB1      ALA   1  -6.294   7.559   9.780
    6    HB2  ALA   1           HB2      ALA   1  -4.563   7.559   9.427
    7    HB3  ALA   1           HB3      ALA   1  -5.179   8.436  10.828
    8    HA   PRO   2           HA       PRO   2  -6.028   2.205  10.325
    9    HB2  PRO   2           HB2      PRO   2  -8.652   2.061   9.348
   10    HB3  PRO   2           HB3      PRO   2  -8.206   1.959  11.065
   11    HG2  PRO   2           HG2      PRO   2  -9.170   4.346   9.510
   12    HG3  PRO   2           HG3      PRO   2  -9.646   3.801  11.137
   13    HD2  PRO   2           HD2      PRO   2  -7.908   5.816  10.840
   14    HD3  PRO   2           HD3      PRO   2  -7.671   4.615  12.133
   15    H    CYS   3           H        CYS   3  -4.552   2.254   8.675
   16    HA   CYS   3           HA       CYS   3  -3.684   1.865   6.656
   17    HB2  CYS   3           HB2      CYS   3  -6.568   1.501   5.799
   18    HB3  CYS   3           HB3      CYS   3  -5.166   1.037   4.832
   19    H    GLU   4           H        GLU   4  -5.009   4.655   7.410
   20    HA   GLU   4           HA       GLU   4  -5.480   5.862   4.836
   21    HB2  GLU   4           HB2      GLU   4  -6.756   6.577   6.831
   22    HB3  GLU   4           HB3      GLU   4  -5.268   7.138   7.589
   23    HG2  GLU   4           HG2      GLU   4  -4.986   8.772   5.688
   24    HG3  GLU   4           HG3      GLU   4  -6.561   8.262   5.081
   25    H    ASP   5           H        ASP   5  -2.960   6.150   7.394
   26    HA   ASP   5           HA       ASP   5  -1.242   7.967   6.111
   27    HB2  ASP   5           HB2      ASP   5  -0.399   5.617   7.875
   28    HB3  ASP   5           HB3      ASP   5   0.569   7.048   7.530
   29    H    LEU   6           H        LEU   6  -1.485   4.447   5.871
   30    HA   LEU   6           HA       LEU   6   0.660   3.944   4.112
   31    HB2  LEU   6           HB2      LEU   6  -0.706   2.317   5.561
   32    HB3  LEU   6           HB3      LEU   6  -1.920   2.345   4.299
   33    HG   LEU   6           HG       LEU   6   0.952   1.476   3.745
   34   HD11  LEU   6          HD11      LEU   6   0.243  -0.839   4.039
   35   HD12  LEU   6          HD12      LEU   6  -1.352  -0.300   4.573
   36   HD13  LEU   6          HD13      LEU   6   0.079   0.072   5.539
   37   HD21  LEU   6          HD21      LEU   6  -0.372   1.966   1.732
   38   HD22  LEU   6          HD22      LEU   6  -1.635   0.859   2.271
   39   HD23  LEU   6          HD23      LEU   6  -0.034   0.240   1.849
   40    H    LYS   7           H        LYS   7  -2.788   4.617   3.578
   41    HA   LYS   7           HA       LYS   7  -2.813   4.507   0.750
   42    HB2  LYS   7           HB2      LYS   7  -4.853   4.319   2.019
   43    HB3  LYS   7           HB3      LYS   7  -4.615   5.898   2.756
   44    HG2  LYS   7           HG2      LYS   7  -5.046   7.006   0.616
   45    HG3  LYS   7           HG3      LYS   7  -5.159   5.442  -0.196
   46    HD2  LYS   7           HD2      LYS   7  -7.383   6.469   0.285
   47    HD3  LYS   7           HD3      LYS   7  -7.178   4.878   1.020
   48    HE2  LYS   7           HE2      LYS   7  -8.292   6.440   2.563
   49    HE3  LYS   7           HE3      LYS   7  -6.730   5.943   3.207
   50    HZ1  LYS   7           HZ1      LYS   7  -5.802   8.048   2.442
   51    HZ2  LYS   7           HZ2      LYS   7  -7.100   8.303   3.496
   52    HZ3  LYS   7           HZ3      LYS   7  -7.310   8.512   1.836
   53    H    GLU   8           H        GLU   8  -1.991   7.125   2.983
   54    HA   GLU   8           HA       GLU   8  -1.856   9.208   1.043
   55    HB2  GLU   8           HB2      GLU   8  -0.303   9.078   3.658
   56    HB3  GLU   8           HB3      GLU   8  -0.653  10.519   2.706
   57    HG2  GLU   8           HG2      GLU   8  -2.559   8.855   4.346
   58    HG3  GLU   8           HG3      GLU   8  -2.104  10.534   4.595
   59    H    ARG   9           H        ARG   9   0.440   6.851   2.338
   60    HA   ARG   9           HA       ARG   9   2.730   7.672   0.869
   61    HB2  ARG   9           HB2      ARG   9   1.994   4.912   1.939
   62    HB3  ARG   9           HB3      ARG   9   3.584   5.353   1.315
   63    HG2  ARG   9           HG2      ARG   9   3.902   6.945   3.142
   64    HG3  ARG   9           HG3      ARG   9   2.268   6.643   3.732
   65    HD2  ARG   9           HD2      ARG   9   2.913   4.251   4.130
   66    HD3  ARG   9           HD3      ARG   9   4.568   4.660   3.664
   67    HE   ARG   9           HE       ARG   9   3.788   6.413   5.706
   68   HH11  ARG   9          HH11      ARG   9   4.425   2.981   5.330
   69   HH12  ARG   9          HH12      ARG   9   4.916   2.761   6.977
   70   HH21  ARG   9          HH21      ARG   9   4.459   6.138   7.854
   71   HH22  ARG   9          HH22      ARG   9   4.936   4.565   8.419
   72    H    LEU  10           H        LEU  10  -0.041   5.592   0.085
   73    HA   LEU  10           HA       LEU  10   0.986   4.421  -2.280
   74    HB2  LEU  10           HB2      LEU  10  -1.890   4.958  -1.445
   75    HB3  LEU  10           HB3      LEU  10  -1.437   3.980  -2.830
   76    HG   LEU  10           HG       LEU  10  -0.812   3.341   0.077
   77   HD11  LEU  10          HD11      LEU  10  -2.722   1.968  -1.825
   78   HD12  LEU  10          HD12      LEU  10  -3.168   2.992  -0.460
   79   HD13  LEU  10          HD13      LEU  10  -2.345   1.461  -0.176
   80   HD21  LEU  10          HD21      LEU  10   1.009   2.566  -1.341
   81   HD22  LEU  10          HD22      LEU  10  -0.133   1.751  -2.413
   82   HD23  LEU  10          HD23      LEU  10   0.073   1.196  -0.748
   83    H    LYS  11           H        LYS  11  -0.764   7.445  -1.674
   84    HA   LYS  11           HA       LYS  11  -0.869   8.252  -4.460
   85    HB2  LYS  11           HB2      LYS  11  -1.336   9.861  -1.917
   86    HB3  LYS  11           HB3      LYS  11  -1.731  10.397  -3.549
   87    HG2  LYS  11           HG2      LYS  11  -3.405   8.613  -3.767
   88    HG3  LYS  11           HG3      LYS  11  -2.975   7.980  -2.175
   89    HD2  LYS  11           HD2      LYS  11  -4.177  10.731  -2.721
   90    HD3  LYS  11           HD3      LYS  11  -5.062   9.332  -2.107
   91    HE2  LYS  11           HE2      LYS  11  -3.645   9.331  -0.077
   92    HE3  LYS  11           HE3      LYS  11  -2.753  10.721  -0.695
   93    HZ1  LYS  11           HZ1      LYS  11  -4.421  11.382   0.912
   94    HZ2  LYS  11           HZ2      LYS  11  -5.642  10.683  -0.019
   95    HZ3  LYS  11           HZ3      LYS  11  -4.796  12.015  -0.613
   96    H    LYS  12           H        LYS  12   1.171   8.922  -1.668
   97    HA   LYS  12           HA       LYS  12   2.718  11.086  -2.613
   98    HB2  LYS  12           HB2      LYS  12   2.641  10.575  -0.244
   99    HB3  LYS  12           HB3      LYS  12   3.199   8.936  -0.513
  100    HG2  LYS  12           HG2      LYS  12   4.954  10.248   0.515
  101    HG3  LYS  12           HG3      LYS  12   5.436   9.781  -1.118
  102    HD2  LYS  12           HD2      LYS  12   4.815  12.057  -1.929
  103    HD3  LYS  12           HD3      LYS  12   4.372  12.512  -0.280
  104    HE2  LYS  12           HE2      LYS  12   6.700  12.158   0.446
  105    HE3  LYS  12           HE3      LYS  12   7.141  11.664  -1.190
  106    HZ1  LYS  12           HZ1      LYS  12   6.182  14.339  -0.346
  107    HZ2  LYS  12           HZ2      LYS  12   6.460  13.885  -1.948
  108    HZ3  LYS  12           HZ3      LYS  12   7.745  13.935  -0.854
  109    H    LEU  13           H        LEU  13   3.169   7.624  -2.757
  110    HA   LEU  13           HA       LEU  13   5.762   7.756  -4.048
  111    HB2  LEU  13           HB2      LEU  13   3.979   5.436  -3.215
  112    HB3  LEU  13           HB3      LEU  13   5.586   5.251  -3.895
  113    HG   LEU  13           HG       LEU  13   4.976   6.647  -1.254
  114   HD11  LEU  13          HD11      LEU  13   4.526   4.269  -1.055
  115   HD12  LEU  13          HD12      LEU  13   5.981   4.692  -0.156
  116   HD13  LEU  13          HD13      LEU  13   6.115   3.879  -1.717
  117   HD21  LEU  13          HD21      LEU  13   6.980   7.565  -2.281
  118   HD22  LEU  13          HD22      LEU  13   7.645   5.945  -2.516
  119   HD23  LEU  13          HD23      LEU  13   7.417   6.582  -0.885
  120    H    GLY  14           H        GLY  14   2.393   7.358  -4.895
  121    HA2  GLY  14           HA2      GLY  14   1.286   7.332  -6.889
  122    HA3  GLY  14           HA3      GLY  14   2.687   8.175  -7.523
  123    H    MET  15           H        MET  15   2.504   4.877  -6.277
  124    HA   MET  15           HA       MET  15   4.091   3.788  -8.396
  125    HB2  MET  15           HB2      MET  15   3.879   1.674  -7.175
  126    HB3  MET  15           HB3      MET  15   4.169   2.976  -6.032
  127    HG2  MET  15           HG2      MET  15   1.720   3.030  -5.539
  128    HG3  MET  15           HG3      MET  15   1.518   1.640  -6.604
  129    HE1  MET  15           HE1      MET  15   4.278   2.546  -3.858
  130    HE2  MET  15           HE2      MET  15   3.634   1.589  -2.524
  131    HE3  MET  15           HE3      MET  15   2.708   2.950  -3.151
  132    H    SER  16           H        SER  16   3.039   1.301  -8.925
  133    HA   SER  16           HA       SER  16   1.312   1.698 -11.117
  134    HB2  SER  16           HB2      SER  16   1.911  -0.870  -9.571
  135    HB3  SER  16           HB3      SER  16   1.285  -0.776 -11.221
  136    HG   SER  16           HG       SER  16   3.719  -0.995 -10.680
  137    H    GLU  17           H        GLU  17  -0.950   1.621 -11.282
  138    HA   GLU  17           HA       GLU  17  -2.452   2.281  -9.033
  139    HB2  GLU  17           HB2      GLU  17  -3.249   1.480 -11.817
  140    HB3  GLU  17           HB3      GLU  17  -4.495   1.702 -10.589
  141    HG2  GLU  17           HG2      GLU  17  -3.786   3.983 -10.193
  142    HG3  GLU  17           HG3      GLU  17  -2.442   3.803 -11.325
  143    H    GLU  18           H        GLU  18  -1.975  -0.880 -10.479
  144    HA   GLU  18           HA       GLU  18  -4.078  -2.237  -9.147
  145    HB2  GLU  18           HB2      GLU  18  -3.065  -3.254 -11.116
  146    HB3  GLU  18           HB3      GLU  18  -1.471  -3.251 -10.370
  147    HG2  GLU  18           HG2      GLU  18  -2.262  -4.922  -8.705
  148    HG3  GLU  18           HG3      GLU  18  -3.843  -4.939  -9.485
  149    H    CYS  19           H        CYS  19  -0.869  -1.257  -8.233
  150    HA   CYS  19           HA       CYS  19  -0.418  -3.094  -6.121
  151    HB2  CYS  19           HB2      CYS  19   0.838  -0.455  -6.914
  152    HB3  CYS  19           HB3      CYS  19   1.351  -1.308  -5.483
  153    H    ARG  20           H        ARG  20  -1.564   0.322  -6.244
  154    HA   ARG  20           HA       ARG  20  -1.784   0.572  -3.395
  155    HB2  ARG  20           HB2      ARG  20  -3.452   2.265  -5.292
  156    HB3  ARG  20           HB3      ARG  20  -2.846   2.678  -3.694
  157    HG2  ARG  20           HG2      ARG  20  -1.365   3.885  -4.964
  158    HG3  ARG  20           HG3      ARG  20  -0.474   2.377  -4.915
  159    HD2  ARG  20           HD2      ARG  20  -0.451   3.123  -7.154
  160    HD3  ARG  20           HD3      ARG  20  -1.624   1.791  -7.063
  161    HE   ARG  20           HE       ARG  20  -3.394   3.344  -7.190
  162   HH11  ARG  20          HH11      ARG  20  -0.250   4.790  -7.857
  163   HH12  ARG  20          HH12      ARG  20  -0.927   6.177  -8.645
  164   HH21  ARG  20          HH21      ARG  20  -4.260   5.215  -8.166
  165   HH22  ARG  20          HH22      ARG  20  -3.193   6.418  -8.818
  166    H    GLN  21           H        GLN  21  -4.021  -0.349  -5.960
  167    HA   GLN  21           HA       GLN  21  -6.411  -0.427  -4.468
  168    HB2  GLN  21           HB2      GLN  21  -5.599  -1.992  -6.955
  169    HB3  GLN  21           HB3      GLN  21  -7.249  -1.905  -6.333
  170    HG2  GLN  21           HG2      GLN  21  -7.408   0.438  -6.811
  171    HG3  GLN  21           HG3      GLN  21  -5.679   0.567  -7.123
  172   HE21  GLN  21          HE21      GLN  21  -7.702   1.460  -8.877
  173   HE22  GLN  21          HE22      GLN  21  -7.599   0.530 -10.329
  174    H    ARG  22           H        ARG  22  -3.782  -2.707  -4.885
  175    HA   ARG  22           HA       ARG  22  -5.026  -4.889  -3.465
  176    HB2  ARG  22           HB2      ARG  22  -2.211  -4.355  -4.462
  177    HB3  ARG  22           HB3      ARG  22  -2.568  -5.758  -3.460
  178    HG2  ARG  22           HG2      ARG  22  -4.120  -6.621  -5.130
  179    HG3  ARG  22           HG3      ARG  22  -3.922  -5.169  -6.118
  180    HD2  ARG  22           HD2      ARG  22  -1.610  -5.727  -6.579
  181    HD3  ARG  22           HD3      ARG  22  -1.650  -7.063  -5.424
  182    HE   ARG  22           HE       ARG  22  -3.570  -7.328  -7.557
  183   HH11  ARG  22          HH11      ARG  22  -0.217  -7.902  -6.674
  184   HH12  ARG  22          HH12      ARG  22   0.004  -9.180  -7.827
  185   HH21  ARG  22          HH21      ARG  22  -3.303  -9.028  -9.040
  186   HH22  ARG  22          HH22      ARG  22  -1.765  -9.821  -9.185
  187    H    LEU  23           H        LEU  23  -2.707  -2.307  -2.658
  188    HA   LEU  23           HA       LEU  23  -1.842  -3.532  -0.213
  189    HB2  LEU  23           HB2      LEU  23  -1.343  -0.766  -1.352
  190    HB3  LEU  23           HB3      LEU  23  -0.503  -1.455   0.018
  191    HG   LEU  23           HG       LEU  23  -0.421  -2.646  -2.772
  192   HD11  LEU  23          HD11      LEU  23   1.641  -0.872  -1.482
  193   HD12  LEU  23          HD12      LEU  23   0.611  -0.469  -2.856
  194   HD13  LEU  23          HD13      LEU  23   1.827  -1.733  -3.014
  195   HD21  LEU  23          HD21      LEU  23   0.044  -4.322  -1.106
  196   HD22  LEU  23          HD22      LEU  23   1.256  -3.285  -0.353
  197   HD23  LEU  23          HD23      LEU  23   1.521  -3.915  -1.977
  198    H    GLU  24           H        GLU  24  -4.098  -0.971  -1.064
  199    HA   GLU  24           HA       GLU  24  -4.754  -0.021   1.489
  200    HB2  GLU  24           HB2      GLU  24  -5.822   0.216  -1.217
  201    HB3  GLU  24           HB3      GLU  24  -7.163  -0.052  -0.120
  202    HG2  GLU  24           HG2      GLU  24  -5.091   2.131   0.257
  203    HG3  GLU  24           HG3      GLU  24  -6.608   2.360  -0.611
  204    H    LYS  25           H        LYS  25  -5.815  -2.852  -0.340
  205    HA   LYS  25           HA       LYS  25  -7.875  -3.660   1.527
  206    HB2  LYS  25           HB2      LYS  25  -8.006  -4.195  -0.912
  207    HB3  LYS  25           HB3      LYS  25  -6.601  -5.242  -0.751
  208    HG2  LYS  25           HG2      LYS  25  -7.894  -6.688   0.827
  209    HG3  LYS  25           HG3      LYS  25  -9.301  -5.651   0.598
  210    HD2  LYS  25           HD2      LYS  25  -7.943  -7.223  -1.629
  211    HD3  LYS  25           HD3      LYS  25  -9.345  -7.793  -0.727
  212    HE2  LYS  25           HE2      LYS  25 -10.196  -6.918  -2.769
  213    HE3  LYS  25           HE3      LYS  25 -10.573  -5.709  -1.548
  214    HZ1  LYS  25           HZ1      LYS  25  -8.266  -5.561  -3.420
  215    HZ2  LYS  25           HZ2      LYS  25  -8.758  -4.364  -2.331
  216    HZ3  LYS  25           HZ3      LYS  25  -9.741  -4.768  -3.640
  217    H    MET  26           H        MET  26  -4.562  -4.665   0.767
  218    HA   MET  26           HA       MET  26  -4.370  -6.946   2.394
  219    HB2  MET  26           HB2      MET  26  -2.216  -5.058   1.362
  220    HB3  MET  26           HB3      MET  26  -1.859  -6.554   2.215
  221    HG2  MET  26           HG2      MET  26  -2.954  -7.839   0.429
  222    HG3  MET  26           HG3      MET  26  -3.325  -6.338  -0.421
  223    HE1  MET  26           HE1      MET  26   0.016  -7.199   1.564
  224    HE2  MET  26           HE2      MET  26   0.982  -7.872   0.253
  225    HE3  MET  26           HE3      MET  26  -0.448  -8.732   0.821
  226    H    CYS  27           H        CYS  27  -3.879  -3.537   3.030
  227    HA   CYS  27           HA       CYS  27  -2.726  -3.733   5.594
  228    HB2  CYS  27           HB2      CYS  27  -2.663  -1.645   4.366
  229    HB3  CYS  27           HB3      CYS  27  -4.421  -1.561   4.322
  230    H    LYS  28           H        LYS  28  -6.095  -3.778   4.489
  231    HA   LYS  28           HA       LYS  28  -7.217  -3.442   7.136
  232    HB2  LYS  28           HB2      LYS  28  -8.631  -4.175   4.536
  233    HB3  LYS  28           HB3      LYS  28  -9.394  -3.591   6.016
  234    HG2  LYS  28           HG2      LYS  28  -8.186  -1.432   5.762
  235    HG3  LYS  28           HG3      LYS  28  -7.479  -2.030   4.259
  236    HD2  LYS  28           HD2      LYS  28  -9.961  -2.368   3.496
  237    HD3  LYS  28           HD3      LYS  28 -10.359  -1.296   4.842
  238    HE2  LYS  28           HE2      LYS  28  -8.605  -0.659   2.446
  239    HE3  LYS  28           HE3      LYS  28 -10.196   0.008   2.804
  240    HZ1  LYS  28           HZ1      LYS  28  -7.720   0.458   4.375
  241    HZ2  LYS  28           HZ2      LYS  28  -9.241   1.085   4.760
  242    HZ3  LYS  28           HZ3      LYS  28  -8.458   1.569   3.340
  243    H    GLU  29           H        GLU  29  -7.449  -6.102   4.705
  244    HA   GLU  29           HA       GLU  29  -8.522  -7.930   6.672
  245    HB2  GLU  29           HB2      GLU  29  -8.619  -9.565   4.784
  246    HB3  GLU  29           HB3      GLU  29  -9.438  -8.052   4.459
  247    HG2  GLU  29           HG2      GLU  29  -8.401  -8.515   2.429
  248    HG3  GLU  29           HG3      GLU  29  -7.298  -7.368   3.180
  249    H    GLY  30           H        GLY  30  -5.379  -7.119   5.547
  250    HA2  GLY  30           HA2      GLY  30  -4.173  -9.409   7.016
  251    HA3  GLY  30           HA3      GLY  30  -3.371  -8.451   5.778
  252    H    THR  31           H        THR  31  -1.946  -6.989   6.539
  253    HA   THR  31           HA       THR  31  -2.458  -5.514   9.036
  254    HB   THR  31           HB       THR  31  -0.049  -5.785   9.745
  255    HG1  THR  31           HG1      THR  31   0.022  -7.896   7.834
  256   HG21  THR  31          HG21      THR  31  -1.522  -8.439   9.599
  257   HG22  THR  31          HG22      THR  31  -1.766  -7.205  10.836
  258   HG23  THR  31          HG23      THR  31  -0.214  -8.039  10.715
  259    H    SER  32           H        SER  32  -1.362  -3.491   9.132
  260    HA   SER  32           HA       SER  32  -1.090  -2.094   6.688
  261    HB2  SER  32           HB2      SER  32  -0.077  -1.229   9.436
  262    HB3  SER  32           HB3      SER  32  -0.457  -0.173   8.069
  263    HG   SER  32           HG       SER  32  -2.623  -1.539   8.431
  264    H    GLU  33           H        GLU  33   1.307  -3.260   9.036
  265    HA   GLU  33           HA       GLU  33   3.620  -2.135   7.936
  266    HB2  GLU  33           HB2      GLU  33   4.850  -3.801   9.322
  267    HB3  GLU  33           HB3      GLU  33   3.590  -2.952  10.214
  268    HG2  GLU  33           HG2      GLU  33   2.107  -4.894  10.031
  269    HG3  GLU  33           HG3      GLU  33   3.309  -5.748   9.067
  270    H    ASP  34           H        ASP  34   2.001  -5.194   7.187
  271    HA   ASP  34           HA       ASP  34   4.088  -6.294   5.554
  272    HB2  ASP  34           HB2      ASP  34   2.412  -7.705   6.681
  273    HB3  ASP  34           HB3      ASP  34   1.125  -6.975   5.739
  274    H    ALA  35           H        ALA  35   1.048  -4.545   4.887
  275    HA   ALA  35           HA       ALA  35   1.134  -4.742   2.069
  276    HB1  ALA  35           HB1      ALA  35  -0.248  -2.668   3.791
  277    HB2  ALA  35           HB2      ALA  35  -0.911  -4.231   3.310
  278    HB3  ALA  35           HB3      ALA  35  -0.592  -2.997   2.090
  279    H    GLU  36           H        GLU  36   2.200  -2.095   4.249
  280    HA   GLU  36           HA       GLU  36   3.172  -0.378   2.216
  281    HB2  GLU  36           HB2      GLU  36   4.302   0.870   3.985
  282    HB3  GLU  36           HB3      GLU  36   2.672   0.432   4.492
  283    HG2  GLU  36           HG2      GLU  36   3.642  -1.475   5.788
  284    HG3  GLU  36           HG3      GLU  36   5.253  -0.895   5.362
  285    H    ARG  37           H        ARG  37   4.622  -3.136   3.856
  286    HA   ARG  37           HA       ARG  37   7.300  -2.774   2.943
  287    HB2  ARG  37           HB2      ARG  37   6.233  -4.420   4.771
  288    HB3  ARG  37           HB3      ARG  37   6.152  -5.536   3.420
  289    HG2  ARG  37           HG2      ARG  37   8.667  -4.226   4.517
  290    HG3  ARG  37           HG3      ARG  37   8.159  -5.890   4.796
  291    HD2  ARG  37           HD2      ARG  37   8.464  -6.403   2.415
  292    HD3  ARG  37           HD3      ARG  37   8.889  -4.722   2.081
  293    HE   ARG  37           HE       ARG  37  10.507  -6.647   3.644
  294   HH11  ARG  37          HH11      ARG  37  10.327  -3.679   1.750
  295   HH12  ARG  37          HH12      ARG  37  12.046  -3.458   1.713
  296   HH21  ARG  37          HH21      ARG  37  12.751  -6.362   3.559
  297   HH22  ARG  37          HH22      ARG  37  13.428  -4.983   2.747
  298    H    MET  38           H        MET  38   4.486  -4.549   1.688
  299    HA   MET  38           HA       MET  38   5.767  -5.583  -0.643
  300    HB2  MET  38           HB2      MET  38   2.810  -5.245  -0.032
  301    HB3  MET  38           HB3      MET  38   3.467  -6.186  -1.365
  302    HG2  MET  38           HG2      MET  38   3.996  -6.789   1.556
  303    HG3  MET  38           HG3      MET  38   2.731  -7.544   0.604
  304    HE1  MET  38           HE1      MET  38   6.306  -7.786   1.852
  305    HE2  MET  38           HE2      MET  38   6.761  -6.948   0.368
  306    HE3  MET  38           HE3      MET  38   7.188  -8.645   0.591
  307    H    ALA  39           H        ALA  39   4.349  -2.522   0.129
  308    HA   ALA  39           HA       ALA  39   3.944  -1.421  -2.441
  309    HB1  ALA  39           HB1      ALA  39   4.796  -0.065   0.142
  310    HB2  ALA  39           HB2      ALA  39   3.137  -0.369  -0.371
  311    HB3  ALA  39           HB3      ALA  39   4.150   0.753  -1.279
  312    H    ARG  40           H        ARG  40   6.750  -1.629  -0.336
  313    HA   ARG  40           HA       ARG  40   8.636  -0.199  -1.885
  314    HB2  ARG  40           HB2      ARG  40   9.188  -2.455   0.083
  315    HB3  ARG  40           HB3      ARG  40  10.281  -1.143  -0.357
  316    HG2  ARG  40           HG2      ARG  40   7.695  -0.215   0.783
  317    HG3  ARG  40           HG3      ARG  40   8.637  -1.208   1.890
  318    HD2  ARG  40           HD2      ARG  40   9.063   1.195   2.174
  319    HD3  ARG  40           HD3      ARG  40  10.510   0.298   1.726
  320    HE   ARG  40           HE       ARG  40   9.088   1.609  -0.458
  321   HH11  ARG  40          HH11      ARG  40  11.718   1.845   1.871
  322   HH12  ARG  40          HH12      ARG  40  12.565   3.066   0.977
  323   HH21  ARG  40          HH21      ARG  40  10.227   3.209  -1.625
  324   HH22  ARG  40          HH22      ARG  40  11.716   3.838  -1.006
  325    H    ASN  41           H        ASN  41   7.534  -3.519  -1.872
  326    HA   ASN  41           HA       ASN  41   9.560  -4.561  -3.669
  327    HB2  ASN  41           HB2      ASN  41   7.033  -5.729  -2.438
  328    HB3  ASN  41           HB3      ASN  41   7.963  -6.612  -3.646
  329   HD21  ASN  41          HD21      ASN  41   8.110  -5.195  -0.424
  330   HD22  ASN  41          HD22      ASN  41   9.397  -6.189   0.150
  331    H    CYS  42           H        CYS  42   6.324  -3.222  -3.961
  332    HA   CYS  42           HA       CYS  42   5.715  -4.071  -6.607
  333    HB2  CYS  42           HB2      CYS  42   3.866  -3.175  -5.374
  334    HB3  CYS  42           HB3      CYS  42   4.757  -1.727  -4.918
  335    H    GLU  43           H        GLU  43   7.012  -1.002  -5.368
  336    HA   GLU  43           HA       GLU  43   8.854  -0.433  -7.380
  337    HB2  GLU  43           HB2      GLU  43   6.787  -0.292  -8.823
  338    HB3  GLU  43           HB3      GLU  43   6.157   0.969  -7.768
  339    HG2  GLU  43           HG2      GLU  43   7.994   2.462  -8.408
  340    HG3  GLU  43           HG3      GLU  43   8.712   1.184  -9.391
  341    H    SER  44           H        SER  44   6.398   0.793  -5.197
  342    HA   SER  44           HA       SER  44   6.249   2.404  -3.647
  343    HB2  SER  44           HB2      SER  44   8.220   1.174  -2.673
  344    HB3  SER  44           HB3      SER  44   9.296   2.269  -3.533
  345    HG   SER  44           HG       SER  44   8.065   3.968  -2.337
  Start of MODEL    9
    1    H1   ALA   1           H1       ALA   1  -3.631   6.019  13.845
    2    H2   ALA   1           H2       ALA   1  -5.282   5.829  14.134
    3    H3   ALA   1           H3       ALA   1  -4.628   7.380  13.945
    4    HA   ALA   1           HA       ALA   1  -5.811   6.695  11.970
    5    HB1  ALA   1           HB1      ALA   1  -4.005   7.160  10.348
    6    HB2  ALA   1           HB2      ALA   1  -2.801   6.857  11.607
    7    HB3  ALA   1           HB3      ALA   1  -3.908   8.220  11.756
    8    HA   PRO   2           HA       PRO   2  -5.569   2.202  11.762
    9    HB2  PRO   2           HB2      PRO   2  -7.457   1.777   9.775
   10    HB3  PRO   2           HB3      PRO   2  -7.857   2.151  11.465
   11    HG2  PRO   2           HG2      PRO   2  -7.790   3.991   9.097
   12    HG3  PRO   2           HG3      PRO   2  -8.975   3.906  10.419
   13    HD2  PRO   2           HD2      PRO   2  -7.017   5.789  10.350
   14    HD3  PRO   2           HD3      PRO   2  -7.635   5.131  11.880
   15    H    CYS   3           H        CYS   3  -5.623   3.894   8.579
   16    HA   CYS   3           HA       CYS   3  -3.217   2.460   7.720
   17    HB2  CYS   3           HB2      CYS   3  -5.160   0.991   7.098
   18    HB3  CYS   3           HB3      CYS   3  -5.798   2.297   6.109
   19    H    GLU   4           H        GLU   4  -4.248   5.276   8.246
   20    HA   GLU   4           HA       GLU   4  -4.797   6.516   5.734
   21    HB2  GLU   4           HB2      GLU   4  -4.087   7.871   8.367
   22    HB3  GLU   4           HB3      GLU   4  -4.902   8.609   6.987
   23    HG2  GLU   4           HG2      GLU   4  -5.980   6.464   8.842
   24    HG3  GLU   4           HG3      GLU   4  -6.568   8.115   8.659
   25    H    ASP   5           H        ASP   5  -1.938   6.439   7.836
   26    HA   ASP   5           HA       ASP   5  -0.206   8.107   6.400
   27    HB2  ASP   5           HB2      ASP   5   0.494   5.600   7.995
   28    HB3  ASP   5           HB3      ASP   5   1.639   6.856   7.519
   29    H    LEU   6           H        LEU   6  -0.883   4.644   6.106
   30    HA   LEU   6           HA       LEU   6   1.079   4.012   4.155
   31    HB2  LEU   6           HB2      LEU   6   0.051   2.405   5.735
   32    HB3  LEU   6           HB3      LEU   6  -1.484   2.570   4.914
   33    HG   LEU   6           HG       LEU   6   0.881   1.572   3.299
   34   HD11  LEU   6          HD11      LEU   6  -0.697  -0.172   5.205
   35   HD12  LEU   6          HD12      LEU   6   1.004   0.272   5.366
   36   HD13  LEU   6          HD13      LEU   6   0.484  -0.727   4.013
   37   HD21  LEU   6          HD21      LEU   6  -0.850   0.222   2.151
   38   HD22  LEU   6          HD22      LEU   6  -1.268   1.934   2.132
   39   HD23  LEU   6          HD23      LEU   6  -2.079   0.847   3.260
   40    H    LYS   7           H        LYS   7  -2.326   4.885   4.016
   41    HA   LYS   7           HA       LYS   7  -2.881   4.502   1.291
   42    HB2  LYS   7           HB2      LYS   7  -4.599   4.810   3.010
   43    HB3  LYS   7           HB3      LYS   7  -4.037   6.449   3.323
   44    HG2  LYS   7           HG2      LYS   7  -4.727   7.044   0.949
   45    HG3  LYS   7           HG3      LYS   7  -5.446   5.431   0.826
   46    HD2  LYS   7           HD2      LYS   7  -6.222   7.605   2.820
   47    HD3  LYS   7           HD3      LYS   7  -7.165   7.090   1.421
   48    HE2  LYS   7           HE2      LYS   7  -7.555   4.910   2.418
   49    HE3  LYS   7           HE3      LYS   7  -6.454   5.267   3.747
   50    HZ1  LYS   7           HZ1      LYS   7  -7.965   7.018   4.463
   51    HZ2  LYS   7           HZ2      LYS   7  -8.705   5.507   4.449
   52    HZ3  LYS   7           HZ3      LYS   7  -9.046   6.618   3.223
   53    H    GLU   8           H        GLU   8  -1.662   7.324   3.076
   54    HA   GLU   8           HA       GLU   8  -1.543   9.121   0.904
   55    HB2  GLU   8           HB2      GLU   8   0.085   9.041   3.463
   56    HB3  GLU   8           HB3      GLU   8   0.051  10.402   2.344
   57    HG2  GLU   8           HG2      GLU   8  -2.322   9.322   3.887
   58    HG3  GLU   8           HG3      GLU   8  -1.393  10.755   4.316
   59    H    ARG   9           H        ARG   9   0.795   6.748   2.163
   60    HA   ARG   9           HA       ARG   9   3.001   7.370   0.519
   61    HB2  ARG   9           HB2      ARG   9   2.123   4.644   1.560
   62    HB3  ARG   9           HB3      ARG   9   3.712   4.994   0.880
   63    HG2  ARG   9           HG2      ARG   9   4.223   6.490   2.737
   64    HG3  ARG   9           HG3      ARG   9   2.593   6.294   3.390
   65    HD2  ARG   9           HD2      ARG   9   3.041   3.874   3.734
   66    HD3  ARG   9           HD3      ARG   9   4.681   4.102   3.117
   67    HE   ARG   9           HE       ARG   9   4.248   5.880   5.246
   68   HH11  ARG   9          HH11      ARG   9   4.745   2.432   4.698
   69   HH12  ARG   9          HH12      ARG   9   5.395   2.150   6.281
   70   HH21  ARG   9          HH21      ARG   9   5.046   5.479   7.344
   71   HH22  ARG   9          HH22      ARG   9   5.568   3.882   7.785
   72    H    LEU  10           H        LEU  10   0.128   5.370  -0.051
   73    HA   LEU  10           HA       LEU  10   0.921   4.117  -2.453
   74    HB2  LEU  10           HB2      LEU  10  -1.925   4.795  -1.611
   75    HB3  LEU  10           HB3      LEU  10  -1.447   3.575  -2.777
   76    HG   LEU  10           HG       LEU  10  -1.129   3.498   0.237
   77   HD11  LEU  10          HD11      LEU  10  -2.463   1.467   0.106
   78   HD12  LEU  10          HD12      LEU  10  -2.562   1.615  -1.651
   79   HD13  LEU  10          HD13      LEU  10  -3.317   2.829  -0.615
   80   HD21  LEU  10          HD21      LEU  10   0.961   2.649  -0.647
   81   HD22  LEU  10          HD22      LEU  10   0.103   1.563  -1.743
   82   HD23  LEU  10          HD23      LEU  10   0.008   1.322   0.005
   83    H    LYS  11           H        LYS  11  -0.877   7.119  -1.834
   84    HA   LYS  11           HA       LYS  11  -1.432   7.666  -4.619
   85    HB2  LYS  11           HB2      LYS  11  -1.820   9.410  -2.162
   86    HB3  LYS  11           HB3      LYS  11  -2.546   9.675  -3.747
   87    HG2  LYS  11           HG2      LYS  11  -3.857   7.606  -3.517
   88    HG3  LYS  11           HG3      LYS  11  -3.077   7.269  -1.968
   89    HD2  LYS  11           HD2      LYS  11  -5.283   8.212  -1.559
   90    HD3  LYS  11           HD3      LYS  11  -4.056   9.366  -1.041
   91    HE2  LYS  11           HE2      LYS  11  -4.396  10.677  -3.088
   92    HE3  LYS  11           HE3      LYS  11  -5.553   9.484  -3.682
   93    HZ1  LYS  11           HZ1      LYS  11  -5.899  11.093  -1.208
   94    HZ2  LYS  11           HZ2      LYS  11  -7.020  10.014  -1.868
   95    HZ3  LYS  11           HZ3      LYS  11  -6.627  11.433  -2.697
   96    H    LYS  12           H        LYS  12   0.646   9.115  -2.121
   97    HA   LYS  12           HA       LYS  12   1.405  11.415  -3.618
   98    HB2  LYS  12           HB2      LYS  12   1.324  10.882  -0.984
   99    HB3  LYS  12           HB3      LYS  12   3.003  10.443  -1.231
  100    HG2  LYS  12           HG2      LYS  12   1.783  13.156  -1.826
  101    HG3  LYS  12           HG3      LYS  12   2.665  12.740  -0.353
  102    HD2  LYS  12           HD2      LYS  12   4.707  12.331  -1.706
  103    HD3  LYS  12           HD3      LYS  12   3.820  12.749  -3.175
  104    HE2  LYS  12           HE2      LYS  12   3.427  15.026  -2.205
  105    HE3  LYS  12           HE3      LYS  12   4.468  14.586  -0.847
  106    HZ1  LYS  12           HZ1      LYS  12   6.291  14.275  -2.379
  107    HZ2  LYS  12           HZ2      LYS  12   5.642  15.825  -2.573
  108    HZ3  LYS  12           HZ3      LYS  12   5.292  14.617  -3.700
  109    H    LEU  13           H        LEU  13   2.953   8.299  -2.956
  110    HA   LEU  13           HA       LEU  13   5.482   8.928  -4.173
  111    HB2  LEU  13           HB2      LEU  13   4.514   6.923  -2.474
  112    HB3  LEU  13           HB3      LEU  13   4.814   6.044  -3.954
  113    HG   LEU  13           HG       LEU  13   6.938   7.772  -2.638
  114   HD11  LEU  13          HD11      LEU  13   6.437   4.825  -2.157
  115   HD12  LEU  13          HD12      LEU  13   6.254   6.130  -0.982
  116   HD13  LEU  13          HD13      LEU  13   7.854   5.729  -1.609
  117   HD21  LEU  13          HD21      LEU  13   7.140   5.506  -4.647
  118   HD22  LEU  13          HD22      LEU  13   8.503   6.373  -3.932
  119   HD23  LEU  13          HD23      LEU  13   7.371   7.226  -4.979
  120    H    GLY  14           H        GLY  14   2.411   7.887  -5.339
  121    HA2  GLY  14           HA2      GLY  14   1.579   7.571  -7.425
  122    HA3  GLY  14           HA3      GLY  14   3.040   8.328  -8.045
  123    H    MET  15           H        MET  15   2.401   5.274  -6.318
  124    HA   MET  15           HA       MET  15   4.144   3.720  -8.009
  125    HB2  MET  15           HB2      MET  15   3.433   1.805  -6.663
  126    HB3  MET  15           HB3      MET  15   3.799   3.172  -5.619
  127    HG2  MET  15           HG2      MET  15   1.383   3.632  -5.393
  128    HG3  MET  15           HG3      MET  15   1.035   2.258  -6.433
  129    HE1  MET  15           HE1      MET  15   2.919   1.803  -2.236
  130    HE2  MET  15           HE2      MET  15   2.520   3.375  -2.933
  131    HE3  MET  15           HE3      MET  15   3.846   2.419  -3.598
  132    H    SER  16           H        SER  16   3.082   1.442  -8.748
  133    HA   SER  16           HA       SER  16   1.455   1.957 -10.998
  134    HB2  SER  16           HB2      SER  16   2.031  -0.691  -9.592
  135    HB3  SER  16           HB3      SER  16   1.351  -0.530 -11.213
  136    HG   SER  16           HG       SER  16   3.682  -0.893 -11.064
  137    H    GLU  17           H        GLU  17  -0.783   1.680 -11.355
  138    HA   GLU  17           HA       GLU  17  -2.430   2.294  -9.140
  139    HB2  GLU  17           HB2      GLU  17  -2.900   2.956 -11.526
  140    HB3  GLU  17           HB3      GLU  17  -3.417   1.299 -11.831
  141    HG2  GLU  17           HG2      GLU  17  -5.199   1.510 -10.148
  142    HG3  GLU  17           HG3      GLU  17  -4.671   3.145  -9.749
  143    H    GLU  18           H        GLU  18  -1.562  -0.691 -10.620
  144    HA   GLU  18           HA       GLU  18  -3.619  -2.381  -9.640
  145    HB2  GLU  18           HB2      GLU  18  -2.221  -3.026 -11.550
  146    HB3  GLU  18           HB3      GLU  18  -0.765  -2.924 -10.566
  147    HG2  GLU  18           HG2      GLU  18  -1.552  -4.864  -9.224
  148    HG3  GLU  18           HG3      GLU  18  -2.988  -4.972 -10.244
  149    H    CYS  19           H        CYS  19  -0.704  -1.033  -8.276
  150    HA   CYS  19           HA       CYS  19  -0.223  -3.029  -6.286
  151    HB2  CYS  19           HB2      CYS  19   0.810  -0.185  -6.649
  152    HB3  CYS  19           HB3      CYS  19   1.374  -1.266  -5.401
  153    H    ARG  20           H        ARG  20  -1.667   0.289  -6.267
  154    HA   ARG  20           HA       ARG  20  -2.056   0.386  -3.444
  155    HB2  ARG  20           HB2      ARG  20  -3.932   1.873  -5.315
  156    HB3  ARG  20           HB3      ARG  20  -3.432   2.311  -3.684
  157    HG2  ARG  20           HG2      ARG  20  -2.140   3.772  -4.882
  158    HG3  ARG  20           HG3      ARG  20  -1.024   2.422  -4.820
  159    HD2  ARG  20           HD2      ARG  20  -1.024   3.211  -7.047
  160    HD3  ARG  20           HD3      ARG  20  -1.971   1.709  -7.030
  161    HE   ARG  20           HE       ARG  20  -3.976   2.992  -7.187
  162   HH11  ARG  20          HH11      ARG  20  -1.035   4.860  -7.811
  163   HH12  ARG  20          HH12      ARG  20  -1.868   6.113  -8.669
  164   HH21  ARG  20          HH21      ARG  20  -5.055   4.706  -8.277
  165   HH22  ARG  20          HH22      ARG  20  -4.133   6.024  -8.931
  166    H    GLN  21           H        GLN  21  -4.050  -0.879  -6.043
  167    HA   GLN  21           HA       GLN  21  -6.462  -1.282  -4.671
  168    HB2  GLN  21           HB2      GLN  21  -5.288  -2.864  -7.002
  169    HB3  GLN  21           HB3      GLN  21  -6.971  -2.944  -6.472
  170    HG2  GLN  21           HG2      GLN  21  -7.284  -0.588  -7.036
  171    HG3  GLN  21           HG3      GLN  21  -5.588  -0.455  -7.500
  172   HE21  GLN  21          HE21      GLN  21  -6.073   0.181  -9.594
  173   HE22  GLN  21          HE22      GLN  21  -6.769  -0.882 -10.766
  174    H    ARG  22           H        ARG  22  -3.547  -3.212  -4.971
  175    HA   ARG  22           HA       ARG  22  -4.493  -5.533  -3.532
  176    HB2  ARG  22           HB2      ARG  22  -1.722  -4.586  -4.378
  177    HB3  ARG  22           HB3      ARG  22  -1.986  -6.102  -3.540
  178    HG2  ARG  22           HG2      ARG  22  -3.382  -6.899  -5.423
  179    HG3  ARG  22           HG3      ARG  22  -3.107  -5.368  -6.263
  180    HD2  ARG  22           HD2      ARG  22  -0.703  -5.835  -6.387
  181    HD3  ARG  22           HD3      ARG  22  -0.913  -7.326  -5.465
  182    HE   ARG  22           HE       ARG  22  -2.531  -7.735  -7.579
  183   HH11  ARG  22          HH11      ARG  22   0.856  -6.698  -7.432
  184   HH12  ARG  22          HH12      ARG  22   1.257  -7.415  -8.961
  185   HH21  ARG  22          HH21      ARG  22  -1.988  -8.663  -9.558
  186   HH22  ARG  22          HH22      ARG  22  -0.370  -8.532 -10.174
  187    H    LEU  23           H        LEU  23  -2.628  -2.586  -2.761
  188    HA   LEU  23           HA       LEU  23  -1.530  -3.631  -0.318
  189    HB2  LEU  23           HB2      LEU  23  -1.499  -0.805  -1.418
  190    HB3  LEU  23           HB3      LEU  23  -0.484  -1.413  -0.122
  191    HG   LEU  23           HG       LEU  23  -0.425  -2.376  -2.986
  192   HD11  LEU  23          HD11      LEU  23   0.475  -0.168  -2.867
  193   HD12  LEU  23          HD12      LEU  23   1.750  -1.344  -3.178
  194   HD13  LEU  23          HD13      LEU  23   1.564  -0.650  -1.565
  195   HD21  LEU  23          HD21      LEU  23   1.358  -3.196  -0.696
  196   HD22  LEU  23          HD22      LEU  23   1.547  -3.659  -2.391
  197   HD23  LEU  23          HD23      LEU  23   0.129  -4.189  -1.495
  198    H    GLU  24           H        GLU  24  -3.914  -1.100  -1.092
  199    HA   GLU  24           HA       GLU  24  -4.598  -0.354   1.502
  200    HB2  GLU  24           HB2      GLU  24  -5.573   0.205  -1.149
  201    HB3  GLU  24           HB3      GLU  24  -6.973  -0.272  -0.208
  202    HG2  GLU  24           HG2      GLU  24  -5.041   1.894   0.666
  203    HG3  GLU  24           HG3      GLU  24  -6.467   2.213  -0.319
  204    H    LYS  25           H        LYS  25  -5.638  -3.060  -0.506
  205    HA   LYS  25           HA       LYS  25  -7.809  -3.934   1.117
  206    HB2  LYS  25           HB2      LYS  25  -7.663  -4.467  -1.280
  207    HB3  LYS  25           HB3      LYS  25  -6.185  -5.382  -1.009
  208    HG2  LYS  25           HG2      LYS  25  -7.392  -7.050   0.280
  209    HG3  LYS  25           HG3      LYS  25  -8.887  -6.110   0.160
  210    HD2  LYS  25           HD2      LYS  25  -8.912  -6.439  -2.292
  211    HD3  LYS  25           HD3      LYS  25  -7.383  -7.327  -2.203
  212    HE2  LYS  25           HE2      LYS  25  -8.469  -9.037  -0.811
  213    HE3  LYS  25           HE3      LYS  25  -9.991  -8.154  -0.900
  214    HZ1  LYS  25           HZ1      LYS  25  -8.552  -9.322  -3.217
  215    HZ2  LYS  25           HZ2      LYS  25 -10.042  -8.526  -3.263
  216    HZ3  LYS  25           HZ3      LYS  25  -9.901 -10.000  -2.454
  217    H    MET  26           H        MET  26  -4.400  -4.898   0.839
  218    HA   MET  26           HA       MET  26  -4.479  -7.000   2.757
  219    HB2  MET  26           HB2      MET  26  -2.169  -5.342   1.682
  220    HB3  MET  26           HB3      MET  26  -1.961  -6.735   2.733
  221    HG2  MET  26           HG2      MET  26  -3.267  -6.854   0.005
  222    HG3  MET  26           HG3      MET  26  -1.571  -7.189   0.307
  223    HE1  MET  26           HE1      MET  26  -5.113 -10.018   1.152
  224    HE2  MET  26           HE2      MET  26  -5.108  -8.632   0.061
  225    HE3  MET  26           HE3      MET  26  -5.172  -8.382   1.807
  226    H    CYS  27           H        CYS  27  -4.050  -3.556   2.941
  227    HA   CYS  27           HA       CYS  27  -3.082  -3.396   5.622
  228    HB2  CYS  27           HB2      CYS  27  -2.792  -1.663   3.806
  229    HB3  CYS  27           HB3      CYS  27  -4.495  -1.257   3.988
  230    H    LYS  28           H        LYS  28  -6.271  -3.476   4.108
  231    HA   LYS  28           HA       LYS  28  -7.825  -2.861   6.447
  232    HB2  LYS  28           HB2      LYS  28  -8.669  -4.327   3.899
  233    HB3  LYS  28           HB3      LYS  28  -9.762  -3.675   5.115
  234    HG2  LYS  28           HG2      LYS  28  -9.136  -1.399   4.539
  235    HG3  LYS  28           HG3      LYS  28  -7.898  -1.984   3.433
  236    HD2  LYS  28           HD2      LYS  28  -9.805  -3.156   2.150
  237    HD3  LYS  28           HD3      LYS  28 -10.908  -2.196   3.141
  238    HE2  LYS  28           HE2      LYS  28  -8.827  -1.149   1.193
  239    HE3  LYS  28           HE3      LYS  28 -10.583  -1.092   1.008
  240    HZ1  LYS  28           HZ1      LYS  28  -9.783   1.033   1.716
  241    HZ2  LYS  28           HZ2      LYS  28  -8.957   0.365   3.023
  242    HZ3  LYS  28           HZ3      LYS  28 -10.650   0.353   3.002
  243    H    GLU  29           H        GLU  29  -7.349  -5.876   4.613
  244    HA   GLU  29           HA       GLU  29  -8.727  -7.451   6.660
  245    HB2  GLU  29           HB2      GLU  29  -7.860  -8.181   3.828
  246    HB3  GLU  29           HB3      GLU  29  -8.906  -9.149   4.871
  247    HG2  GLU  29           HG2      GLU  29 -10.574  -7.291   4.861
  248    HG3  GLU  29           HG3      GLU  29  -9.544  -6.399   3.740
  249    H    GLY  30           H        GLY  30  -5.757  -6.571   6.714
  250    HA2  GLY  30           HA2      GLY  30  -4.784  -9.061   7.902
  251    HA3  GLY  30           HA3      GLY  30  -3.850  -8.436   6.541
  252    H    THR  31           H        THR  31  -2.167  -7.264   7.153
  253    HA   THR  31           HA       THR  31  -2.384  -5.465   9.500
  254    HB   THR  31           HB       THR  31   0.035  -5.889  10.009
  255    HG1  THR  31           HG1      THR  31  -0.232  -7.949   8.056
  256   HG21  THR  31          HG21      THR  31  -1.650  -8.419  10.069
  257   HG22  THR  31          HG22      THR  31  -1.686  -7.139  11.285
  258   HG23  THR  31          HG23      THR  31  -0.226  -8.106  11.061
  259    H    SER  32           H        SER  32  -1.486  -3.449   9.263
  260    HA   SER  32           HA       SER  32  -1.136  -2.351   6.701
  261    HB2  SER  32           HB2      SER  32  -0.221  -1.208   9.375
  262    HB3  SER  32           HB3      SER  32  -0.503  -0.294   7.892
  263    HG   SER  32           HG       SER  32  -2.647  -0.564   8.113
  264    H    GLU  33           H        GLU  33   1.217  -3.553   9.087
  265    HA   GLU  33           HA       GLU  33   3.554  -2.544   7.883
  266    HB2  GLU  33           HB2      GLU  33   4.792  -4.155   9.256
  267    HB3  GLU  33           HB3      GLU  33   3.574  -3.301  10.195
  268    HG2  GLU  33           HG2      GLU  33   2.094  -5.280  10.072
  269    HG3  GLU  33           HG3      GLU  33   3.323  -6.137   9.136
  270    H    ASP  34           H        ASP  34   1.699  -5.490   7.249
  271    HA   ASP  34           HA       ASP  34   3.556  -6.776   5.508
  272    HB2  ASP  34           HB2      ASP  34   1.690  -8.022   6.502
  273    HB3  ASP  34           HB3      ASP  34   0.513  -6.984   5.702
  274    H    ALA  35           H        ALA  35   0.867  -4.532   4.976
  275    HA   ALA  35           HA       ALA  35   0.866  -4.647   2.137
  276    HB1  ALA  35           HB1      ALA  35  -1.112  -4.047   3.451
  277    HB2  ALA  35           HB2      ALA  35  -0.720  -2.784   2.281
  278    HB3  ALA  35           HB3      ALA  35  -0.318  -2.565   3.987
  279    H    GLU  36           H        GLU  36   2.479  -2.491   4.452
  280    HA   GLU  36           HA       GLU  36   3.413  -0.646   2.443
  281    HB2  GLU  36           HB2      GLU  36   4.747   0.384   4.229
  282    HB3  GLU  36           HB3      GLU  36   3.080   0.135   4.736
  283    HG2  GLU  36           HG2      GLU  36   3.762  -1.842   6.021
  284    HG3  GLU  36           HG3      GLU  36   5.434  -1.608   5.508
  285    H    ARG  37           H        ARG  37   4.740  -3.566   3.955
  286    HA   ARG  37           HA       ARG  37   7.316  -3.500   2.769
  287    HB2  ARG  37           HB2      ARG  37   5.543  -5.873   3.475
  288    HB3  ARG  37           HB3      ARG  37   7.206  -6.030   2.919
  289    HG2  ARG  37           HG2      ARG  37   8.002  -4.790   4.879
  290    HG3  ARG  37           HG3      ARG  37   6.345  -4.591   5.443
  291    HD2  ARG  37           HD2      ARG  37   7.361  -6.412   6.668
  292    HD3  ARG  37           HD3      ARG  37   6.141  -7.079   5.581
  293    HE   ARG  37           HE       ARG  37   8.530  -7.184   4.203
  294   HH11  ARG  37          HH11      ARG  37   7.300  -8.606   7.197
  295   HH12  ARG  37          HH12      ARG  37   8.312 -10.013   7.075
  296   HH21  ARG  37          HH21      ARG  37   9.841  -9.011   4.066
  297   HH22  ARG  37          HH22      ARG  37   9.759 -10.242   5.285
  298    H    MET  38           H        MET  38   4.204  -4.786   1.604
  299    HA   MET  38           HA       MET  38   5.166  -5.611  -0.956
  300    HB2  MET  38           HB2      MET  38   2.346  -5.091   0.050
  301    HB3  MET  38           HB3      MET  38   2.720  -5.809  -1.510
  302    HG2  MET  38           HG2      MET  38   3.476  -7.023   1.163
  303    HG3  MET  38           HG3      MET  38   2.042  -7.452   0.240
  304    HE1  MET  38           HE1      MET  38   5.649  -8.387   1.007
  305    HE2  MET  38           HE2      MET  38   6.051  -7.192  -0.225
  306    HE3  MET  38           HE3      MET  38   6.339  -8.907  -0.527
  307    H    ALA  39           H        ALA  39   4.130  -2.550   0.361
  308    HA   ALA  39           HA       ALA  39   3.629  -1.160  -2.068
  309    HB1  ALA  39           HB1      ALA  39   3.830   0.892  -0.733
  310    HB2  ALA  39           HB2      ALA  39   4.531  -0.028   0.602
  311    HB3  ALA  39           HB3      ALA  39   2.859  -0.315   0.117
  312    H    ARG  40           H        ARG  40   6.566  -1.435  -0.021
  313    HA   ARG  40           HA       ARG  40   8.217   0.030  -1.851
  314    HB2  ARG  40           HB2      ARG  40  10.114  -0.664  -0.486
  315    HB3  ARG  40           HB3      ARG  40   8.793  -0.092   0.523
  316    HG2  ARG  40           HG2      ARG  40   8.198  -2.394   1.094
  317    HG3  ARG  40           HG3      ARG  40   9.482  -3.006   0.048
  318    HD2  ARG  40           HD2      ARG  40   9.910  -1.255   2.490
  319    HD3  ARG  40           HD3      ARG  40  10.072  -3.014   2.461
  320    HE   ARG  40           HE       ARG  40  11.707  -1.581   0.538
  321   HH11  ARG  40          HH11      ARG  40  11.639  -2.960   3.787
  322   HH12  ARG  40          HH12      ARG  40  13.357  -3.087   3.902
  323   HH21  ARG  40          HH21      ARG  40  13.954  -1.806   0.681
  324   HH22  ARG  40          HH22      ARG  40  14.674  -2.427   2.126
  325    H    ASN  41           H        ASN  41   7.179  -3.288  -1.645
  326    HA   ASN  41           HA       ASN  41   9.126  -4.333  -3.519
  327    HB2  ASN  41           HB2      ASN  41   6.719  -5.470  -2.107
  328    HB3  ASN  41           HB3      ASN  41   7.196  -6.246  -3.614
  329   HD21  ASN  41          HD21      ASN  41   8.059  -5.728  -0.267
  330   HD22  ASN  41          HD22      ASN  41   9.383  -6.823  -0.246
  331    H    CYS  42           H        CYS  42   6.298  -2.452  -3.812
  332    HA   CYS  42           HA       CYS  42   6.061  -2.881  -6.716
  333    HB2  CYS  42           HB2      CYS  42   4.004  -2.392  -5.389
  334    HB3  CYS  42           HB3      CYS  42   4.681  -0.849  -4.883
  335    H    GLU  43           H        GLU  43   8.579  -1.940  -5.326
  336    HA   GLU  43           HA       GLU  43  10.387  -0.709  -5.721
  337    HB2  GLU  43           HB2      GLU  43   8.916   0.086  -8.260
  338    HB3  GLU  43           HB3      GLU  43  10.615   0.433  -7.953
  339    HG2  GLU  43           HG2      GLU  43  11.097  -1.998  -7.857
  340    HG3  GLU  43           HG3      GLU  43   9.392  -2.346  -8.170
  341    H    SER  44           H        SER  44   7.960   0.527  -4.383
  342    HA   SER  44           HA       SER  44   8.100   3.351  -5.022
  343    HB2  SER  44           HB2      SER  44   6.496   1.955  -2.852
  344    HB3  SER  44           HB3      SER  44   6.225   3.574  -3.506
  345    HG   SER  44           HG       SER  44   5.415   1.166  -4.461
  Start of MODEL   10
    1    H1   ALA   1           H1       ALA   1  -3.801   7.454  12.555
    2    H2   ALA   1           H2       ALA   1  -5.067   6.700  13.378
    3    H3   ALA   1           H3       ALA   1  -5.249   8.284  12.821
    4    HA   ALA   1           HA       ALA   1  -6.426   6.702  11.446
    5    HB1  ALA   1           HB1      ALA   1  -5.626   8.808  10.496
    6    HB2  ALA   1           HB2      ALA   1  -5.586   7.516   9.299
    7    HB3  ALA   1           HB3      ALA   1  -4.089   8.048  10.071
    8    HA   PRO   2           HA       PRO   2  -4.056   2.838  11.662
    9    HB2  PRO   2           HB2      PRO   2  -6.062   1.138  10.751
   10    HB3  PRO   2           HB3      PRO   2  -5.964   1.759  12.413
   11    HG2  PRO   2           HG2      PRO   2  -7.614   2.774  10.114
   12    HG3  PRO   2           HG3      PRO   2  -8.076   2.544  11.816
   13    HD2  PRO   2           HD2      PRO   2  -7.457   4.986  10.853
   14    HD3  PRO   2           HD3      PRO   2  -7.030   4.524  12.512
   15    H    CYS   3           H        CYS   3  -5.667   3.876   8.642
   16    HA   CYS   3           HA       CYS   3  -3.602   2.448   7.083
   17    HB2  CYS   3           HB2      CYS   3  -5.712   0.991   7.414
   18    HB3  CYS   3           HB3      CYS   3  -6.537   2.135   6.361
   19    H    GLU   4           H        GLU   4  -5.363   5.227   7.627
   20    HA   GLU   4           HA       GLU   4  -5.742   6.260   4.991
   21    HB2  GLU   4           HB2      GLU   4  -5.518   7.649   7.689
   22    HB3  GLU   4           HB3      GLU   4  -5.838   8.521   6.202
   23    HG2  GLU   4           HG2      GLU   4  -7.880   8.097   7.552
   24    HG3  GLU   4           HG3      GLU   4  -7.956   7.456   5.914
   25    H    ASP   5           H        ASP   5  -3.192   6.630   7.430
   26    HA   ASP   5           HA       ASP   5  -1.443   8.337   6.062
   27    HB2  ASP   5           HB2      ASP   5  -1.153   7.818   8.463
   28    HB3  ASP   5           HB3      ASP   5  -0.819   6.131   8.083
   29    H    LEU   6           H        LEU   6  -1.817   4.809   5.998
   30    HA   LEU   6           HA       LEU   6   0.487   4.202   4.469
   31    HB2  LEU   6           HB2      LEU   6  -0.672   2.556   5.882
   32    HB3  LEU   6           HB3      LEU   6  -2.068   2.606   4.825
   33    HG   LEU   6           HG       LEU   6   0.513   1.834   3.485
   34   HD11  LEU   6          HD11      LEU   6  -0.838  -0.098   5.375
   35   HD12  LEU   6          HD12      LEU   6   0.751   0.637   5.607
   36   HD13  LEU   6          HD13      LEU   6   0.482  -0.465   4.259
   37   HD21  LEU   6          HD21      LEU   6  -2.282   0.633   3.361
   38   HD22  LEU   6          HD22      LEU   6  -0.923   0.203   2.315
   39   HD23  LEU   6          HD23      LEU   6  -1.618   1.821   2.234
   40    H    LYS   7           H        LYS   7  -2.944   4.611   3.503
   41    HA   LYS   7           HA       LYS   7  -2.490   3.880   0.806
   42    HB2  LYS   7           HB2      LYS   7  -4.731   3.797   0.693
   43    HB3  LYS   7           HB3      LYS   7  -4.775   4.287   2.368
   44    HG2  LYS   7           HG2      LYS   7  -4.774   6.381   0.190
   45    HG3  LYS   7           HG3      LYS   7  -6.256   5.505   0.576
   46    HD2  LYS   7           HD2      LYS   7  -6.091   6.266   2.931
   47    HD3  LYS   7           HD3      LYS   7  -4.604   7.133   2.552
   48    HE2  LYS   7           HE2      LYS   7  -5.831   8.625   1.053
   49    HE3  LYS   7           HE3      LYS   7  -7.317   7.717   1.337
   50    HZ1  LYS   7           HZ1      LYS   7  -7.273   8.358   3.638
   51    HZ2  LYS   7           HZ2      LYS   7  -7.203   9.742   2.672
   52    HZ3  LYS   7           HZ3      LYS   7  -5.806   9.177   3.439
   53    H    GLU   8           H        GLU   8  -2.292   6.957   2.454
   54    HA   GLU   8           HA       GLU   8  -2.048   8.609   0.118
   55    HB2  GLU   8           HB2      GLU   8  -1.267   9.103   3.016
   56    HB3  GLU   8           HB3      GLU   8  -1.217  10.335   1.749
   57    HG2  GLU   8           HG2      GLU   8  -3.663  10.061   1.414
   58    HG3  GLU   8           HG3      GLU   8  -3.692   8.865   2.713
   59    H    ARG   9           H        ARG   9   0.217   6.742   2.073
   60    HA   ARG   9           HA       ARG   9   2.609   7.798   0.905
   61    HB2  ARG   9           HB2      ARG   9   2.010   5.236   2.427
   62    HB3  ARG   9           HB3      ARG   9   3.602   5.543   1.739
   63    HG2  ARG   9           HG2      ARG   9   3.773   7.615   3.089
   64    HG3  ARG   9           HG3      ARG   9   2.204   7.261   3.818
   65    HD2  ARG   9           HD2      ARG   9   4.590   5.390   3.969
   66    HD3  ARG   9           HD3      ARG   9   4.234   6.603   5.198
   67    HE   ARG   9           HE       ARG   9   1.943   5.322   5.247
   68   HH11  ARG   9          HH11      ARG   9   5.162   3.891   5.029
   69   HH12  ARG   9          HH12      ARG   9   4.694   2.428   5.833
   70   HH21  ARG   9          HH21      ARG   9   1.358   3.371   6.291
   71   HH22  ARG   9          HH22      ARG   9   2.544   2.136   6.547
   72    H    LEU  10           H        LEU  10   0.347   5.194   0.037
   73    HA   LEU  10           HA       LEU  10   1.853   4.018  -2.055
   74    HB2  LEU  10           HB2      LEU  10  -1.179   4.216  -2.007
   75    HB3  LEU  10           HB3      LEU  10  -0.199   2.989  -2.795
   76    HG   LEU  10           HG       LEU  10  -0.714   3.316   0.183
   77   HD11  LEU  10          HD11      LEU  10  -1.383   1.055  -1.710
   78   HD12  LEU  10          HD12      LEU  10  -2.510   2.259  -1.079
   79   HD13  LEU  10          HD13      LEU  10  -1.741   1.120   0.021
   80   HD21  LEU  10          HD21      LEU  10   1.638   2.662  -0.089
   81   HD22  LEU  10          HD22      LEU  10   1.157   1.301  -1.104
   82   HD23  LEU  10          HD23      LEU  10   0.684   1.351   0.596
   83    H    LYS  11           H        LYS  11  -0.183   6.871  -1.877
   84    HA   LYS  11           HA       LYS  11  -0.303   7.426  -4.700
   85    HB2  LYS  11           HB2      LYS  11  -0.925   9.224  -2.326
   86    HB3  LYS  11           HB3      LYS  11  -1.369   9.539  -4.004
   87    HG2  LYS  11           HG2      LYS  11  -2.882   7.602  -3.991
   88    HG3  LYS  11           HG3      LYS  11  -2.388   7.206  -2.342
   89    HD2  LYS  11           HD2      LYS  11  -4.526   8.363  -2.254
   90    HD3  LYS  11           HD3      LYS  11  -3.285   9.420  -1.577
   91    HE2  LYS  11           HE2      LYS  11  -3.187  10.682  -3.688
   92    HE3  LYS  11           HE3      LYS  11  -4.365   9.588  -4.415
   93    HZ1  LYS  11           HZ1      LYS  11  -5.983  10.332  -2.781
   94    HZ2  LYS  11           HZ2      LYS  11  -5.396  11.625  -3.696
   95    HZ3  LYS  11           HZ3      LYS  11  -4.851  11.394  -2.115
   96    H    LYS  12           H        LYS  12   1.506   8.791  -1.922
   97    HA   LYS  12           HA       LYS  12   2.747  10.907  -3.360
   98    HB2  LYS  12           HB2      LYS  12   2.362  10.981  -0.903
   99    HB3  LYS  12           HB3      LYS  12   3.519   9.679  -0.672
  100    HG2  LYS  12           HG2      LYS  12   4.432  12.231  -2.005
  101    HG3  LYS  12           HG3      LYS  12   4.203  12.226  -0.258
  102    HD2  LYS  12           HD2      LYS  12   5.924  10.608   0.071
  103    HD3  LYS  12           HD3      LYS  12   5.936  10.144  -1.627
  104    HE2  LYS  12           HE2      LYS  12   7.926  11.420  -1.146
  105    HE3  LYS  12           HE3      LYS  12   6.888  12.363  -2.209
  106    HZ1  LYS  12           HZ1      LYS  12   6.177  13.670  -0.298
  107    HZ2  LYS  12           HZ2      LYS  12   7.861  13.717  -0.461
  108    HZ3  LYS  12           HZ3      LYS  12   7.155  12.745   0.726
  109    H    LEU  13           H        LEU  13   3.824   7.673  -2.401
  110    HA   LEU  13           HA       LEU  13   6.475   7.948  -3.474
  111    HB2  LEU  13           HB2      LEU  13   4.884   5.598  -2.416
  112    HB3  LEU  13           HB3      LEU  13   6.442   5.354  -3.176
  113    HG   LEU  13           HG       LEU  13   7.579   6.630  -1.417
  114   HD11  LEU  13          HD11      LEU  13   5.846   8.294  -0.902
  115   HD12  LEU  13          HD12      LEU  13   6.452   7.513   0.554
  116   HD13  LEU  13          HD13      LEU  13   4.880   7.050  -0.108
  117   HD21  LEU  13          HD21      LEU  13   7.198   4.240  -1.046
  118   HD22  LEU  13          HD22      LEU  13   5.677   4.590  -0.226
  119   HD23  LEU  13          HD23      LEU  13   7.209   5.121   0.477
  120    H    GLY  14           H        GLY  14   3.357   6.908  -4.716
  121    HA2  GLY  14           HA2      GLY  14   2.630   7.036  -6.880
  122    HA3  GLY  14           HA3      GLY  14   4.246   7.499  -7.376
  123    H    MET  15           H        MET  15   2.386   4.650  -6.294
  124    HA   MET  15           HA       MET  15   3.923   2.837  -8.007
  125    HB2  MET  15           HB2      MET  15   2.549   1.098  -6.871
  126    HB3  MET  15           HB3      MET  15   3.393   2.129  -5.726
  127    HG2  MET  15           HG2      MET  15   1.274   3.411  -5.383
  128    HG3  MET  15           HG3      MET  15   0.456   2.277  -6.449
  129    HE1  MET  15           HE1      MET  15   2.447   0.931  -2.528
  130    HE2  MET  15           HE2      MET  15   2.685   2.526  -3.238
  131    HE3  MET  15           HE3      MET  15   3.327   1.093  -4.044
  132    H    SER  16           H        SER  16   2.196   1.070  -8.916
  133    HA   SER  16           HA       SER  16   0.456   2.330 -10.845
  134    HB2  SER  16           HB2      SER  16   0.674  -0.615 -10.030
  135    HB3  SER  16           HB3      SER  16  -0.064   0.008 -11.509
  136    HG   SER  16           HG       SER  16   2.637  -0.207 -10.805
  137    H    GLU  17           H        GLU  17  -1.885   2.317 -10.788
  138    HA   GLU  17           HA       GLU  17  -3.071   2.636  -8.264
  139    HB2  GLU  17           HB2      GLU  17  -4.371   2.155 -10.962
  140    HB3  GLU  17           HB3      GLU  17  -5.298   2.468  -9.495
  141    HG2  GLU  17           HG2      GLU  17  -3.885   4.611  -9.277
  142    HG3  GLU  17           HG3      GLU  17  -3.420   4.324 -10.958
  143    H    GLU  18           H        GLU  18  -2.873  -0.213 -10.361
  144    HA   GLU  18           HA       GLU  18  -4.583  -1.912  -8.903
  145    HB2  GLU  18           HB2      GLU  18  -3.733  -2.495 -11.156
  146    HB3  GLU  18           HB3      GLU  18  -2.112  -2.688 -10.490
  147    HG2  GLU  18           HG2      GLU  18  -2.965  -4.541  -9.027
  148    HG3  GLU  18           HG3      GLU  18  -4.548  -4.372  -9.794
  149    H    CYS  19           H        CYS  19  -1.187  -0.992  -8.397
  150    HA   CYS  19           HA       CYS  19  -0.486  -2.945  -6.477
  151    HB2  CYS  19           HB2      CYS  19   1.130  -1.255  -7.654
  152    HB3  CYS  19           HB3      CYS  19   0.581  -0.093  -6.473
  153    H    ARG  20           H        ARG  20  -1.896   0.346  -6.132
  154    HA   ARG  20           HA       ARG  20  -2.194   0.420  -3.328
  155    HB2  ARG  20           HB2      ARG  20  -4.184   1.513  -5.346
  156    HB3  ARG  20           HB3      ARG  20  -4.008   2.000  -3.653
  157    HG2  ARG  20           HG2      ARG  20  -1.796   2.968  -4.204
  158    HG3  ARG  20           HG3      ARG  20  -2.053   2.528  -5.911
  159    HD2  ARG  20           HD2      ARG  20  -3.871   4.289  -4.232
  160    HD3  ARG  20           HD3      ARG  20  -2.742   4.858  -5.469
  161    HE   ARG  20           HE       ARG  20  -4.121   3.559  -7.093
  162   HH11  ARG  20          HH11      ARG  20  -5.618   4.460  -4.054
  163   HH12  ARG  20          HH12      ARG  20  -7.227   4.450  -4.701
  164   HH21  ARG  20          HH21      ARG  20  -6.236   3.717  -7.979
  165   HH22  ARG  20          HH22      ARG  20  -7.571   4.028  -6.918
  166    H    GLN  21           H        GLN  21  -4.333  -0.764  -5.885
  167    HA   GLN  21           HA       GLN  21  -6.617  -1.191  -4.380
  168    HB2  GLN  21           HB2      GLN  21  -5.709  -2.611  -6.928
  169    HB3  GLN  21           HB3      GLN  21  -7.334  -2.761  -6.256
  170    HG2  GLN  21           HG2      GLN  21  -7.860  -0.501  -6.719
  171    HG3  GLN  21           HG3      GLN  21  -6.170  -0.068  -6.982
  172   HE21  GLN  21          HE21      GLN  21  -6.472   0.755  -9.017
  173   HE22  GLN  21          HE22      GLN  21  -6.894  -0.197 -10.390
  174    H    ARG  22           H        ARG  22  -3.803  -3.182  -4.972
  175    HA   ARG  22           HA       ARG  22  -4.552  -5.556  -3.575
  176    HB2  ARG  22           HB2      ARG  22  -1.822  -4.324  -4.163
  177    HB3  ARG  22           HB3      ARG  22  -2.062  -5.954  -3.562
  178    HG2  ARG  22           HG2      ARG  22  -3.026  -6.675  -5.641
  179    HG3  ARG  22           HG3      ARG  22  -3.147  -5.013  -6.233
  180    HD2  ARG  22           HD2      ARG  22  -0.692  -4.831  -6.266
  181    HD3  ARG  22           HD3      ARG  22  -0.546  -6.468  -5.630
  182    HE   ARG  22           HE       ARG  22  -1.930  -6.165  -8.190
  183   HH11  ARG  22          HH11      ARG  22   1.050  -7.013  -6.520
  184   HH12  ARG  22          HH12      ARG  22   1.729  -7.843  -7.877
  185   HH21  ARG  22          HH21      ARG  22  -1.011  -7.237  -9.992
  186   HH22  ARG  22          HH22      ARG  22   0.554  -7.970  -9.858
  187    H    LEU  23           H        LEU  23  -2.667  -2.607  -2.678
  188    HA   LEU  23           HA       LEU  23  -1.748  -3.773  -0.225
  189    HB2  LEU  23           HB2      LEU  23  -1.352  -1.049  -1.438
  190    HB3  LEU  23           HB3      LEU  23  -0.532  -1.601   0.005
  191    HG   LEU  23           HG       LEU  23  -0.265  -2.788  -2.773
  192   HD11  LEU  23          HD11      LEU  23   1.763  -1.293  -1.131
  193   HD12  LEU  23          HD12      LEU  23   0.891  -0.672  -2.540
  194   HD13  LEU  23          HD13      LEU  23   2.017  -2.016  -2.725
  195   HD21  LEU  23          HD21      LEU  23  -0.145  -4.571  -1.103
  196   HD22  LEU  23          HD22      LEU  23   1.107  -3.679  -0.228
  197   HD23  LEU  23          HD23      LEU  23   1.424  -4.293  -1.853
  198    H    GLU  24           H        GLU  24  -3.826  -0.949  -0.924
  199    HA   GLU  24           HA       GLU  24  -4.527  -0.147   1.627
  200    HB2  GLU  24           HB2      GLU  24  -6.261  -0.288  -0.886
  201    HB3  GLU  24           HB3      GLU  24  -6.776   0.524   0.596
  202    HG2  GLU  24           HG2      GLU  24  -4.883   2.070   0.404
  203    HG3  GLU  24           HG3      GLU  24  -4.367   1.274  -1.085
  204    H    LYS  25           H        LYS  25  -5.744  -2.794  -0.334
  205    HA   LYS  25           HA       LYS  25  -7.939  -3.505   1.326
  206    HB2  LYS  25           HB2      LYS  25  -7.708  -3.942  -1.158
  207    HB3  LYS  25           HB3      LYS  25  -6.530  -5.192  -0.777
  208    HG2  LYS  25           HG2      LYS  25  -8.260  -6.435   0.469
  209    HG3  LYS  25           HG3      LYS  25  -9.432  -5.168   0.113
  210    HD2  LYS  25           HD2      LYS  25  -9.708  -7.111  -1.378
  211    HD3  LYS  25           HD3      LYS  25  -9.284  -5.652  -2.277
  212    HE2  LYS  25           HE2      LYS  25  -6.938  -6.436  -2.430
  213    HE3  LYS  25           HE3      LYS  25  -7.369  -7.884  -1.511
  214    HZ1  LYS  25           HZ1      LYS  25  -8.817  -8.573  -3.268
  215    HZ2  LYS  25           HZ2      LYS  25  -7.294  -8.240  -3.924
  216    HZ3  LYS  25           HZ3      LYS  25  -8.557  -7.135  -4.122
  217    H    MET  26           H        MET  26  -4.695  -4.942   0.779
  218    HA   MET  26           HA       MET  26  -4.801  -7.033   2.650
  219    HB2  MET  26           HB2      MET  26  -2.406  -5.489   1.593
  220    HB3  MET  26           HB3      MET  26  -2.280  -6.983   2.513
  221    HG2  MET  26           HG2      MET  26  -3.500  -8.164   0.732
  222    HG3  MET  26           HG3      MET  26  -3.605  -6.667  -0.183
  223    HE1  MET  26           HE1      MET  26  -1.047  -9.320   1.344
  224    HE2  MET  26           HE2      MET  26  -0.410  -7.785   1.941
  225    HE3  MET  26           HE3      MET  26   0.473  -8.692   0.715
  226    H    CYS  27           H        CYS  27  -4.013  -3.647   3.022
  227    HA   CYS  27           HA       CYS  27  -2.879  -3.641   5.613
  228    HB2  CYS  27           HB2      CYS  27  -2.533  -1.711   4.260
  229    HB3  CYS  27           HB3      CYS  27  -4.242  -1.563   3.885
  230    H    LYS  28           H        LYS  28  -6.180  -3.557   4.421
  231    HA   LYS  28           HA       LYS  28  -7.340  -3.256   7.112
  232    HB2  LYS  28           HB2      LYS  28  -8.457  -3.051   4.303
  233    HB3  LYS  28           HB3      LYS  28  -9.534  -3.202   5.689
  234    HG2  LYS  28           HG2      LYS  28  -8.757  -1.146   6.644
  235    HG3  LYS  28           HG3      LYS  28  -7.434  -1.018   5.482
  236    HD2  LYS  28           HD2      LYS  28 -10.308  -1.052   4.516
  237    HD3  LYS  28           HD3      LYS  28  -9.621   0.435   5.170
  238    HE2  LYS  28           HE2      LYS  28  -8.510  -1.131   2.802
  239    HE3  LYS  28           HE3      LYS  28  -9.432   0.374   2.714
  240    HZ1  LYS  28           HZ1      LYS  28  -6.746  -0.008   3.926
  241    HZ2  LYS  28           HZ2      LYS  28  -7.646   1.417   4.057
  242    HZ3  LYS  28           HZ3      LYS  28  -7.128   0.887   2.541
  243    H    GLU  29           H        GLU  29  -6.684  -5.742   4.787
  244    HA   GLU  29           HA       GLU  29  -8.614  -7.664   5.782
  245    HB2  GLU  29           HB2      GLU  29  -6.281  -7.937   3.841
  246    HB3  GLU  29           HB3      GLU  29  -7.279  -9.304   4.330
  247    HG2  GLU  29           HG2      GLU  29  -9.264  -8.209   3.355
  248    HG3  GLU  29           HG3      GLU  29  -8.270  -6.834   2.870
  249    H    GLY  30           H        GLY  30  -5.239  -6.834   6.298
  250    HA2  GLY  30           HA2      GLY  30  -5.050  -8.751   8.547
  251    HA3  GLY  30           HA3      GLY  30  -3.858  -8.839   7.252
  252    H    THR  31           H        THR  31  -2.303  -7.177   7.053
  253    HA   THR  31           HA       THR  31  -2.043  -5.402   9.418
  254    HB   THR  31           HB       THR  31   0.491  -5.912   9.238
  255    HG1  THR  31           HG1      THR  31   1.023  -7.842   8.204
  256   HG21  THR  31          HG21      THR  31  -0.869  -6.790  11.107
  257   HG22  THR  31          HG22      THR  31   0.346  -7.966  10.603
  258   HG23  THR  31          HG23      THR  31  -1.337  -8.179  10.120
  259    H    SER  32           H        SER  32  -1.311  -3.412   9.041
  260    HA   SER  32           HA       SER  32  -1.058  -2.310   6.442
  261    HB2  SER  32           HB2      SER  32  -0.215  -0.271   7.760
  262    HB3  SER  32           HB3      SER  32  -1.816  -0.864   8.220
  263    HG   SER  32           HG       SER  32   0.583  -0.893   9.625
  264    H    GLU  33           H        GLU  33   1.272  -3.431   8.882
  265    HA   GLU  33           HA       GLU  33   3.696  -2.489   7.903
  266    HB2  GLU  33           HB2      GLU  33   3.047  -5.090   9.340
  267    HB3  GLU  33           HB3      GLU  33   4.700  -4.529   9.068
  268    HG2  GLU  33           HG2      GLU  33   4.298  -2.539  10.412
  269    HG3  GLU  33           HG3      GLU  33   2.595  -2.964  10.599
  270    H    ASP  34           H        ASP  34   1.908  -5.389   6.892
  271    HA   ASP  34           HA       ASP  34   3.979  -6.342   5.113
  272    HB2  ASP  34           HB2      ASP  34   1.152  -7.254   5.726
  273    HB3  ASP  34           HB3      ASP  34   2.030  -7.934   4.355
  274    H    ALA  35           H        ALA  35   1.038  -4.431   4.766
  275    HA   ALA  35           HA       ALA  35   0.841  -4.471   1.929
  276    HB1  ALA  35           HB1      ALA  35  -1.038  -3.822   3.385
  277    HB2  ALA  35           HB2      ALA  35  -0.677  -2.543   2.226
  278    HB3  ALA  35           HB3      ALA  35  -0.156  -2.383   3.905
  279    H    GLU  36           H        GLU  36   2.280  -2.101   4.181
  280    HA   GLU  36           HA       GLU  36   3.341  -0.403   2.155
  281    HB2  GLU  36           HB2      GLU  36   4.481   0.767   3.998
  282    HB3  GLU  36           HB3      GLU  36   2.789   0.468   4.382
  283    HG2  GLU  36           HG2      GLU  36   3.516  -1.529   5.724
  284    HG3  GLU  36           HG3      GLU  36   5.194  -1.048   5.455
  285    H    ARG  37           H        ARG  37   4.599  -3.210   3.922
  286    HA   ARG  37           HA       ARG  37   7.297  -3.116   3.106
  287    HB2  ARG  37           HB2      ARG  37   6.545  -4.766   4.750
  288    HB3  ARG  37           HB3      ARG  37   5.505  -5.537   3.557
  289    HG2  ARG  37           HG2      ARG  37   7.520  -6.204   2.249
  290    HG3  ARG  37           HG3      ARG  37   8.547  -5.462   3.481
  291    HD2  ARG  37           HD2      ARG  37   6.633  -7.772   3.923
  292    HD3  ARG  37           HD3      ARG  37   8.384  -7.909   3.756
  293    HE   ARG  37           HE       ARG  37   8.233  -6.244   5.832
  294   HH11  ARG  37          HH11      ARG  37   6.428  -9.231   5.269
  295   HH12  ARG  37          HH12      ARG  37   6.272  -9.584   6.958
  296   HH21  ARG  37          HH21      ARG  37   8.043  -6.753   8.023
  297   HH22  ARG  37          HH22      ARG  37   7.191  -8.175   8.520
  298    H    MET  38           H        MET  38   4.480  -4.687   1.538
  299    HA   MET  38           HA       MET  38   5.856  -5.566  -0.764
  300    HB2  MET  38           HB2      MET  38   2.909  -4.999  -0.350
  301    HB3  MET  38           HB3      MET  38   3.553  -5.758  -1.798
  302    HG2  MET  38           HG2      MET  38   3.822  -6.921   0.989
  303    HG3  MET  38           HG3      MET  38   2.540  -7.343  -0.138
  304    HE1  MET  38           HE1      MET  38   6.008  -8.181   1.162
  305    HE2  MET  38           HE2      MET  38   6.619  -7.149  -0.135
  306    HE3  MET  38           HE3      MET  38   6.868  -8.894  -0.201
  307    H    ALA  39           H        ALA  39   4.413  -2.465   0.042
  308    HA   ALA  39           HA       ALA  39   4.313  -1.218  -2.462
  309    HB1  ALA  39           HB1      ALA  39   4.384   0.903  -1.207
  310    HB2  ALA  39           HB2      ALA  39   4.935   0.038   0.233
  311    HB3  ALA  39           HB3      ALA  39   3.328  -0.275  -0.418
  312    H    ARG  40           H        ARG  40   7.016  -1.379  -0.113
  313    HA   ARG  40           HA       ARG  40   8.761   0.150  -1.843
  314    HB2  ARG  40           HB2      ARG  40  10.494  -0.214  -0.038
  315    HB3  ARG  40           HB3      ARG  40   9.049   0.657   0.433
  316    HG2  ARG  40           HG2      ARG  40   9.541  -0.729   2.252
  317    HG3  ARG  40           HG3      ARG  40   8.205  -1.531   1.434
  318    HD2  ARG  40           HD2      ARG  40   9.905  -3.121   2.203
  319    HD3  ARG  40           HD3      ARG  40   9.755  -3.144   0.445
  320    HE   ARG  40           HE       ARG  40  11.788  -1.623   0.487
  321   HH11  ARG  40          HH11      ARG  40  11.249  -4.008   3.038
  322   HH12  ARG  40          HH12      ARG  40  12.942  -4.180   3.387
  323   HH21  ARG  40          HH21      ARG  40  13.979  -1.894   0.935
  324   HH22  ARG  40          HH22      ARG  40  14.490  -2.981   2.187
  325    H    ASN  41           H        ASN  41   7.797  -2.805  -2.411
  326    HA   ASN  41           HA       ASN  41  10.224  -3.233  -4.028
  327    HB2  ASN  41           HB2      ASN  41   9.940  -5.735  -3.821
  328    HB3  ASN  41           HB3      ASN  41  10.464  -4.949  -2.343
  329   HD21  ASN  41          HD21      ASN  41   9.178  -5.017  -0.560
  330   HD22  ASN  41          HD22      ASN  41   7.711  -5.915  -0.467
  331    H    CYS  42           H        CYS  42   6.988  -2.596  -3.960
  332    HA   CYS  42           HA       CYS  42   6.195  -4.001  -6.393
  333    HB2  CYS  42           HB2      CYS  42   4.488  -3.588  -4.676
  334    HB3  CYS  42           HB3      CYS  42   4.809  -1.860  -4.721
  335    H    GLU  43           H        GLU  43   6.735  -0.636  -5.358
  336    HA   GLU  43           HA       GLU  43   6.799   0.321  -8.141
  337    HB2  GLU  43           HB2      GLU  43   6.540   2.552  -7.154
  338    HB3  GLU  43           HB3      GLU  43   5.327   1.456  -6.505
  339    HG2  GLU  43           HG2      GLU  43   7.056   1.144  -4.539
  340    HG3  GLU  43           HG3      GLU  43   7.719   2.669  -5.118
  341    H    SER  44           H        SER  44   8.792   0.038  -5.235
  342    HA   SER  44           HA       SER  44  11.078   1.436  -6.345
  343    HB2  SER  44           HB2      SER  44  10.849  -0.204  -3.778
  344    HB3  SER  44           HB3      SER  44  12.153   0.911  -4.197
  345    HG   SER  44           HG       SER  44  10.397   2.527  -4.347
  Start of MODEL   11
    1    H1   ALA   1           H1       ALA   1  -4.867   4.113  14.487
    2    H2   ALA   1           H2       ALA   1  -3.594   5.215  14.647
    3    H3   ALA   1           H3       ALA   1  -3.287   3.629  14.149
    4    HA   ALA   1           HA       ALA   1  -4.889   5.596  12.636
    5    HB1  ALA   1           HB1      ALA   1  -2.936   5.735  11.123
    6    HB2  ALA   1           HB2      ALA   1  -2.035   4.660  12.196
    7    HB3  ALA   1           HB3      ALA   1  -2.532   6.256  12.760
    8    HA   PRO   2           HA       PRO   2  -6.538   1.668  11.142
    9    HB2  PRO   2           HB2      PRO   2  -7.770   3.263   8.933
   10    HB3  PRO   2           HB3      PRO   2  -8.552   2.267  10.174
   11    HG2  PRO   2           HG2      PRO   2  -8.702   4.927  10.285
   12    HG3  PRO   2           HG3      PRO   2  -8.522   3.962  11.768
   13    HD2  PRO   2           HD2      PRO   2  -6.406   5.499  10.261
   14    HD3  PRO   2           HD3      PRO   2  -6.698   5.411  12.015
   15    H    CYS   3           H        CYS   3  -5.755   3.762   8.298
   16    HA   CYS   3           HA       CYS   3  -3.737   1.940   7.282
   17    HB2  CYS   3           HB2      CYS   3  -6.052   0.939   6.674
   18    HB3  CYS   3           HB3      CYS   3  -6.241   2.309   5.589
   19    H    GLU   4           H        GLU   4  -4.326   4.823   7.987
   20    HA   GLU   4           HA       GLU   4  -4.557   6.395   5.613
   21    HB2  GLU   4           HB2      GLU   4  -4.175   8.319   7.202
   22    HB3  GLU   4           HB3      GLU   4  -5.481   7.235   7.664
   23    HG2  GLU   4           HG2      GLU   4  -3.938   6.126   9.279
   24    HG3  GLU   4           HG3      GLU   4  -2.700   7.314   8.867
   25    H    ASP   5           H        ASP   5  -1.842   5.551   7.758
   26    HA   ASP   5           HA       ASP   5   0.196   7.124   6.647
   27    HB2  ASP   5           HB2      ASP   5   0.402   4.356   7.927
   28    HB3  ASP   5           HB3      ASP   5   1.777   5.416   7.601
   29    H    LEU   6           H        LEU   6  -1.071   3.937   5.778
   30    HA   LEU   6           HA       LEU   6   0.796   3.260   3.765
   31    HB2  LEU   6           HB2      LEU   6  -0.717   1.631   4.816
   32    HB3  LEU   6           HB3      LEU   6  -2.105   2.469   4.145
   33    HG   LEU   6           HG       LEU   6  -1.065   1.920   1.810
   34   HD11  LEU   6          HD11      LEU   6   0.429  -0.119   3.466
   35   HD12  LEU   6          HD12      LEU   6   1.133   1.229   2.571
   36   HD13  LEU   6          HD13      LEU   6   0.334  -0.078   1.701
   37   HD21  LEU   6          HD21      LEU   6  -2.190  -0.338   3.461
   38   HD22  LEU   6          HD22      LEU   6  -2.191  -0.218   1.699
   39   HD23  LEU   6          HD23      LEU   6  -3.131   0.923   2.662
   40    H    LYS   7           H        LYS   7  -2.487   4.719   3.617
   41    HA   LYS   7           HA       LYS   7  -2.788   4.725   0.839
   42    HB2  LYS   7           HB2      LYS   7  -4.692   4.916   2.335
   43    HB3  LYS   7           HB3      LYS   7  -4.113   6.459   2.960
   44    HG2  LYS   7           HG2      LYS   7  -4.459   7.469   0.698
   45    HG3  LYS   7           HG3      LYS   7  -5.093   5.923   0.129
   46    HD2  LYS   7           HD2      LYS   7  -6.307   7.614   2.349
   47    HD3  LYS   7           HD3      LYS   7  -6.872   7.572   0.678
   48    HE2  LYS   7           HE2      LYS   7  -7.406   5.164   0.932
   49    HE3  LYS   7           HE3      LYS   7  -6.870   5.231   2.613
   50    HZ1  LYS   7           HZ1      LYS   7  -8.611   6.794   3.099
   51    HZ2  LYS   7           HZ2      LYS   7  -9.284   5.422   2.381
   52    HZ3  LYS   7           HZ3      LYS   7  -9.099   6.841   1.480
   53    H    GLU   8           H        GLU   8  -1.701   7.355   2.978
   54    HA   GLU   8           HA       GLU   8  -1.585   9.316   0.910
   55    HB2  GLU   8           HB2      GLU   8  -0.238   9.389   3.632
   56    HB3  GLU   8           HB3      GLU   8  -0.562  10.768   2.577
   57    HG2  GLU   8           HG2      GLU   8  -2.630   9.009   3.917
   58    HG3  GLU   8           HG3      GLU   8  -2.194  10.643   4.410
   59    H    ARG   9           H        ARG   9   0.738   6.998   2.174
   60    HA   ARG   9           HA       ARG   9   2.967   8.028   0.662
   61    HB2  ARG   9           HB2      ARG   9   2.481   5.418   2.115
   62    HB3  ARG   9           HB3      ARG   9   3.941   5.685   1.163
   63    HG2  ARG   9           HG2      ARG   9   4.499   7.628   2.592
   64    HG3  ARG   9           HG3      ARG   9   3.051   7.323   3.559
   65    HD2  ARG   9           HD2      ARG   9   5.395   5.416   3.216
   66    HD3  ARG   9           HD3      ARG   9   5.079   6.421   4.640
   67    HE   ARG   9           HE       ARG   9   2.854   4.745   3.975
   68   HH11  ARG   9          HH11      ARG   9   5.993   4.651   5.605
   69   HH12  ARG   9          HH12      ARG   9   5.541   3.321   6.626
   70   HH21  ARG   9          HH21      ARG   9   2.268   3.081   5.378
   71   HH22  ARG   9          HH22      ARG   9   3.421   2.436   6.496
   72    H    LEU  10           H        LEU  10   0.318   5.730   0.031
   73    HA   LEU  10           HA       LEU  10   1.458   4.438  -2.235
   74    HB2  LEU  10           HB2      LEU  10  -1.510   4.867  -1.707
   75    HB3  LEU  10           HB3      LEU  10  -0.819   3.711  -2.836
   76    HG   LEU  10           HG       LEU  10  -0.788   3.603   0.189
   77   HD11  LEU  10          HD11      LEU  10  -1.905   1.487  -0.078
   78   HD12  LEU  10          HD12      LEU  10  -1.834   1.635  -1.835
   79   HD13  LEU  10          HD13      LEU  10  -2.799   2.771  -0.887
   80   HD21  LEU  10          HD21      LEU  10   1.453   2.975  -0.488
   81   HD22  LEU  10          HD22      LEU  10   0.817   1.835  -1.675
   82   HD23  LEU  10          HD23      LEU  10   0.569   1.551   0.050
   83    H    LYS  11           H        LYS  11  -0.676   7.270  -1.905
   84    HA   LYS  11           HA       LYS  11  -0.889   7.808  -4.711
   85    HB2  LYS  11           HB2      LYS  11  -1.954   9.933  -4.019
   86    HB3  LYS  11           HB3      LYS  11  -2.636   8.555  -3.162
   87    HG2  LYS  11           HG2      LYS  11  -1.290   9.113  -1.173
   88    HG3  LYS  11           HG3      LYS  11  -0.575  10.478  -2.027
   89    HD2  LYS  11           HD2      LYS  11  -2.314  11.242  -0.494
   90    HD3  LYS  11           HD3      LYS  11  -2.797  11.560  -2.161
   91    HE2  LYS  11           HE2      LYS  11  -4.360   9.710  -2.117
   92    HE3  LYS  11           HE3      LYS  11  -3.743   9.161  -0.554
   93    HZ1  LYS  11           HZ1      LYS  11  -5.847  10.406  -0.383
   94    HZ2  LYS  11           HZ2      LYS  11  -5.077  11.781  -0.998
   95    HZ3  LYS  11           HZ3      LYS  11  -4.589  11.131   0.484
   96    H    LYS  12           H        LYS  12   1.288   8.869  -2.141
   97    HA   LYS  12           HA       LYS  12   2.561  11.021  -3.515
   98    HB2  LYS  12           HB2      LYS  12   2.566  10.674  -1.015
   99    HB3  LYS  12           HB3      LYS  12   3.663   9.308  -1.243
  100    HG2  LYS  12           HG2      LYS  12   5.317  10.909  -2.279
  101    HG3  LYS  12           HG3      LYS  12   4.224  12.232  -1.863
  102    HD2  LYS  12           HD2      LYS  12   4.435  11.661   0.528
  103    HD3  LYS  12           HD3      LYS  12   5.505  10.315   0.114
  104    HE2  LYS  12           HE2      LYS  12   6.806  12.253   0.900
  105    HE3  LYS  12           HE3      LYS  12   7.160  11.907  -0.791
  106    HZ1  LYS  12           HZ1      LYS  12   5.607  13.709  -1.406
  107    HZ2  LYS  12           HZ2      LYS  12   6.911  14.265  -0.486
  108    HZ3  LYS  12           HZ3      LYS  12   5.394  14.074   0.231
  109    H    LEU  13           H        LEU  13   3.213   7.590  -3.153
  110    HA   LEU  13           HA       LEU  13   5.851   7.593  -4.245
  111    HB2  LEU  13           HB2      LEU  13   4.890   6.009  -2.536
  112    HB3  LEU  13           HB3      LEU  13   3.906   5.298  -3.791
  113    HG   LEU  13           HG       LEU  13   6.929   5.240  -4.044
  114   HD11  LEU  13          HD11      LEU  13   5.290   3.261  -2.434
  115   HD12  LEU  13          HD12      LEU  13   6.442   4.424  -1.776
  116   HD13  LEU  13          HD13      LEU  13   7.011   3.117  -2.819
  117   HD21  LEU  13          HD21      LEU  13   6.501   3.132  -5.272
  118   HD22  LEU  13          HD22      LEU  13   5.619   4.476  -5.993
  119   HD23  LEU  13          HD23      LEU  13   4.769   3.313  -4.979
  120    H    GLY  14           H        GLY  14   2.597   7.385  -5.515
  121    HA2  GLY  14           HA2      GLY  14   1.761   7.382  -7.643
  122    HA3  GLY  14           HA3      GLY  14   3.358   7.880  -8.180
  123    H    MET  15           H        MET  15   2.259   4.876  -6.631
  124    HA   MET  15           HA       MET  15   3.719   3.174  -8.425
  125    HB2  MET  15           HB2      MET  15   2.661   1.359  -7.051
  126    HB3  MET  15           HB3      MET  15   3.483   2.571  -6.078
  127    HG2  MET  15           HG2      MET  15   1.263   3.644  -5.630
  128    HG3  MET  15           HG3      MET  15   0.498   2.328  -6.511
  129    HE1  MET  15           HE1      MET  15   2.791   3.185  -3.400
  130    HE2  MET  15           HE2      MET  15   3.648   1.847  -4.167
  131    HE3  MET  15           HE3      MET  15   2.849   1.613  -2.609
  132    H    SER  16           H        SER  16   2.375   1.137  -9.208
  133    HA   SER  16           HA       SER  16   0.632   1.893 -11.284
  134    HB2  SER  16           HB2      SER  16   0.951  -0.828  -9.946
  135    HB3  SER  16           HB3      SER  16   0.177  -0.552 -11.502
  136    HG   SER  16           HG       SER  16   2.620   0.575 -11.506
  137    H    GLU  17           H        GLU  17  -1.668   1.747 -11.507
  138    HA   GLU  17           HA       GLU  17  -3.141   2.506  -9.217
  139    HB2  GLU  17           HB2      GLU  17  -4.012   1.663 -11.990
  140    HB3  GLU  17           HB3      GLU  17  -5.181   2.103 -10.738
  141    HG2  GLU  17           HG2      GLU  17  -4.160   4.303 -10.496
  142    HG3  GLU  17           HG3      GLU  17  -2.929   3.892 -11.690
  143    H    GLU  18           H        GLU  18  -2.636  -0.596 -10.734
  144    HA   GLU  18           HA       GLU  18  -4.483  -2.148  -9.280
  145    HB2  GLU  18           HB2      GLU  18  -3.333  -2.886 -11.364
  146    HB3  GLU  18           HB3      GLU  18  -1.807  -2.948 -10.493
  147    HG2  GLU  18           HG2      GLU  18  -2.618  -4.780  -9.101
  148    HG3  GLU  18           HG3      GLU  18  -4.220  -4.657  -9.824
  149    H    CYS  19           H        CYS  19  -1.326  -0.817  -8.434
  150    HA   CYS  19           HA       CYS  19  -0.532  -2.773  -6.524
  151    HB2  CYS  19           HB2      CYS  19   1.056  -1.080  -7.655
  152    HB3  CYS  19           HB3      CYS  19   0.380   0.137  -6.605
  153    H    ARG  20           H        ARG  20  -2.023   0.475  -6.211
  154    HA   ARG  20           HA       ARG  20  -2.061   0.502  -3.361
  155    HB2  ARG  20           HB2      ARG  20  -4.220   2.037  -4.821
  156    HB3  ARG  20           HB3      ARG  20  -3.286   2.492  -3.404
  157    HG2  ARG  20           HG2      ARG  20  -2.430   3.943  -4.988
  158    HG3  ARG  20           HG3      ARG  20  -1.291   2.617  -5.138
  159    HD2  ARG  20           HD2      ARG  20  -1.928   3.370  -7.321
  160    HD3  ARG  20           HD3      ARG  20  -2.610   1.761  -7.026
  161    HE   ARG  20           HE       ARG  20  -4.757   2.716  -6.791
  162   HH11  ARG  20          HH11      ARG  20  -2.356   5.114  -7.811
  163   HH12  ARG  20          HH12      ARG  20  -3.555   6.214  -8.407
  164   HH21  ARG  20          HH21      ARG  20  -6.277   4.160  -7.622
  165   HH22  ARG  20          HH22      ARG  20  -5.771   5.671  -8.300
  166    H    GLN  21           H        GLN  21  -4.311  -0.675  -5.770
  167    HA   GLN  21           HA       GLN  21  -6.548  -1.206  -4.146
  168    HB2  GLN  21           HB2      GLN  21  -5.616  -2.597  -6.696
  169    HB3  GLN  21           HB3      GLN  21  -7.218  -2.792  -5.979
  170    HG2  GLN  21           HG2      GLN  21  -7.783  -0.503  -6.412
  171    HG3  GLN  21           HG3      GLN  21  -6.121  -0.107  -6.849
  172   HE21  GLN  21          HE21      GLN  21  -6.696   0.713  -8.837
  173   HE22  GLN  21          HE22      GLN  21  -7.213  -0.276 -10.155
  174    H    ARG  22           H        ARG  22  -3.664  -3.073  -4.970
  175    HA   ARG  22           HA       ARG  22  -4.426  -5.494  -3.622
  176    HB2  ARG  22           HB2      ARG  22  -1.898  -4.466  -4.904
  177    HB3  ARG  22           HB3      ARG  22  -1.733  -5.781  -3.752
  178    HG2  ARG  22           HG2      ARG  22  -1.865  -6.624  -6.056
  179    HG3  ARG  22           HG3      ARG  22  -3.207  -7.199  -5.070
  180    HD2  ARG  22           HD2      ARG  22  -4.626  -5.381  -6.067
  181    HD3  ARG  22           HD3      ARG  22  -3.291  -5.004  -7.155
  182    HE   ARG  22           HE       ARG  22  -3.604  -7.575  -7.700
  183   HH11  ARG  22          HH11      ARG  22  -6.077  -5.076  -7.312
  184   HH12  ARG  22          HH12      ARG  22  -7.196  -5.835  -8.394
  185   HH21  ARG  22          HH21      ARG  22  -5.105  -8.553  -9.155
  186   HH22  ARG  22          HH22      ARG  22  -6.640  -7.798  -9.433
  187    H    LEU  23           H        LEU  23  -2.607  -2.582  -2.731
  188    HA   LEU  23           HA       LEU  23  -1.486  -3.743  -0.354
  189    HB2  LEU  23           HB2      LEU  23  -1.552  -0.887  -1.333
  190    HB3  LEU  23           HB3      LEU  23  -0.578  -1.464   0.003
  191    HG   LEU  23           HG       LEU  23  -0.293  -2.314  -2.900
  192   HD11  LEU  23          HD11      LEU  23   1.861  -1.211  -2.879
  193   HD12  LEU  23          HD12      LEU  23   1.575  -0.659  -1.226
  194   HD13  LEU  23          HD13      LEU  23   0.553  -0.076  -2.544
  195   HD21  LEU  23          HD21      LEU  23   0.209  -4.202  -1.472
  196   HD22  LEU  23          HD22      LEU  23   1.322  -3.219  -0.515
  197   HD23  LEU  23          HD23      LEU  23   1.687  -3.581  -2.204
  198    H    GLU  24           H        GLU  24  -3.973  -1.161  -0.892
  199    HA   GLU  24           HA       GLU  24  -4.763  -0.849   1.767
  200    HB2  GLU  24           HB2      GLU  24  -6.370  -0.500  -0.782
  201    HB3  GLU  24           HB3      GLU  24  -7.024  -0.107   0.808
  202    HG2  GLU  24           HG2      GLU  24  -5.107   1.513   1.108
  203    HG3  GLU  24           HG3      GLU  24  -4.644   1.190  -0.568
  204    H    LYS  25           H        LYS  25  -5.544  -3.412  -0.507
  205    HA   LYS  25           HA       LYS  25  -7.791  -4.516   0.880
  206    HB2  LYS  25           HB2      LYS  25  -7.137  -4.896  -1.557
  207    HB3  LYS  25           HB3      LYS  25  -5.856  -5.952  -0.980
  208    HG2  LYS  25           HG2      LYS  25  -7.638  -7.391   0.095
  209    HG3  LYS  25           HG3      LYS  25  -8.846  -6.363  -0.678
  210    HD2  LYS  25           HD2      LYS  25  -8.526  -8.346  -2.034
  211    HD3  LYS  25           HD3      LYS  25  -7.881  -6.953  -2.908
  212    HE2  LYS  25           HE2      LYS  25  -6.353  -8.847  -3.129
  213    HE3  LYS  25           HE3      LYS  25  -5.580  -7.596  -2.153
  214    HZ1  LYS  25           HZ1      LYS  25  -6.236  -8.864  -0.150
  215    HZ2  LYS  25           HZ2      LYS  25  -5.234  -9.760  -1.175
  216    HZ3  LYS  25           HZ3      LYS  25  -6.892 -10.073  -1.140
  217    H    MET  26           H        MET  26  -4.322  -5.370   0.675
  218    HA   MET  26           HA       MET  26  -4.252  -7.462   2.566
  219    HB2  MET  26           HB2      MET  26  -2.068  -5.558   1.634
  220    HB3  MET  26           HB3      MET  26  -1.772  -7.006   2.588
  221    HG2  MET  26           HG2      MET  26  -2.570  -8.407   0.781
  222    HG3  MET  26           HG3      MET  26  -3.057  -7.003  -0.150
  223    HE1  MET  26           HE1      MET  26   0.008  -8.908   1.408
  224    HE2  MET  26           HE2      MET  26   0.360  -7.255   1.922
  225    HE3  MET  26           HE3      MET  26   1.365  -8.036   0.703
  226    H    CYS  27           H        CYS  27  -4.109  -4.009   2.907
  227    HA   CYS  27           HA       CYS  27  -3.046  -3.822   5.542
  228    HB2  CYS  27           HB2      CYS  27  -2.862  -1.988   3.994
  229    HB3  CYS  27           HB3      CYS  27  -4.603  -1.917   3.785
  230    H    LYS  28           H        LYS  28  -6.336  -3.656   4.211
  231    HA   LYS  28           HA       LYS  28  -7.523  -3.131   6.813
  232    HB2  LYS  28           HB2      LYS  28  -8.783  -3.490   4.063
  233    HB3  LYS  28           HB3      LYS  28  -9.681  -3.075   5.523
  234    HG2  LYS  28           HG2      LYS  28  -8.433  -0.978   5.737
  235    HG3  LYS  28           HG3      LYS  28  -7.456  -1.384   4.324
  236    HD2  LYS  28           HD2      LYS  28 -10.473  -0.919   4.313
  237    HD3  LYS  28           HD3      LYS  28  -9.264   0.259   3.798
  238    HE2  LYS  28           HE2      LYS  28  -8.557  -1.272   1.977
  239    HE3  LYS  28           HE3      LYS  28  -9.765  -2.448   2.498
  240    HZ1  LYS  28           HZ1      LYS  28 -10.317   0.280   1.451
  241    HZ2  LYS  28           HZ2      LYS  28 -11.491  -0.807   1.993
  242    HZ3  LYS  28           HZ3      LYS  28 -10.567  -1.175   0.628
  243    H    GLU  29           H        GLU  29  -6.973  -5.909   4.781
  244    HA   GLU  29           HA       GLU  29  -8.720  -7.691   6.301
  245    HB2  GLU  29           HB2      GLU  29  -6.623  -8.309   4.169
  246    HB3  GLU  29           HB3      GLU  29  -7.692  -9.505   4.905
  247    HG2  GLU  29           HG2      GLU  29  -9.650  -8.333   3.946
  248    HG3  GLU  29           HG3      GLU  29  -8.573  -7.148   3.208
  249    H    GLY  30           H        GLY  30  -5.206  -7.632   5.607
  250    HA2  GLY  30           HA2      GLY  30  -4.556  -9.140   8.036
  251    HA3  GLY  30           HA3      GLY  30  -3.450  -8.650   6.761
  252    H    THR  31           H        THR  31  -2.164  -6.901   7.104
  253    HA   THR  31           HA       THR  31  -2.848  -4.943   9.213
  254    HB   THR  31           HB       THR  31  -0.404  -4.951   9.947
  255    HG1  THR  31           HG1      THR  31   0.408  -7.319   9.361
  256   HG21  THR  31          HG21      THR  31  -0.539  -6.941  11.390
  257   HG22  THR  31          HG22      THR  31  -1.849  -7.587  10.399
  258   HG23  THR  31          HG23      THR  31  -2.098  -6.113  11.340
  259    H    SER  32           H        SER  32  -1.900  -2.901   8.935
  260    HA   SER  32           HA       SER  32  -1.422  -1.941   6.335
  261    HB2  SER  32           HB2      SER  32  -2.194  -0.461   8.161
  262    HB3  SER  32           HB3      SER  32  -0.671  -0.678   9.017
  263    HG   SER  32           HG       SER  32   0.378   0.343   7.219
  264    H    GLU  33           H        GLU  33   0.706  -3.225   8.807
  265    HA   GLU  33           HA       GLU  33   3.187  -2.307   7.786
  266    HB2  GLU  33           HB2      GLU  33   2.635  -4.729   9.546
  267    HB3  GLU  33           HB3      GLU  33   4.204  -3.976   9.300
  268    HG2  GLU  33           HG2      GLU  33   3.527  -3.172  11.392
  269    HG3  GLU  33           HG3      GLU  33   3.152  -1.841  10.301
  270    H    ASP  34           H        ASP  34   1.286  -5.224   7.284
  271    HA   ASP  34           HA       ASP  34   3.089  -6.750   5.736
  272    HB2  ASP  34           HB2      ASP  34   1.101  -7.711   6.816
  273    HB3  ASP  34           HB3      ASP  34   0.041  -6.703   5.840
  274    H    ALA  35           H        ALA  35   0.641  -4.355   4.890
  275    HA   ALA  35           HA       ALA  35   0.777  -4.612   2.056
  276    HB1  ALA  35           HB1      ALA  35  -0.301  -2.365   3.785
  277    HB2  ALA  35           HB2      ALA  35  -1.202  -3.785   3.241
  278    HB3  ALA  35           HB3      ALA  35  -0.634  -2.596   2.065
  279    H    GLU  36           H        GLU  36   2.100  -2.180   4.326
  280    HA   GLU  36           HA       GLU  36   3.251  -0.501   2.348
  281    HB2  GLU  36           HB2      GLU  36   4.336   0.691   4.199
  282    HB3  GLU  36           HB3      GLU  36   2.641   0.368   4.551
  283    HG2  GLU  36           HG2      GLU  36   3.354  -1.593   5.920
  284    HG3  GLU  36           HG3      GLU  36   5.032  -1.119   5.662
  285    H    ARG  37           H        ARG  37   4.447  -3.288   4.097
  286    HA   ARG  37           HA       ARG  37   7.178  -3.195   3.499
  287    HB2  ARG  37           HB2      ARG  37   6.054  -4.882   4.995
  288    HB3  ARG  37           HB3      ARG  37   5.390  -5.668   3.565
  289    HG2  ARG  37           HG2      ARG  37   7.658  -6.211   2.789
  290    HG3  ARG  37           HG3      ARG  37   8.347  -5.370   4.180
  291    HD2  ARG  37           HD2      ARG  37   7.135  -7.005   5.667
  292    HD3  ARG  37           HD3      ARG  37   6.665  -7.894   4.215
  293    HE   ARG  37           HE       ARG  37   9.384  -7.678   4.012
  294   HH11  ARG  37          HH11      ARG  37   7.247  -8.992   6.504
  295   HH12  ARG  37          HH12      ARG  37   8.407 -10.163   7.041
  296   HH21  ARG  37          HH21      ARG  37  10.899  -9.194   4.763
  297   HH22  ARG  37          HH22      ARG  37  10.478 -10.274   6.052
  298    H    MET  38           H        MET  38   4.485  -4.644   1.632
  299    HA   MET  38           HA       MET  38   5.982  -5.295  -0.660
  300    HB2  MET  38           HB2      MET  38   2.988  -4.821  -0.433
  301    HB3  MET  38           HB3      MET  38   3.814  -5.697  -1.720
  302    HG2  MET  38           HG2      MET  38   3.563  -6.536   1.183
  303    HG3  MET  38           HG3      MET  38   2.800  -7.290  -0.218
  304    HE1  MET  38           HE1      MET  38   4.255  -8.520  -2.161
  305    HE2  MET  38           HE2      MET  38   6.001  -8.744  -2.056
  306    HE3  MET  38           HE3      MET  38   5.330  -7.126  -2.274
  307    H    ALA  39           H        ALA  39   4.421  -2.307   0.358
  308    HA   ALA  39           HA       ALA  39   4.141  -1.000  -2.122
  309    HB1  ALA  39           HB1      ALA  39   4.006   1.078  -0.815
  310    HB2  ALA  39           HB2      ALA  39   4.655   0.242   0.600
  311    HB3  ALA  39           HB3      ALA  39   3.079  -0.215  -0.047
  312    H    ARG  40           H        ARG  40   6.870  -1.156   0.127
  313    HA   ARG  40           HA       ARG  40   8.553   0.570  -1.494
  314    HB2  ARG  40           HB2      ARG  40  10.283   0.069   0.320
  315    HB3  ARG  40           HB3      ARG  40   8.834   0.929   0.824
  316    HG2  ARG  40           HG2      ARG  40   7.907  -1.201   1.708
  317    HG3  ARG  40           HG3      ARG  40   9.400  -2.018   1.249
  318    HD2  ARG  40           HD2      ARG  40  10.680  -0.703   2.827
  319    HD3  ARG  40           HD3      ARG  40   9.285   0.320   3.185
  320    HE   ARG  40           HE       ARG  40   8.383  -1.361   4.501
  321   HH11  ARG  40          HH11      ARG  40  11.303  -2.568   2.953
  322   HH12  ARG  40          HH12      ARG  40  11.411  -3.962   3.973
  323   HH21  ARG  40          HH21      ARG  40   8.565  -3.165   5.863
  324   HH22  ARG  40          HH22      ARG  40   9.854  -4.305   5.630
  325    H    ASN  41           H        ASN  41   7.653  -2.442  -2.150
  326    HA   ASN  41           HA       ASN  41  10.064  -2.697  -3.835
  327    HB2  ASN  41           HB2      ASN  41  10.142  -5.156  -3.628
  328    HB3  ASN  41           HB3      ASN  41  10.456  -4.387  -2.081
  329   HD21  ASN  41          HD21      ASN  41   9.019  -4.670  -0.421
  330   HD22  ASN  41          HD22      ASN  41   7.703  -5.774  -0.471
  331    H    CYS  42           H        CYS  42   6.925  -2.100  -3.796
  332    HA   CYS  42           HA       CYS  42   5.770  -3.919  -5.673
  333    HB2  CYS  42           HB2      CYS  42   4.315  -2.586  -4.238
  334    HB3  CYS  42           HB3      CYS  42   4.959  -1.080  -4.887
  335    H    GLU  43           H        GLU  43   7.578  -0.926  -5.996
  336    HA   GLU  43           HA       GLU  43   7.855  -1.184  -8.861
  337    HB2  GLU  43           HB2      GLU  43   5.585  -0.167  -8.638
  338    HB3  GLU  43           HB3      GLU  43   6.271   1.159  -7.700
  339    HG2  GLU  43           HG2      GLU  43   7.555   1.910  -9.637
  340    HG3  GLU  43           HG3      GLU  43   6.980   0.535 -10.582
  341    H    SER  44           H        SER  44   7.933   1.235  -6.248
  342    HA   SER  44           HA       SER  44  10.565   2.215  -6.980
  343    HB2  SER  44           HB2      SER  44   8.771   2.877  -4.609
  344    HB3  SER  44           HB3      SER  44  10.241   3.753  -5.064
  345    HG   SER  44           HG       SER  44   8.851   3.709  -7.235
  Start of MODEL   12
    1    H1   ALA   1           H1       ALA   1  -2.627   4.508  12.974
    2    H2   ALA   1           H2       ALA   1  -3.965   4.174  13.941
    3    H3   ALA   1           H3       ALA   1  -3.133   5.638  14.122
    4    HA   ALA   1           HA       ALA   1  -5.215   5.940  12.929
    5    HB1  ALA   1           HB1      ALA   1  -4.266   7.227  11.045
    6    HB2  ALA   1           HB2      ALA   1  -2.736   6.364  11.218
    7    HB3  ALA   1           HB3      ALA   1  -3.290   7.436  12.502
    8    HA   PRO   2           HA       PRO   2  -6.456   2.544  10.272
    9    HB2  PRO   2           HB2      PRO   2  -8.459   3.669   8.779
   10    HB3  PRO   2           HB3      PRO   2  -8.632   3.368  10.522
   11    HG2  PRO   2           HG2      PRO   2  -7.905   5.940   9.135
   12    HG3  PRO   2           HG3      PRO   2  -9.077   5.674  10.447
   13    HD2  PRO   2           HD2      PRO   2  -6.589   6.609  10.937
   14    HD3  PRO   2           HD3      PRO   2  -7.428   5.543  12.085
   15    H    CYS   3           H        CYS   3  -4.221   2.748   9.263
   16    HA   CYS   3           HA       CYS   3  -2.988   2.237   7.486
   17    HB2  CYS   3           HB2      CYS   3  -5.283   1.134   6.832
   18    HB3  CYS   3           HB3      CYS   3  -5.373   2.426   5.646
   19    H    GLU   4           H        GLU   4  -3.599   5.073   8.239
   20    HA   GLU   4           HA       GLU   4  -3.917   6.711   5.963
   21    HB2  GLU   4           HB2      GLU   4  -2.772   7.335   8.712
   22    HB3  GLU   4           HB3      GLU   4  -3.152   8.558   7.506
   23    HG2  GLU   4           HG2      GLU   4  -5.141   6.688   8.829
   24    HG3  GLU   4           HG3      GLU   4  -4.912   8.393   9.212
   25    H    ASP   5           H        ASP   5  -1.019   5.796   7.813
   26    HA   ASP   5           HA       ASP   5   0.968   7.206   6.443
   27    HB2  ASP   5           HB2      ASP   5   1.393   6.130   8.594
   28    HB3  ASP   5           HB3      ASP   5   1.051   4.539   7.927
   29    H    LEU   6           H        LEU   6  -0.470   4.068   5.782
   30    HA   LEU   6           HA       LEU   6   1.240   3.330   3.594
   31    HB2  LEU   6           HB2      LEU   6  -0.044   1.810   5.196
   32    HB3  LEU   6           HB3      LEU   6  -1.491   2.228   4.312
   33    HG   LEU   6           HG       LEU   6   0.876   0.895   2.949
   34   HD11  LEU   6          HD11      LEU   6  -1.466  -0.472   4.270
   35   HD12  LEU   6          HD12      LEU   6   0.204  -0.480   4.839
   36   HD13  LEU   6          HD13      LEU   6  -0.203  -1.245   3.310
   37   HD21  LEU   6          HD21      LEU   6  -2.076   0.947   2.200
   38   HD22  LEU   6          HD22      LEU   6  -0.803   0.095   1.316
   39   HD23  LEU   6          HD23      LEU   6  -0.793   1.855   1.399
   40    H    LYS   7           H        LYS   7  -1.979   4.703   3.968
   41    HA   LYS   7           HA       LYS   7  -2.808   4.460   1.258
   42    HB2  LYS   7           HB2      LYS   7  -4.374   4.504   3.131
   43    HB3  LYS   7           HB3      LYS   7  -3.888   6.145   3.531
   44    HG2  LYS   7           HG2      LYS   7  -4.900   7.008   1.514
   45    HG3  LYS   7           HG3      LYS   7  -5.214   5.373   0.922
   46    HD2  LYS   7           HD2      LYS   7  -7.239   6.507   1.877
   47    HD3  LYS   7           HD3      LYS   7  -6.842   4.975   2.656
   48    HE2  LYS   7           HE2      LYS   7  -5.829   6.184   4.547
   49    HE3  LYS   7           HE3      LYS   7  -6.149   7.725   3.749
   50    HZ1  LYS   7           HZ1      LYS   7  -8.239   5.789   4.585
   51    HZ2  LYS   7           HZ2      LYS   7  -8.498   7.330   3.940
   52    HZ3  LYS   7           HZ3      LYS   7  -7.788   7.159   5.464
   53    H    GLU   8           H        GLU   8  -1.276   7.042   3.091
   54    HA   GLU   8           HA       GLU   8  -1.401   8.994   1.002
   55    HB2  GLU   8           HB2      GLU   8   0.086  10.358   2.309
   56    HB3  GLU   8           HB3      GLU   8  -1.074   9.622   3.411
   57    HG2  GLU   8           HG2      GLU   8   0.603   7.978   4.110
   58    HG3  GLU   8           HG3      GLU   8   1.767   8.651   2.969
   59    H    ARG   9           H        ARG   9   0.875   6.399   1.887
   60    HA   ARG   9           HA       ARG   9   3.021   7.099   0.178
   61    HB2  ARG   9           HB2      ARG   9   2.065   4.450   1.279
   62    HB3  ARG   9           HB3      ARG   9   3.404   4.501   0.141
   63    HG2  ARG   9           HG2      ARG   9   4.651   5.959   1.687
   64    HG3  ARG   9           HG3      ARG   9   3.319   5.863   2.846
   65    HD2  ARG   9           HD2      ARG   9   5.265   4.264   3.268
   66    HD3  ARG   9           HD3      ARG   9   3.665   3.524   3.188
   67    HE   ARG   9           HE       ARG   9   4.259   2.423   1.270
   68   HH11  ARG   9          HH11      ARG   9   6.836   4.729   1.982
   69   HH12  ARG   9          HH12      ARG   9   7.894   4.074   0.779
   70   HH21  ARG   9          HH21      ARG   9   5.651   1.667  -0.350
   71   HH22  ARG   9          HH22      ARG   9   7.220   2.358  -0.524
   72    H    LEU  10           H        LEU  10  -0.072   5.551  -0.485
   73    HA   LEU  10           HA       LEU  10   0.466   4.420  -3.011
   74    HB2  LEU  10           HB2      LEU  10  -2.169   5.584  -2.041
   75    HB3  LEU  10           HB3      LEU  10  -1.972   4.413  -3.335
   76    HG   LEU  10           HG       LEU  10  -1.422   3.914  -0.383
   77   HD11  LEU  10          HD11      LEU  10  -3.358   2.441  -0.466
   78   HD12  LEU  10          HD12      LEU  10  -3.647   2.884  -2.152
   79   HD13  LEU  10          HD13      LEU  10  -3.792   4.098  -0.877
   80   HD21  LEU  10          HD21      LEU  10  -1.087   1.556  -0.991
   81   HD22  LEU  10          HD22      LEU  10   0.120   2.590  -1.747
   82   HD23  LEU  10          HD23      LEU  10  -1.227   1.963  -2.703
   83    H    LYS  11           H        LYS  11  -0.853   7.594  -2.134
   84    HA   LYS  11           HA       LYS  11  -0.978   8.543  -4.857
   85    HB2  LYS  11           HB2      LYS  11  -1.913  10.592  -3.898
   86    HB3  LYS  11           HB3      LYS  11  -2.706   9.174  -3.224
   87    HG2  LYS  11           HG2      LYS  11  -1.281   9.388  -1.180
   88    HG3  LYS  11           HG3      LYS  11  -0.587  10.865  -1.856
   89    HD2  LYS  11           HD2      LYS  11  -2.900  11.871  -1.886
   90    HD3  LYS  11           HD3      LYS  11  -3.502  10.418  -1.082
   91    HE2  LYS  11           HE2      LYS  11  -1.959  10.872   0.816
   92    HE3  LYS  11           HE3      LYS  11  -1.440  12.358   0.018
   93    HZ1  LYS  11           HZ1      LYS  11  -4.175  11.735   0.977
   94    HZ2  LYS  11           HZ2      LYS  11  -3.737  13.136   0.142
   95    HZ3  LYS  11           HZ3      LYS  11  -3.091  12.833   1.673
   96    H    LYS  12           H        LYS  12   1.242   8.836  -2.165
   97    HA   LYS  12           HA       LYS  12   2.580  11.228  -3.052
   98    HB2  LYS  12           HB2      LYS  12   2.449  10.536  -0.658
   99    HB3  LYS  12           HB3      LYS  12   3.474   9.151  -1.026
  100    HG2  LYS  12           HG2      LYS  12   5.295  10.767  -1.710
  101    HG3  LYS  12           HG3      LYS  12   4.259  12.084  -1.150
  102    HD2  LYS  12           HD2      LYS  12   5.291   9.793   0.543
  103    HD3  LYS  12           HD3      LYS  12   5.929  11.435   0.555
  104    HE2  LYS  12           HE2      LYS  12   3.749  12.267   1.398
  105    HE3  LYS  12           HE3      LYS  12   3.117  10.619   1.382
  106    HZ1  LYS  12           HZ1      LYS  12   3.822  11.286   3.594
  107    HZ2  LYS  12           HZ2      LYS  12   5.398  11.570   3.044
  108    HZ3  LYS  12           HZ3      LYS  12   4.766  10.002   3.030
  109    H    LEU  13           H        LEU  13   3.233   7.765  -3.147
  110    HA   LEU  13           HA       LEU  13   5.823   8.006  -4.386
  111    HB2  LEU  13           HB2      LEU  13   5.141   6.178  -2.813
  112    HB3  LEU  13           HB3      LEU  13   4.001   5.599  -4.012
  113    HG   LEU  13           HG       LEU  13   5.907   5.031  -5.526
  114   HD11  LEU  13          HD11      LEU  13   7.544   6.675  -4.753
  115   HD12  LEU  13          HD12      LEU  13   8.201   5.041  -4.676
  116   HD13  LEU  13          HD13      LEU  13   7.664   5.846  -3.198
  117   HD21  LEU  13          HD21      LEU  13   6.009   3.807  -2.757
  118   HD22  LEU  13          HD22      LEU  13   6.738   3.105  -4.203
  119   HD23  LEU  13          HD23      LEU  13   4.990   3.299  -4.107
  120    H    GLY  14           H        GLY  14   2.490   7.729  -5.397
  121    HA2  GLY  14           HA2      GLY  14   1.443   7.803  -7.427
  122    HA3  GLY  14           HA3      GLY  14   2.959   8.385  -8.100
  123    H    MET  15           H        MET  15   1.970   5.283  -6.626
  124    HA   MET  15           HA       MET  15   3.447   3.697  -8.498
  125    HB2  MET  15           HB2      MET  15   2.587   1.809  -7.130
  126    HB3  MET  15           HB3      MET  15   3.264   3.077  -6.116
  127    HG2  MET  15           HG2      MET  15   0.951   3.902  -5.663
  128    HG3  MET  15           HG3      MET  15   0.321   2.579  -6.621
  129    HE1  MET  15           HE1      MET  15   2.643   1.791  -2.691
  130    HE2  MET  15           HE2      MET  15   2.449   3.422  -3.342
  131    HE3  MET  15           HE3      MET  15   3.446   2.239  -4.193
  132    H    SER  16           H        SER  16   1.998   1.577  -9.164
  133    HA   SER  16           HA       SER  16   0.109   2.390 -11.125
  134    HB2  SER  16           HB2      SER  16   0.591  -0.386  -9.946
  135    HB3  SER  16           HB3      SER  16  -0.228  -0.034 -11.469
  136    HG   SER  16           HG       SER  16   1.646   0.196 -12.408
  137    H    GLU  17           H        GLU  17  -2.201   2.160 -11.117
  138    HA   GLU  17           HA       GLU  17  -3.652   2.448  -8.709
  139    HB2  GLU  17           HB2      GLU  17  -4.632   1.419 -11.413
  140    HB3  GLU  17           HB3      GLU  17  -5.680   1.900 -10.074
  141    HG2  GLU  17           HG2      GLU  17  -4.711   4.186 -10.191
  142    HG3  GLU  17           HG3      GLU  17  -3.782   3.687 -11.605
  143    H    GLU  18           H        GLU  18  -2.914  -0.345 -10.732
  144    HA   GLU  18           HA       GLU  18  -4.186  -2.408  -9.411
  145    HB2  GLU  18           HB2      GLU  18  -3.041  -2.632 -11.585
  146    HB3  GLU  18           HB3      GLU  18  -1.479  -2.423 -10.800
  147    HG2  GLU  18           HG2      GLU  18  -1.934  -4.537  -9.500
  148    HG3  GLU  18           HG3      GLU  18  -3.397  -4.756 -10.464
  149    H    CYS  19           H        CYS  19  -1.048  -0.848  -8.711
  150    HA   CYS  19           HA       CYS  19  -0.098  -2.648  -6.747
  151    HB2  CYS  19           HB2      CYS  19   1.294  -0.762  -7.869
  152    HB3  CYS  19           HB3      CYS  19   0.441   0.362  -6.834
  153    H    ARG  20           H        ARG  20  -1.897   0.441  -6.494
  154    HA   ARG  20           HA       ARG  20  -2.176   0.661  -3.729
  155    HB2  ARG  20           HB2      ARG  20  -4.266   1.433  -5.816
  156    HB3  ARG  20           HB3      ARG  20  -4.156   2.047  -4.167
  157    HG2  ARG  20           HG2      ARG  20  -1.981   3.104  -4.772
  158    HG3  ARG  20           HG3      ARG  20  -2.249   2.590  -6.450
  159    HD2  ARG  20           HD2      ARG  20  -4.180   4.248  -4.822
  160    HD3  ARG  20           HD3      ARG  20  -3.014   4.929  -5.961
  161    HE   ARG  20           HE       ARG  20  -4.789   2.963  -7.121
  162   HH11  ARG  20          HH11      ARG  20  -4.493   6.392  -6.317
  163   HH12  ARG  20          HH12      ARG  20  -5.671   6.883  -7.489
  164   HH21  ARG  20          HH21      ARG  20  -6.363   3.660  -8.631
  165   HH22  ARG  20          HH22      ARG  20  -6.722   5.351  -8.788
  166    H    GLN  21           H        GLN  21  -4.415  -0.795  -6.080
  167    HA   GLN  21           HA       GLN  21  -6.463  -1.385  -4.288
  168    HB2  GLN  21           HB2      GLN  21  -5.810  -2.535  -7.031
  169    HB3  GLN  21           HB3      GLN  21  -7.282  -2.963  -6.160
  170    HG2  GLN  21           HG2      GLN  21  -8.074  -0.698  -6.215
  171    HG3  GLN  21           HG3      GLN  21  -6.536  -0.106  -6.841
  172   HE21  GLN  21          HE21      GLN  21  -6.059  -0.400  -9.022
  173   HE22  GLN  21          HE22      GLN  21  -7.240  -0.851 -10.184
  174    H    ARG  22           H        ARG  22  -3.605  -3.200  -5.195
  175    HA   ARG  22           HA       ARG  22  -4.167  -5.658  -3.870
  176    HB2  ARG  22           HB2      ARG  22  -1.589  -4.325  -4.779
  177    HB3  ARG  22           HB3      ARG  22  -1.580  -5.884  -3.981
  178    HG2  ARG  22           HG2      ARG  22  -2.947  -6.831  -5.797
  179    HG3  ARG  22           HG3      ARG  22  -2.979  -5.256  -6.596
  180    HD2  ARG  22           HD2      ARG  22  -0.518  -5.344  -6.856
  181    HD3  ARG  22           HD3      ARG  22  -0.488  -6.916  -6.045
  182    HE   ARG  22           HE       ARG  22  -2.238  -7.188  -8.168
  183   HH11  ARG  22          HH11      ARG  22   1.190  -6.436  -7.821
  184   HH12  ARG  22          HH12      ARG  22   1.609  -7.109  -9.363
  185   HH21  ARG  22          HH21      ARG  22  -1.672  -8.031 -10.193
  186   HH22  ARG  22          HH22      ARG  22  -0.017  -8.014 -10.711
  187    H    LEU  23           H        LEU  23  -2.558  -2.626  -2.932
  188    HA   LEU  23           HA       LEU  23  -1.425  -3.646  -0.489
  189    HB2  LEU  23           HB2      LEU  23  -1.655  -0.855  -1.635
  190    HB3  LEU  23           HB3      LEU  23  -0.697  -1.260  -0.227
  191    HG   LEU  23           HG       LEU  23  -0.256  -2.312  -3.033
  192   HD11  LEU  23          HD11      LEU  23   1.824  -1.047  -2.999
  193   HD12  LEU  23          HD12      LEU  23   1.371  -0.359  -1.438
  194   HD13  LEU  23          HD13      LEU  23   0.401  -0.015  -2.872
  195   HD21  LEU  23          HD21      LEU  23   1.790  -3.357  -2.190
  196   HD22  LEU  23          HD22      LEU  23   0.355  -4.031  -1.430
  197   HD23  LEU  23          HD23      LEU  23   1.366  -2.887  -0.542
  198    H    GLU  24           H        GLU  24  -3.981  -1.261  -1.182
  199    HA   GLU  24           HA       GLU  24  -4.987  -0.699   1.295
  200    HB2  GLU  24           HB2      GLU  24  -6.561  -1.191  -1.272
  201    HB3  GLU  24           HB3      GLU  24  -7.204  -0.381   0.155
  202    HG2  GLU  24           HG2      GLU  24  -5.678   1.461  -0.118
  203    HG3  GLU  24           HG3      GLU  24  -4.832   0.630  -1.429
  204    H    LYS  25           H        LYS  25  -5.573  -3.524  -0.758
  205    HA   LYS  25           HA       LYS  25  -7.638  -4.686   0.799
  206    HB2  LYS  25           HB2      LYS  25  -7.039  -5.120  -1.679
  207    HB3  LYS  25           HB3      LYS  25  -5.787  -6.197  -1.076
  208    HG2  LYS  25           HG2      LYS  25  -7.762  -7.471  -1.698
  209    HG3  LYS  25           HG3      LYS  25  -7.522  -7.566   0.053
  210    HD2  LYS  25           HD2      LYS  25  -9.279  -5.972   0.459
  211    HD3  LYS  25           HD3      LYS  25  -9.398  -5.571  -1.258
  212    HE2  LYS  25           HE2      LYS  25 -11.259  -6.992  -0.567
  213    HE3  LYS  25           HE3      LYS  25 -10.238  -7.833  -1.732
  214    HZ1  LYS  25           HZ1      LYS  25 -10.175  -8.230   1.214
  215    HZ2  LYS  25           HZ2      LYS  25  -9.237  -9.072   0.091
  216    HZ3  LYS  25           HZ3      LYS  25 -10.917  -9.266   0.104
  217    H    MET  26           H        MET  26  -4.173  -5.456   0.418
  218    HA   MET  26           HA       MET  26  -3.897  -7.497   2.300
  219    HB2  MET  26           HB2      MET  26  -1.966  -5.404   1.245
  220    HB3  MET  26           HB3      MET  26  -1.443  -6.637   2.379
  221    HG2  MET  26           HG2      MET  26  -2.719  -7.331  -0.264
  222    HG3  MET  26           HG3      MET  26  -0.985  -7.056  -0.090
  223    HE1  MET  26           HE1      MET  26   0.046  -9.944   2.374
  224    HE2  MET  26           HE2      MET  26  -0.442  -8.324   2.872
  225    HE3  MET  26           HE3      MET  26   0.598  -8.539   1.462
  226    H    CYS  27           H        CYS  27  -3.880  -3.997   2.729
  227    HA   CYS  27           HA       CYS  27  -3.037  -3.906   5.449
  228    HB2  CYS  27           HB2      CYS  27  -2.839  -1.961   3.944
  229    HB3  CYS  27           HB3      CYS  27  -4.591  -1.869   3.807
  230    H    LYS  28           H        LYS  28  -6.174  -4.071   3.840
  231    HA   LYS  28           HA       LYS  28  -7.732  -3.766   6.243
  232    HB2  LYS  28           HB2      LYS  28  -8.478  -4.510   3.389
  233    HB3  LYS  28           HB3      LYS  28  -9.664  -4.416   4.687
  234    HG2  LYS  28           HG2      LYS  28  -9.171  -2.034   5.012
  235    HG3  LYS  28           HG3      LYS  28  -7.920  -2.094   3.770
  236    HD2  LYS  28           HD2      LYS  28 -10.876  -2.648   3.280
  237    HD3  LYS  28           HD3      LYS  28 -10.098  -1.095   2.977
  238    HE2  LYS  28           HE2      LYS  28  -8.634  -2.157   1.291
  239    HE3  LYS  28           HE3      LYS  28  -9.404  -3.718   1.601
  240    HZ1  LYS  28           HZ1      LYS  28 -10.316  -2.645  -0.360
  241    HZ2  LYS  28           HZ2      LYS  28 -10.763  -1.291   0.550
  242    HZ3  LYS  28           HZ3      LYS  28 -11.504  -2.781   0.836
  243    H    GLU  29           H        GLU  29  -6.360  -6.481   4.482
  244    HA   GLU  29           HA       GLU  29  -7.989  -8.521   5.712
  245    HB2  GLU  29           HB2      GLU  29  -5.234  -8.875   4.455
  246    HB3  GLU  29           HB3      GLU  29  -6.418 -10.139   4.762
  247    HG2  GLU  29           HG2      GLU  29  -6.501  -7.972   2.670
  248    HG3  GLU  29           HG3      GLU  29  -6.428  -9.703   2.430
  249    H    GLY  30           H        GLY  30  -4.535  -7.636   6.047
  250    HA2  GLY  30           HA2      GLY  30  -4.489  -8.711   8.804
  251    HA3  GLY  30           HA3      GLY  30  -3.091  -8.354   7.800
  252    H    THR  31           H        THR  31  -2.085  -6.503   8.098
  253    HA   THR  31           HA       THR  31  -3.438  -4.189   9.310
  254    HB   THR  31           HB       THR  31  -1.434  -3.712  10.725
  255    HG1  THR  31           HG1      THR  31  -0.566  -6.158   9.627
  256   HG21  THR  31          HG21      THR  31  -3.305  -4.946  11.788
  257   HG22  THR  31          HG22      THR  31  -1.749  -5.441  12.455
  258   HG23  THR  31          HG23      THR  31  -2.564  -6.473  11.281
  259    H    SER  32           H        SER  32  -1.956  -2.244   9.154
  260    HA   SER  32           HA       SER  32  -1.246  -1.634   6.529
  261    HB2  SER  32           HB2      SER  32  -0.333  -0.269   9.099
  262    HB3  SER  32           HB3      SER  32  -0.238   0.427   7.480
  263    HG   SER  32           HG       SER  32  -2.533   0.181   7.382
  264    H    GLU  33           H        GLU  33   0.601  -3.109   9.101
  265    HA   GLU  33           HA       GLU  33   3.214  -2.406   8.314
  266    HB2  GLU  33           HB2      GLU  33   2.322  -4.836   9.921
  267    HB3  GLU  33           HB3      GLU  33   3.960  -4.178   9.856
  268    HG2  GLU  33           HG2      GLU  33   3.129  -2.059  10.857
  269    HG3  GLU  33           HG3      GLU  33   1.516  -2.764  10.977
  270    H    ASP  34           H        ASP  34   1.158  -5.169   7.457
  271    HA   ASP  34           HA       ASP  34   3.116  -6.746   6.117
  272    HB2  ASP  34           HB2      ASP  34   0.107  -6.699   5.568
  273    HB3  ASP  34           HB3      ASP  34   1.225  -8.006   5.177
  274    H    ALA  35           H        ALA  35   0.660  -4.491   4.966
  275    HA   ALA  35           HA       ALA  35   1.223  -4.911   2.192
  276    HB1  ALA  35           HB1      ALA  35  -0.578  -3.292   1.829
  277    HB2  ALA  35           HB2      ALA  35  -0.592  -2.921   3.554
  278    HB3  ALA  35           HB3      ALA  35  -1.044  -4.528   3.000
  279    H    GLU  36           H        GLU  36   2.194  -2.482   4.579
  280    HA   GLU  36           HA       GLU  36   3.002  -0.456   2.734
  281    HB2  GLU  36           HB2      GLU  36   4.186   0.594   4.578
  282    HB3  GLU  36           HB3      GLU  36   2.642  -0.001   5.173
  283    HG2  GLU  36           HG2      GLU  36   3.725  -1.914   6.204
  284    HG3  GLU  36           HG3      GLU  36   5.286  -1.439   5.542
  285    H    ARG  37           H        ARG  37   4.590  -3.300   4.097
  286    HA   ARG  37           HA       ARG  37   7.202  -2.868   3.099
  287    HB2  ARG  37           HB2      ARG  37   6.622  -4.547   4.850
  288    HB3  ARG  37           HB3      ARG  37   5.767  -5.502   3.642
  289    HG2  ARG  37           HG2      ARG  37   7.867  -5.892   2.435
  290    HG3  ARG  37           HG3      ARG  37   8.732  -4.865   3.578
  291    HD2  ARG  37           HD2      ARG  37   8.188  -6.454   5.398
  292    HD3  ARG  37           HD3      ARG  37   7.361  -7.493   4.228
  293    HE   ARG  37           HE       ARG  37  10.007  -6.957   3.364
  294   HH11  ARG  37          HH11      ARG  37   8.292  -8.904   5.745
  295   HH12  ARG  37          HH12      ARG  37   9.522 -10.120   5.811
  296   HH21  ARG  37          HH21      ARG  37  11.607  -8.573   3.442
  297   HH22  ARG  37          HH22      ARG  37  11.404  -9.931   4.503
  298    H    MET  38           H        MET  38   4.338  -4.503   1.777
  299    HA   MET  38           HA       MET  38   5.491  -5.321  -0.672
  300    HB2  MET  38           HB2      MET  38   2.549  -4.803  -0.083
  301    HB3  MET  38           HB3      MET  38   3.211  -5.844  -1.336
  302    HG2  MET  38           HG2      MET  38   3.232  -6.315   1.653
  303    HG3  MET  38           HG3      MET  38   2.390  -7.253   0.421
  304    HE1  MET  38           HE1      MET  38   5.506  -8.901  -1.421
  305    HE2  MET  38           HE2      MET  38   4.802  -7.327  -1.793
  306    HE3  MET  38           HE3      MET  38   3.754  -8.705  -1.449
  307    H    ALA  39           H        ALA  39   4.118  -2.307   0.454
  308    HA   ALA  39           HA       ALA  39   3.815  -1.015  -2.082
  309    HB1  ALA  39           HB1      ALA  39   4.225   0.210   0.671
  310    HB2  ALA  39           HB2      ALA  39   2.669  -0.210  -0.044
  311    HB3  ALA  39           HB3      ALA  39   3.654   1.060  -0.771
  312    H    ARG  40           H        ARG  40   6.412  -1.336   0.269
  313    HA   ARG  40           HA       ARG  40   8.284   0.370  -1.082
  314    HB2  ARG  40           HB2      ARG  40   8.749  -1.723   1.082
  315    HB3  ARG  40           HB3      ARG  40   9.921  -0.512   0.564
  316    HG2  ARG  40           HG2      ARG  40   8.379   1.280   1.338
  317    HG3  ARG  40           HG3      ARG  40   7.256   0.045   1.898
  318    HD2  ARG  40           HD2      ARG  40   8.435   0.767   3.823
  319    HD3  ARG  40           HD3      ARG  40   9.141  -0.795   3.397
  320    HE   ARG  40           HE       ARG  40  10.688   1.107   2.125
  321   HH11  ARG  40          HH11      ARG  40   9.895   0.343   5.484
  322   HH12  ARG  40          HH12      ARG  40  11.391   0.972   6.097
  323   HH21  ARG  40          HH21      ARG  40  12.616   1.941   2.954
  324   HH22  ARG  40          HH22      ARG  40  12.932   1.880   4.656
  325    H    ASN  41           H        ASN  41   7.288  -2.945  -1.307
  326    HA   ASN  41           HA       ASN  41   9.576  -3.883  -2.861
  327    HB2  ASN  41           HB2      ASN  41   6.933  -5.151  -2.031
  328    HB3  ASN  41           HB3      ASN  41   7.979  -5.931  -3.208
  329   HD21  ASN  41          HD21      ASN  41   9.208  -4.151  -0.379
  330   HD22  ASN  41          HD22      ASN  41   9.791  -5.553   0.435
  331    H    CYS  42           H        CYS  42   6.451  -2.491  -3.359
  332    HA   CYS  42           HA       CYS  42   5.990  -3.069  -6.084
  333    HB2  CYS  42           HB2      CYS  42   4.307  -2.146  -4.414
  334    HB3  CYS  42           HB3      CYS  42   5.094  -0.581  -4.555
  335    H    GLU  43           H        GLU  43   7.124   0.016  -4.628
  336    HA   GLU  43           HA       GLU  43   9.015   0.375  -6.874
  337    HB2  GLU  43           HB2      GLU  43   7.229   2.515  -5.646
  338    HB3  GLU  43           HB3      GLU  43   8.522   2.851  -6.785
  339    HG2  GLU  43           HG2      GLU  43   6.114   1.115  -7.421
  340    HG3  GLU  43           HG3      GLU  43   6.190   2.845  -7.754
  341    H    SER  44           H        SER  44   8.206   2.130  -3.826
  342    HA   SER  44           HA       SER  44  10.911   1.820  -2.791
  343    HB2  SER  44           HB2      SER  44   9.905   4.562  -3.698
  344    HB3  SER  44           HB3      SER  44  11.407   4.258  -2.817
  345    HG   SER  44           HG       SER  44  11.582   2.698  -4.844
  Start of MODEL   13
    1    H1   ALA   1           H1       ALA   1  -4.280   4.534  13.736
    2    H2   ALA   1           H2       ALA   1  -5.929   4.556  13.374
    3    H3   ALA   1           H3       ALA   1  -5.101   6.007  13.647
    4    HA   ALA   1           HA       ALA   1  -5.525   5.663  11.307
    5    HB1  ALA   1           HB1      ALA   1  -3.243   6.083  10.505
    6    HB2  ALA   1           HB2      ALA   1  -2.585   5.477  12.030
    7    HB3  ALA   1           HB3      ALA   1  -3.553   6.949  12.011
    8    HA   PRO   2           HA       PRO   2  -5.268   1.101  10.599
    9    HB2  PRO   2           HB2      PRO   2  -7.308   1.589   8.496
   10    HB3  PRO   2           HB3      PRO   2  -7.430   0.589   9.955
   11    HG2  PRO   2           HG2      PRO   2  -8.803   2.904   9.705
   12    HG3  PRO   2           HG3      PRO   2  -8.190   2.331  11.273
   13    HD2  PRO   2           HD2      PRO   2  -7.005   4.425   9.444
   14    HD3  PRO   2           HD3      PRO   2  -7.214   4.457  11.212
   15    H    CYS   3           H        CYS   3  -6.061   2.941   7.635
   16    HA   CYS   3           HA       CYS   3  -3.646   1.844   6.297
   17    HB2  CYS   3           HB2      CYS   3  -6.392   2.368   5.061
   18    HB3  CYS   3           HB3      CYS   3  -4.991   1.676   4.242
   19    H    GLU   4           H        GLU   4  -4.532   4.589   7.636
   20    HA   GLU   4           HA       GLU   4  -4.676   6.542   5.594
   21    HB2  GLU   4           HB2      GLU   4  -3.739   6.815   8.481
   22    HB3  GLU   4           HB3      GLU   4  -4.146   8.166   7.425
   23    HG2  GLU   4           HG2      GLU   4  -6.488   7.247   7.251
   24    HG3  GLU   4           HG3      GLU   4  -6.040   6.013   8.429
   25    H    ASP   5           H        ASP   5  -1.913   5.377   7.522
   26    HA   ASP   5           HA       ASP   5   0.126   6.987   6.427
   27    HB2  ASP   5           HB2      ASP   5   0.430   4.168   7.563
   28    HB3  ASP   5           HB3      ASP   5   1.713   5.366   7.398
   29    H    LEU   6           H        LEU   6  -1.154   3.868   5.592
   30    HA   LEU   6           HA       LEU   6   0.695   3.011   3.674
   31    HB2  LEU   6           HB2      LEU   6  -0.794   1.524   4.938
   32    HB3  LEU   6           HB3      LEU   6  -2.207   2.266   4.237
   33    HG   LEU   6           HG       LEU   6  -1.484  -0.116   3.441
   34   HD11  LEU   6          HD11      LEU   6  -2.361   0.204   1.198
   35   HD12  LEU   6          HD12      LEU   6  -2.147   1.950   1.341
   36   HD13  LEU   6          HD13      LEU   6  -3.297   1.117   2.385
   37   HD21  LEU   6          HD21      LEU   6   0.097  -0.255   1.600
   38   HD22  LEU   6          HD22      LEU   6   0.896   0.410   3.022
   39   HD23  LEU   6          HD23      LEU   6   0.425   1.479   1.700
   40    H    LYS   7           H        LYS   7  -2.525   4.619   3.308
   41    HA   LYS   7           HA       LYS   7  -2.601   4.417   0.468
   42    HB2  LYS   7           HB2      LYS   7  -4.252   6.077   2.405
   43    HB3  LYS   7           HB3      LYS   7  -4.579   6.002   0.672
   44    HG2  LYS   7           HG2      LYS   7  -5.002   3.586   0.826
   45    HG3  LYS   7           HG3      LYS   7  -4.603   3.607   2.548
   46    HD2  LYS   7           HD2      LYS   7  -7.048   3.591   2.222
   47    HD3  LYS   7           HD3      LYS   7  -6.530   5.094   2.989
   48    HE2  LYS   7           HE2      LYS   7  -6.733   6.285   0.854
   49    HE3  LYS   7           HE3      LYS   7  -7.130   4.781   0.023
   50    HZ1  LYS   7           HZ1      LYS   7  -8.765   6.152   2.088
   51    HZ2  LYS   7           HZ2      LYS   7  -9.118   4.630   1.448
   52    HZ3  LYS   7           HZ3      LYS   7  -9.123   5.985   0.441
   53    H    GLU   8           H        GLU   8  -1.713   7.069   2.667
   54    HA   GLU   8           HA       GLU   8  -1.401   9.107   0.748
   55    HB2  GLU   8           HB2      GLU   8   0.002   8.694   3.415
   56    HB3  GLU   8           HB3      GLU   8   0.129  10.174   2.466
   57    HG2  GLU   8           HG2      GLU   8  -2.452   9.030   3.547
   58    HG3  GLU   8           HG3      GLU   8  -1.519  10.303   4.330
   59    H    ARG   9           H        ARG   9   0.863   6.720   2.027
   60    HA   ARG   9           HA       ARG   9   3.233   7.514   0.766
   61    HB2  ARG   9           HB2      ARG   9   2.888   5.855   2.688
   62    HB3  ARG   9           HB3      ARG   9   2.451   4.663   1.470
   63    HG2  ARG   9           HG2      ARG   9   4.700   4.902   0.447
   64    HG3  ARG   9           HG3      ARG   9   5.114   6.108   1.667
   65    HD2  ARG   9           HD2      ARG   9   4.562   3.164   2.090
   66    HD3  ARG   9           HD3      ARG   9   6.075   4.036   2.370
   67    HE   ARG   9           HE       ARG   9   4.028   5.157   3.977
   68   HH11  ARG   9          HH11      ARG   9   6.063   2.295   3.844
   69   HH12  ARG   9          HH12      ARG   9   5.951   2.007   5.550
   70   HH21  ARG   9          HH21      ARG   9   3.838   4.699   6.197
   71   HH22  ARG   9          HH22      ARG   9   4.701   3.354   6.873
   72    H    LEU  10           H        LEU  10   0.514   5.517  -0.308
   73    HA   LEU  10           HA       LEU  10   1.676   4.332  -2.604
   74    HB2  LEU  10           HB2      LEU  10  -1.275   5.011  -2.224
   75    HB3  LEU  10           HB3      LEU  10  -0.609   3.812  -3.322
   76    HG   LEU  10           HG       LEU  10  -0.800   3.668  -0.303
   77   HD11  LEU  10          HD11      LEU  10  -1.871   1.806  -2.410
   78   HD12  LEU  10          HD12      LEU  10  -2.797   3.016  -1.521
   79   HD13  LEU  10          HD13      LEU  10  -2.074   1.659  -0.666
   80   HD21  LEU  10          HD21      LEU  10   0.397   1.518  -0.366
   81   HD22  LEU  10          HD22      LEU  10   1.426   2.867  -0.829
   82   HD23  LEU  10          HD23      LEU  10   0.786   1.784  -2.066
   83    H    LYS  11           H        LYS  11  -0.156   7.314  -2.106
   84    HA   LYS  11           HA       LYS  11  -0.196   8.076  -4.891
   85    HB2  LYS  11           HB2      LYS  11  -1.014   9.581  -2.384
   86    HB3  LYS  11           HB3      LYS  11  -1.303  10.150  -4.031
   87    HG2  LYS  11           HG2      LYS  11  -2.743   8.221  -4.494
   88    HG3  LYS  11           HG3      LYS  11  -2.400   7.537  -2.901
   89    HD2  LYS  11           HD2      LYS  11  -3.767  10.220  -3.359
   90    HD3  LYS  11           HD3      LYS  11  -4.629   8.707  -3.069
   91    HE2  LYS  11           HE2      LYS  11  -3.728   8.521  -0.841
   92    HE3  LYS  11           HE3      LYS  11  -2.584   9.837  -1.123
   93    HZ1  LYS  11           HZ1      LYS  11  -4.523  10.503   0.198
   94    HZ2  LYS  11           HZ2      LYS  11  -5.539  10.148  -1.105
   95    HZ3  LYS  11           HZ3      LYS  11  -4.381  11.384  -1.236
   96    H    LYS  12           H        LYS  12   1.870   8.722  -2.159
   97    HA   LYS  12           HA       LYS  12   3.196  11.041  -3.237
   98    HB2  LYS  12           HB2      LYS  12   2.924  10.279  -0.726
   99    HB3  LYS  12           HB3      LYS  12   4.339   9.287  -1.024
  100    HG2  LYS  12           HG2      LYS  12   4.254  12.301  -1.404
  101    HG3  LYS  12           HG3      LYS  12   4.787  11.520   0.084
  102    HD2  LYS  12           HD2      LYS  12   6.646  10.429  -1.193
  103    HD3  LYS  12           HD3      LYS  12   6.098  11.254  -2.653
  104    HE2  LYS  12           HE2      LYS  12   6.483  13.443  -1.425
  105    HE3  LYS  12           HE3      LYS  12   7.273  12.505  -0.157
  106    HZ1  LYS  12           HZ1      LYS  12   8.862  11.710  -1.800
  107    HZ2  LYS  12           HZ2      LYS  12   8.863  13.397  -1.731
  108    HZ3  LYS  12           HZ3      LYS  12   8.096  12.608  -3.010
  109    H    LEU  13           H        LEU  13   3.916   7.554  -3.016
  110    HA   LEU  13           HA       LEU  13   6.346   7.677  -4.547
  111    HB2  LEU  13           HB2      LEU  13   4.500   5.309  -3.985
  112    HB3  LEU  13           HB3      LEU  13   6.082   5.183  -4.739
  113    HG   LEU  13           HG       LEU  13   5.535   6.058  -1.870
  114   HD11  LEU  13          HD11      LEU  13   5.197   3.660  -2.191
  115   HD12  LEU  13          HD12      LEU  13   6.625   3.966  -1.208
  116   HD13  LEU  13          HD13      LEU  13   6.806   3.501  -2.903
  117   HD21  LEU  13          HD21      LEU  13   8.218   5.762  -3.273
  118   HD22  LEU  13          HD22      LEU  13   7.979   6.053  -1.547
  119   HD23  LEU  13          HD23      LEU  13   7.477   7.268  -2.718
  120    H    GLY  14           H        GLY  14   2.959   7.657  -5.287
  121    HA2  GLY  14           HA2      GLY  14   1.794   7.975  -7.219
  122    HA3  GLY  14           HA3      GLY  14   3.311   8.467  -7.964
  123    H    MET  15           H        MET  15   2.078   5.428  -6.624
  124    HA   MET  15           HA       MET  15   3.718   3.884  -8.431
  125    HB2  MET  15           HB2      MET  15   3.165   2.040  -6.992
  126    HB3  MET  15           HB3      MET  15   3.402   3.444  -5.959
  127    HG2  MET  15           HG2      MET  15   0.771   3.668  -6.191
  128    HG3  MET  15           HG3      MET  15   0.878   1.957  -6.593
  129    HE1  MET  15           HE1      MET  15   2.979   1.061  -3.141
  130    HE2  MET  15           HE2      MET  15   3.760   1.965  -4.438
  131    HE3  MET  15           HE3      MET  15   2.805   0.527  -4.809
  132    H    SER  16           H        SER  16   2.377   1.584  -8.921
  133    HA   SER  16           HA       SER  16   0.504   2.098 -11.005
  134    HB2  SER  16           HB2      SER  16   1.159  -0.497  -9.526
  135    HB3  SER  16           HB3      SER  16   0.308  -0.379 -11.069
  136    HG   SER  16           HG       SER  16   2.603  -0.852 -11.189
  137    H    GLU  17           H        GLU  17  -1.710   2.127 -10.916
  138    HA   GLU  17           HA       GLU  17  -3.201   2.447  -8.578
  139    HB2  GLU  17           HB2      GLU  17  -4.221   1.495 -11.303
  140    HB3  GLU  17           HB3      GLU  17  -5.251   1.995  -9.974
  141    HG2  GLU  17           HG2      GLU  17  -5.221   3.856 -11.375
  142    HG3  GLU  17           HG3      GLU  17  -4.066   4.269 -10.109
  143    H    GLU  18           H        GLU  18  -2.374  -0.473 -10.365
  144    HA   GLU  18           HA       GLU  18  -4.274  -2.244  -9.199
  145    HB2  GLU  18           HB2      GLU  18  -3.255  -2.778 -11.366
  146    HB3  GLU  18           HB3      GLU  18  -1.646  -2.787 -10.646
  147    HG2  GLU  18           HG2      GLU  18  -2.312  -4.763  -9.255
  148    HG3  GLU  18           HG3      GLU  18  -3.881  -4.770 -10.057
  149    H    CYS  19           H        CYS  19  -0.888  -1.356  -8.523
  150    HA   CYS  19           HA       CYS  19  -0.281  -3.113  -6.436
  151    HB2  CYS  19           HB2      CYS  19   0.608  -0.246  -7.003
  152    HB3  CYS  19           HB3      CYS  19   1.224  -1.152  -5.637
  153    H    ARG  20           H        ARG  20  -1.775   0.139  -6.327
  154    HA   ARG  20           HA       ARG  20  -2.044   0.443  -3.571
  155    HB2  ARG  20           HB2      ARG  20  -3.993   1.413  -5.713
  156    HB3  ARG  20           HB3      ARG  20  -3.888   2.008  -4.054
  157    HG2  ARG  20           HG2      ARG  20  -1.524   2.738  -4.584
  158    HG3  ARG  20           HG3      ARG  20  -1.879   2.370  -6.282
  159    HD2  ARG  20           HD2      ARG  20  -3.511   4.213  -4.534
  160    HD3  ARG  20           HD3      ARG  20  -2.256   4.750  -5.659
  161    HE   ARG  20           HE       ARG  20  -4.303   3.150  -6.896
  162   HH11  ARG  20          HH11      ARG  20  -3.471   6.416  -5.889
  163   HH12  ARG  20          HH12      ARG  20  -4.565   7.159  -7.009
  164   HH21  ARG  20          HH21      ARG  20  -5.753   4.169  -8.340
  165   HH22  ARG  20          HH22      ARG  20  -5.845   5.898  -8.383
  166    H    GLN  21           H        GLN  21  -4.405  -0.779  -5.912
  167    HA   GLN  21           HA       GLN  21  -6.536  -1.224  -4.228
  168    HB2  GLN  21           HB2      GLN  21  -5.752  -2.607  -6.831
  169    HB3  GLN  21           HB3      GLN  21  -7.308  -2.873  -6.045
  170    HG2  GLN  21           HG2      GLN  21  -7.936  -0.565  -6.330
  171    HG3  GLN  21           HG3      GLN  21  -6.323  -0.139  -6.904
  172   HE21  GLN  21          HE21      GLN  21  -5.748  -0.640  -9.030
  173   HE22  GLN  21          HE22      GLN  21  -6.890  -1.150 -10.215
  174    H    ARG  22           H        ARG  22  -3.754  -3.260  -4.887
  175    HA   ARG  22           HA       ARG  22  -4.559  -5.615  -3.479
  176    HB2  ARG  22           HB2      ARG  22  -1.841  -4.572  -4.384
  177    HB3  ARG  22           HB3      ARG  22  -2.046  -6.132  -3.620
  178    HG2  ARG  22           HG2      ARG  22  -3.396  -6.935  -5.457
  179    HG3  ARG  22           HG3      ARG  22  -3.425  -5.332  -6.194
  180    HD2  ARG  22           HD2      ARG  22  -1.020  -5.453  -6.630
  181    HD3  ARG  22           HD3      ARG  22  -0.909  -6.997  -5.779
  182    HE   ARG  22           HE       ARG  22  -2.770  -7.297  -7.827
  183   HH11  ARG  22          HH11      ARG  22   0.694  -6.663  -7.571
  184   HH12  ARG  22          HH12      ARG  22   1.055  -7.419  -9.089
  185   HH21  ARG  22          HH21      ARG  22  -2.261  -8.296  -9.786
  186   HH22  ARG  22          HH22      ARG  22  -0.621  -8.343 -10.342
  187    H    LEU  23           H        LEU  23  -2.730  -2.670  -2.638
  188    HA   LEU  23           HA       LEU  23  -1.566  -3.744  -0.222
  189    HB2  LEU  23           HB2      LEU  23  -1.667  -0.920  -1.350
  190    HB3  LEU  23           HB3      LEU  23  -0.637  -1.428  -0.030
  191    HG   LEU  23           HG       LEU  23  -0.505  -2.601  -2.817
  192   HD11  LEU  23          HD11      LEU  23   1.552  -1.346  -3.148
  193   HD12  LEU  23          HD12      LEU  23   1.291  -0.519  -1.608
  194   HD13  LEU  23          HD13      LEU  23   0.148  -0.303  -2.935
  195   HD21  LEU  23          HD21      LEU  23   1.594  -3.618  -2.129
  196   HD22  LEU  23          HD22      LEU  23   0.267  -4.167  -1.112
  197   HD23  LEU  23          HD23      LEU  23   1.412  -2.968  -0.500
  198    H    GLU  24           H        GLU  24  -4.003  -1.236  -0.905
  199    HA   GLU  24           HA       GLU  24  -4.903  -0.672   1.664
  200    HB2  GLU  24           HB2      GLU  24  -6.498  -0.728  -0.938
  201    HB3  GLU  24           HB3      GLU  24  -7.023   0.063   0.550
  202    HG2  GLU  24           HG2      GLU  24  -5.250   1.685   0.416
  203    HG3  GLU  24           HG3      GLU  24  -4.458   0.807  -0.892
  204    H    LYS  25           H        LYS  25  -5.583  -3.429  -0.437
  205    HA   LYS  25           HA       LYS  25  -7.754  -4.504   1.084
  206    HB2  LYS  25           HB2      LYS  25  -7.623  -5.098  -1.246
  207    HB3  LYS  25           HB3      LYS  25  -5.945  -5.603  -1.099
  208    HG2  LYS  25           HG2      LYS  25  -6.703  -7.510   0.349
  209    HG3  LYS  25           HG3      LYS  25  -8.374  -7.036   0.019
  210    HD2  LYS  25           HD2      LYS  25  -8.066  -7.476  -2.369
  211    HD3  LYS  25           HD3      LYS  25  -6.344  -7.799  -2.116
  212    HE2  LYS  25           HE2      LYS  25  -7.561  -9.896  -2.345
  213    HE3  LYS  25           HE3      LYS  25  -6.932  -9.737  -0.706
  214    HZ1  LYS  25           HZ1      LYS  25  -9.176 -10.563  -0.662
  215    HZ2  LYS  25           HZ2      LYS  25  -9.737  -9.251  -1.563
  216    HZ3  LYS  25           HZ3      LYS  25  -9.152  -9.007   0.004
  217    H    MET  26           H        MET  26  -4.256  -5.106   0.852
  218    HA   MET  26           HA       MET  26  -4.122  -7.269   2.683
  219    HB2  MET  26           HB2      MET  26  -2.002  -5.335   1.666
  220    HB3  MET  26           HB3      MET  26  -1.633  -6.685   2.740
  221    HG2  MET  26           HG2      MET  26  -2.826  -6.894  -0.039
  222    HG3  MET  26           HG3      MET  26  -1.172  -7.276   0.410
  223    HE1  MET  26           HE1      MET  26  -1.860 -10.417   2.797
  224    HE2  MET  26           HE2      MET  26  -1.833  -8.731   3.314
  225    HE3  MET  26           HE3      MET  26  -0.612  -9.332   2.189
  226    H    CYS  27           H        CYS  27  -4.111  -3.811   3.084
  227    HA   CYS  27           HA       CYS  27  -3.215  -3.684   5.798
  228    HB2  CYS  27           HB2      CYS  27  -3.041  -1.717   4.407
  229    HB3  CYS  27           HB3      CYS  27  -4.760  -1.746   4.035
  230    H    LYS  28           H        LYS  28  -6.434  -3.722   4.249
  231    HA   LYS  28           HA       LYS  28  -7.864  -3.297   6.740
  232    HB2  LYS  28           HB2      LYS  28  -8.882  -3.897   3.925
  233    HB3  LYS  28           HB3      LYS  28  -9.914  -3.473   5.293
  234    HG2  LYS  28           HG2      LYS  28  -8.891  -1.269   5.449
  235    HG3  LYS  28           HG3      LYS  28  -7.735  -1.675   4.176
  236    HD2  LYS  28           HD2      LYS  28  -9.714  -1.975   2.609
  237    HD3  LYS  28           HD3      LYS  28 -10.750  -1.341   3.892
  238    HE2  LYS  28           HE2      LYS  28  -9.461   0.773   3.866
  239    HE3  LYS  28           HE3      LYS  28  -8.436   0.124   2.580
  240    HZ1  LYS  28           HZ1      LYS  28 -11.366   0.613   2.387
  241    HZ2  LYS  28           HZ2      LYS  28 -10.394  -0.032   1.166
  242    HZ3  LYS  28           HZ3      LYS  28 -10.151   1.557   1.683
  243    H    GLU  29           H        GLU  29  -7.289  -5.972   4.530
  244    HA   GLU  29           HA       GLU  29  -8.879  -7.859   6.166
  245    HB2  GLU  29           HB2      GLU  29  -7.811  -8.148   3.312
  246    HB3  GLU  29           HB3      GLU  29  -8.754  -9.364   4.173
  247    HG2  GLU  29           HG2      GLU  29 -10.637  -7.718   4.334
  248    HG3  GLU  29           HG3      GLU  29  -9.696  -6.603   3.345
  249    H    GLY  30           H        GLY  30  -5.895  -6.787   6.393
  250    HA2  GLY  30           HA2      GLY  30  -4.925  -9.248   7.596
  251    HA3  GLY  30           HA3      GLY  30  -3.961  -8.683   6.230
  252    H    THR  31           H        THR  31  -2.342  -7.292   6.719
  253    HA   THR  31           HA       THR  31  -2.466  -5.700   9.218
  254    HB   THR  31           HB       THR  31   0.041  -6.173   9.441
  255    HG1  THR  31           HG1      THR  31   0.573  -8.249   8.321
  256   HG21  THR  31          HG21      THR  31  -1.620  -7.370  10.877
  257   HG22  THR  31          HG22      THR  31  -0.222  -8.375  10.492
  258   HG23  THR  31          HG23      THR  31  -1.750  -8.632   9.648
  259    H    SER  32           H        SER  32  -1.668  -3.680   9.080
  260    HA   SER  32           HA       SER  32  -1.438  -2.433   6.521
  261    HB2  SER  32           HB2      SER  32  -0.903  -1.154   9.237
  262    HB3  SER  32           HB3      SER  32  -1.454  -0.362   7.754
  263    HG   SER  32           HG       SER  32  -3.430  -0.907   8.219
  264    H    GLU  33           H        GLU  33   0.793  -3.433   9.056
  265    HA   GLU  33           HA       GLU  33   3.116  -2.022   8.215
  266    HB2  GLU  33           HB2      GLU  33   2.843  -4.569   9.880
  267    HB3  GLU  33           HB3      GLU  33   4.353  -3.677   9.663
  268    HG2  GLU  33           HG2      GLU  33   3.285  -1.667  10.697
  269    HG3  GLU  33           HG3      GLU  33   1.829  -2.621  10.991
  270    H    ASP  34           H        ASP  34   1.798  -5.226   7.412
  271    HA   ASP  34           HA       ASP  34   4.023  -5.920   5.681
  272    HB2  ASP  34           HB2      ASP  34   1.350  -7.272   6.226
  273    HB3  ASP  34           HB3      ASP  34   2.414  -7.842   4.938
  274    H    ALA  35           H        ALA  35   0.928  -4.351   5.318
  275    HA   ALA  35           HA       ALA  35   0.670  -4.478   2.486
  276    HB1  ALA  35           HB1      ALA  35  -0.923  -2.614   2.739
  277    HB2  ALA  35           HB2      ALA  35  -0.394  -2.369   4.407
  278    HB3  ALA  35           HB3      ALA  35  -1.216  -3.864   3.948
  279    H    GLU  36           H        GLU  36   2.113  -2.026   4.656
  280    HA   GLU  36           HA       GLU  36   3.038  -0.331   2.529
  281    HB2  GLU  36           HB2      GLU  36   4.115   0.985   4.253
  282    HB3  GLU  36           HB3      GLU  36   2.500   0.532   4.789
  283    HG2  GLU  36           HG2      GLU  36   3.499  -1.281   6.175
  284    HG3  GLU  36           HG3      GLU  36   5.103  -0.743   5.681
  285    H    ARG  37           H        ARG  37   4.410  -2.973   4.368
  286    HA   ARG  37           HA       ARG  37   7.090  -2.934   3.493
  287    HB2  ARG  37           HB2      ARG  37   6.369  -4.384   5.310
  288    HB3  ARG  37           HB3      ARG  37   5.222  -5.203   4.260
  289    HG2  ARG  37           HG2      ARG  37   7.187  -6.112   2.947
  290    HG3  ARG  37           HG3      ARG  37   8.252  -5.429   4.181
  291    HD2  ARG  37           HD2      ARG  37   7.296  -6.848   5.886
  292    HD3  ARG  37           HD3      ARG  37   6.013  -7.378   4.790
  293    HE   ARG  37           HE       ARG  37   8.598  -8.012   3.766
  294   HH11  ARG  37          HH11      ARG  37   6.200  -9.121   6.112
  295   HH12  ARG  37          HH12      ARG  37   6.731 -10.770   6.035
  296   HH21  ARG  37          HH21      ARG  37   9.213 -10.176   3.651
  297   HH22  ARG  37          HH22      ARG  37   8.428 -11.352   4.648
  298    H    MET  38           H        MET  38   4.122  -4.251   1.974
  299    HA   MET  38           HA       MET  38   5.541  -5.253  -0.347
  300    HB2  MET  38           HB2      MET  38   2.571  -4.941   0.234
  301    HB3  MET  38           HB3      MET  38   3.205  -5.635  -1.251
  302    HG2  MET  38           HG2      MET  38   3.642  -6.766   1.523
  303    HG3  MET  38           HG3      MET  38   2.447  -7.340   0.369
  304    HE1  MET  38           HE1      MET  38   5.874  -7.853   1.829
  305    HE2  MET  38           HE2      MET  38   6.468  -6.735   0.600
  306    HE3  MET  38           HE3      MET  38   6.885  -8.446   0.512
  307    H    ALA  39           H        ALA  39   3.998  -2.278   0.611
  308    HA   ALA  39           HA       ALA  39   3.343  -1.131  -1.855
  309    HB1  ALA  39           HB1      ALA  39   3.258   1.016  -0.663
  310    HB2  ALA  39           HB2      ALA  39   4.130   0.308   0.702
  311    HB3  ALA  39           HB3      ALA  39   2.510  -0.265   0.295
  312    H    ARG  40           H        ARG  40   6.312  -0.901   0.060
  313    HA   ARG  40           HA       ARG  40   7.719   0.903  -1.534
  314    HB2  ARG  40           HB2      ARG  40   9.792  -0.058  -0.485
  315    HB3  ARG  40           HB3      ARG  40   8.539   0.398   0.663
  316    HG2  ARG  40           HG2      ARG  40   7.882  -1.929   0.941
  317    HG3  ARG  40           HG3      ARG  40   9.070  -2.440  -0.261
  318    HD2  ARG  40           HD2      ARG  40   9.764  -1.035   2.341
  319    HD3  ARG  40           HD3      ARG  40   9.779  -2.787   2.119
  320    HE   ARG  40           HE       ARG  40  11.488  -0.955   0.540
  321   HH11  ARG  40          HH11      ARG  40  11.171  -3.891   2.475
  322   HH12  ARG  40          HH12      ARG  40  12.815  -4.380   2.205
  323   HH21  ARG  40          HH21      ARG  40  13.616  -1.625   0.203
  324   HH22  ARG  40          HH22      ARG  40  14.188  -3.096   0.925
  325    H    ASN  41           H        ASN  41   7.344  -2.638  -1.878
  326    HA   ASN  41           HA       ASN  41   9.460  -3.041  -3.721
  327    HB2  ASN  41           HB2      ASN  41   6.998  -4.763  -3.212
  328    HB3  ASN  41           HB3      ASN  41   8.374  -5.264  -4.192
  329   HD21  ASN  41          HD21      ASN  41   7.117  -5.105  -1.034
  330   HD22  ASN  41          HD22      ASN  41   8.534  -5.616  -0.198
  331    H    CYS  42           H        CYS  42   6.237  -1.882  -4.242
  332    HA   CYS  42           HA       CYS  42   5.902  -2.562  -6.998
  333    HB2  CYS  42           HB2      CYS  42   4.016  -1.936  -5.546
  334    HB3  CYS  42           HB3      CYS  42   4.642  -0.310  -5.393
  335    H    GLU  43           H        GLU  43   7.402   0.130  -5.322
  336    HA   GLU  43           HA       GLU  43   7.840   1.629  -7.825
  337    HB2  GLU  43           HB2      GLU  43   6.693   2.815  -5.972
  338    HB3  GLU  43           HB3      GLU  43   8.053   2.490  -4.904
  339    HG2  GLU  43           HG2      GLU  43   8.019   4.821  -5.772
  340    HG3  GLU  43           HG3      GLU  43   9.496   3.950  -6.184
  341    H    SER  44           H        SER  44   9.523   0.520  -4.916
  342    HA   SER  44           HA       SER  44  11.923  -0.186  -6.353
  343    HB2  SER  44           HB2      SER  44  12.066   2.029  -4.256
  344    HB3  SER  44           HB3      SER  44  13.469   1.164  -4.883
  345    HG   SER  44           HG       SER  44  11.777   2.995  -6.166
  Start of MODEL   14
    1    H1   ALA   1           H1       ALA   1  -4.752   4.189  14.390
    2    H2   ALA   1           H2       ALA   1  -4.058   5.731  14.496
    3    H3   ALA   1           H3       ALA   1  -3.098   4.397  14.099
    4    HA   ALA   1           HA       ALA   1  -5.313   5.454  12.454
    5    HB1  ALA   1           HB1      ALA   1  -3.430   7.015  12.530
    6    HB2  ALA   1           HB2      ALA   1  -3.515   6.253  10.941
    7    HB3  ALA   1           HB3      ALA   1  -2.308   5.720  12.114
    8    HA   PRO   2           HA       PRO   2  -4.971   1.169  10.936
    9    HB2  PRO   2           HB2      PRO   2  -6.911   1.299   8.969
   10    HB3  PRO   2           HB3      PRO   2  -7.273   1.129  10.696
   11    HG2  PRO   2           HG2      PRO   2  -7.372   3.583   8.990
   12    HG3  PRO   2           HG3      PRO   2  -8.480   3.062  10.279
   13    HD2  PRO   2           HD2      PRO   2  -6.543   4.968  10.638
   14    HD3  PRO   2           HD3      PRO   2  -7.144   3.939  11.954
   15    H    CYS   3           H        CYS   3  -5.628   3.373   8.164
   16    HA   CYS   3           HA       CYS   3  -3.131   2.542   6.827
   17    HB2  CYS   3           HB2      CYS   3  -5.877   2.538   5.481
   18    HB3  CYS   3           HB3      CYS   3  -4.347   2.027   4.769
   19    H    GLU   4           H        GLU   4  -4.078   5.029   8.203
   20    HA   GLU   4           HA       GLU   4  -4.974   6.979   6.368
   21    HB2  GLU   4           HB2      GLU   4  -3.318   7.504   8.873
   22    HB3  GLU   4           HB3      GLU   4  -4.369   8.646   8.053
   23    HG2  GLU   4           HG2      GLU   4  -5.234   6.174   9.569
   24    HG3  GLU   4           HG3      GLU   4  -5.393   7.844  10.102
   25    H    ASP   5           H        ASP   5  -1.681   6.123   7.468
   26    HA   ASP   5           HA       ASP   5  -0.347   8.014   5.732
   27    HB2  ASP   5           HB2      ASP   5   1.740   7.023   6.501
   28    HB3  ASP   5           HB3      ASP   5   0.675   7.183   7.888
   29    H    LEU   6           H        LEU   6  -1.336   4.652   5.579
   30    HA   LEU   6           HA       LEU   6   0.310   3.723   3.488
   31    HB2  LEU   6           HB2      LEU   6  -0.983   2.334   5.166
   32    HB3  LEU   6           HB3      LEU   6  -2.444   2.686   4.278
   33    HG   LEU   6           HG       LEU   6  -1.351   0.370   3.931
   34   HD11  LEU   6          HD11      LEU   6  -1.976   0.211   1.581
   35   HD12  LEU   6          HD12      LEU   6  -1.981   1.970   1.439
   36   HD13  LEU   6          HD13      LEU   6  -3.148   1.167   2.490
   37   HD21  LEU   6          HD21      LEU   6   0.989   1.126   3.689
   38   HD22  LEU   6          HD22      LEU   6   0.583   1.923   2.168
   39   HD23  LEU   6          HD23      LEU   6   0.467   0.168   2.304
   40    H    LYS   7           H        LYS   7  -3.009   5.024   3.423
   41    HA   LYS   7           HA       LYS   7  -3.440   4.772   0.636
   42    HB2  LYS   7           HB2      LYS   7  -5.409   6.188   0.976
   43    HB3  LYS   7           HB3      LYS   7  -5.284   4.975   2.241
   44    HG2  LYS   7           HG2      LYS   7  -4.188   6.821   3.665
   45    HG3  LYS   7           HG3      LYS   7  -4.792   7.948   2.453
   46    HD2  LYS   7           HD2      LYS   7  -6.473   6.058   4.150
   47    HD3  LYS   7           HD3      LYS   7  -6.334   7.801   4.366
   48    HE2  LYS   7           HE2      LYS   7  -7.371   8.096   2.090
   49    HE3  LYS   7           HE3      LYS   7  -7.625   6.351   2.032
   50    HZ1  LYS   7           HZ1      LYS   7  -9.012   6.509   4.002
   51    HZ2  LYS   7           HZ2      LYS   7  -9.606   7.540   2.797
   52    HZ3  LYS   7           HZ3      LYS   7  -8.742   8.174   4.103
   53    H    GLU   8           H        GLU   8  -1.922   7.250   2.588
   54    HA   GLU   8           HA       GLU   8  -1.583   9.180   0.491
   55    HB2  GLU   8           HB2      GLU   8  -0.029   8.858   3.097
   56    HB3  GLU   8           HB3      GLU   8   0.024  10.269   2.044
   57    HG2  GLU   8           HG2      GLU   8  -2.383   9.265   3.570
   58    HG3  GLU   8           HG3      GLU   8  -1.407  10.673   3.973
   59    H    ARG   9           H        ARG   9   0.339   6.420   1.683
   60    HA   ARG   9           HA       ARG   9   2.694   6.859   0.161
   61    HB2  ARG   9           HB2      ARG   9   1.452   4.192   0.980
   62    HB3  ARG   9           HB3      ARG   9   3.089   4.401   0.366
   63    HG2  ARG   9           HG2      ARG   9   3.697   5.704   2.342
   64    HG3  ARG   9           HG3      ARG   9   2.045   5.585   2.945
   65    HD2  ARG   9           HD2      ARG   9   2.264   3.142   3.126
   66    HD3  ARG   9           HD3      ARG   9   3.906   3.231   2.480
   67    HE   ARG   9           HE       ARG   9   3.246   4.683   4.948
   68   HH11  ARG   9          HH11      ARG   9   4.965   2.018   3.422
   69   HH12  ARG   9          HH12      ARG   9   5.953   1.707   4.814
   70   HH21  ARG   9          HH21      ARG   9   4.523   4.265   6.753
   71   HH22  ARG   9          HH22      ARG   9   5.702   2.987   6.711
   72    H    LEU  10           H        LEU  10  -0.419   5.421  -0.593
   73    HA   LEU  10           HA       LEU  10   0.221   4.112  -3.007
   74    HB2  LEU  10           HB2      LEU  10  -2.459   5.359  -2.260
   75    HB3  LEU  10           HB3      LEU  10  -2.192   4.066  -3.417
   76    HG   LEU  10           HG       LEU  10  -1.986   3.928  -0.403
   77   HD11  LEU  10          HD11      LEU  10  -3.748   2.407  -2.328
   78   HD12  LEU  10          HD12      LEU  10  -4.243   3.715  -1.253
   79   HD13  LEU  10          HD13      LEU  10  -3.694   2.183  -0.578
   80   HD21  LEU  10          HD21      LEU  10  -1.291   1.564  -0.611
   81   HD22  LEU  10          HD22      LEU  10  -0.076   2.692  -1.204
   82   HD23  LEU  10          HD23      LEU  10  -1.077   1.794  -2.345
   83    H    LYS  11           H        LYS  11  -1.084   7.353  -2.368
   84    HA   LYS  11           HA       LYS  11  -1.124   8.079  -5.183
   85    HB2  LYS  11           HB2      LYS  11  -1.915   9.644  -2.709
   86    HB3  LYS  11           HB3      LYS  11  -2.203  10.158  -4.374
   87    HG2  LYS  11           HG2      LYS  11  -3.622   8.163  -4.753
   88    HG3  LYS  11           HG3      LYS  11  -3.346   7.645  -3.091
   89    HD2  LYS  11           HD2      LYS  11  -4.749  10.207  -3.939
   90    HD3  LYS  11           HD3      LYS  11  -5.547   8.743  -3.361
   91    HE2  LYS  11           HE2      LYS  11  -4.459   8.993  -1.170
   92    HE3  LYS  11           HE3      LYS  11  -3.606  10.431  -1.742
   93    HZ1  LYS  11           HZ1      LYS  11  -5.514  11.103  -0.505
   94    HZ2  LYS  11           HZ2      LYS  11  -6.531  10.105  -1.406
   95    HZ3  LYS  11           HZ3      LYS  11  -5.814  11.452  -2.133
   96    H    LYS  12           H        LYS  12   0.570   9.313  -2.277
   97    HA   LYS  12           HA       LYS  12   1.864  11.493  -3.594
   98    HB2  LYS  12           HB2      LYS  12   1.335  11.522  -1.190
   99    HB3  LYS  12           HB3      LYS  12   2.413  10.170  -0.890
  100    HG2  LYS  12           HG2      LYS  12   3.607  12.672  -2.062
  101    HG3  LYS  12           HG3      LYS  12   3.117  12.713  -0.369
  102    HD2  LYS  12           HD2      LYS  12   4.591  10.818   0.141
  103    HD3  LYS  12           HD3      LYS  12   5.012  10.656  -1.567
  104    HE2  LYS  12           HE2      LYS  12   6.028  12.931  -1.488
  105    HE3  LYS  12           HE3      LYS  12   5.684  12.998   0.242
  106    HZ1  LYS  12           HZ1      LYS  12   7.960  12.319  -0.192
  107    HZ2  LYS  12           HZ2      LYS  12   7.430  10.999  -1.103
  108    HZ3  LYS  12           HZ3      LYS  12   7.108  11.064   0.557
  109    H    LEU  13           H        LEU  13   2.976   8.259  -2.600
  110    HA   LEU  13           HA       LEU  13   5.690   8.607  -3.489
  111    HB2  LEU  13           HB2      LEU  13   4.897   7.017  -1.674
  112    HB3  LEU  13           HB3      LEU  13   4.170   6.036  -2.929
  113    HG   LEU  13           HG       LEU  13   6.478   5.683  -3.890
  114   HD11  LEU  13          HD11      LEU  13   7.402   6.995  -1.321
  115   HD12  LEU  13          HD12      LEU  13   7.614   7.623  -2.957
  116   HD13  LEU  13          HD13      LEU  13   8.430   6.140  -2.475
  117   HD21  LEU  13          HD21      LEU  13   5.392   3.970  -2.518
  118   HD22  LEU  13          HD22      LEU  13   6.026   4.709  -1.046
  119   HD23  LEU  13          HD23      LEU  13   7.131   3.989  -2.221
  120    H    GLY  14           H        GLY  14   2.679   7.698  -4.963
  121    HA2  GLY  14           HA2      GLY  14   2.038   7.551  -7.144
  122    HA3  GLY  14           HA3      GLY  14   3.615   8.174  -7.582
  123    H    MET  15           H        MET  15   2.313   5.173  -6.186
  124    HA   MET  15           HA       MET  15   4.153   3.509  -7.725
  125    HB2  MET  15           HB2      MET  15   3.284   1.657  -6.361
  126    HB3  MET  15           HB3      MET  15   3.755   3.006  -5.341
  127    HG2  MET  15           HG2      MET  15   1.329   3.657  -5.202
  128    HG3  MET  15           HG3      MET  15   0.940   2.192  -6.085
  129    HE1  MET  15           HE1      MET  15   2.990   2.027  -1.929
  130    HE2  MET  15           HE2      MET  15   2.670   3.553  -2.752
  131    HE3  MET  15           HE3      MET  15   3.868   2.432  -3.405
  132    H    SER  16           H        SER  16   2.759   1.258  -8.361
  133    HA   SER  16           HA       SER  16   1.195   1.941 -10.644
  134    HB2  SER  16           HB2      SER  16   1.512  -0.726  -9.207
  135    HB3  SER  16           HB3      SER  16   0.781  -0.522 -10.802
  136    HG   SER  16           HG       SER  16   3.172   0.680 -10.771
  137    H    GLU  17           H        GLU  17  -1.046   1.716 -10.992
  138    HA   GLU  17           HA       GLU  17  -2.926   2.255  -9.020
  139    HB2  GLU  17           HB2      GLU  17  -3.404   2.565 -11.402
  140    HB3  GLU  17           HB3      GLU  17  -3.311   0.831 -11.687
  141    HG2  GLU  17           HG2      GLU  17  -5.306   0.488 -10.272
  142    HG3  GLU  17           HG3      GLU  17  -5.403   2.221  -9.972
  143    H    GLU  18           H        GLU  18  -1.718  -0.822 -10.218
  144    HA   GLU  18           HA       GLU  18  -3.583  -2.583  -9.006
  145    HB2  GLU  18           HB2      GLU  18  -2.174  -3.276 -10.936
  146    HB3  GLU  18           HB3      GLU  18  -0.722  -3.102  -9.953
  147    HG2  GLU  18           HG2      GLU  18  -1.698  -4.874  -8.399
  148    HG3  GLU  18           HG3      GLU  18  -2.939  -5.149  -9.619
  149    H    CYS  19           H        CYS  19  -0.385  -1.302  -8.108
  150    HA   CYS  19           HA       CYS  19   0.055  -2.810  -5.787
  151    HB2  CYS  19           HB2      CYS  19   1.021  -0.033  -6.580
  152    HB3  CYS  19           HB3      CYS  19   1.604  -0.912  -5.185
  153    H    ARG  20           H        ARG  20  -1.369   0.457  -6.244
  154    HA   ARG  20           HA       ARG  20  -1.905   1.186  -3.614
  155    HB2  ARG  20           HB2      ARG  20  -3.783   1.729  -5.975
  156    HB3  ARG  20           HB3      ARG  20  -3.697   2.639  -4.473
  157    HG2  ARG  20           HG2      ARG  20  -1.421   3.413  -5.123
  158    HG3  ARG  20           HG3      ARG  20  -1.627   2.587  -6.673
  159    HD2  ARG  20           HD2      ARG  20  -3.473   4.728  -5.585
  160    HD3  ARG  20           HD3      ARG  20  -2.222   5.006  -6.801
  161    HE   ARG  20           HE       ARG  20  -4.192   2.983  -7.466
  162   HH11  ARG  20          HH11      ARG  20  -3.416   6.406  -7.795
  163   HH12  ARG  20          HH12      ARG  20  -4.478   6.644  -9.144
  164   HH21  ARG  20          HH21      ARG  20  -5.662   3.356  -9.156
  165   HH22  ARG  20          HH22      ARG  20  -5.750   4.912  -9.912
  166    H    GLN  21           H        GLN  21  -4.049  -0.441  -5.916
  167    HA   GLN  21           HA       GLN  21  -6.327  -0.563  -4.326
  168    HB2  GLN  21           HB2      GLN  21  -5.450  -2.241  -6.709
  169    HB3  GLN  21           HB3      GLN  21  -7.054  -2.382  -5.997
  170    HG2  GLN  21           HG2      GLN  21  -7.608  -0.127  -6.602
  171    HG3  GLN  21           HG3      GLN  21  -5.952   0.217  -7.088
  172   HE21  GLN  21          HE21      GLN  21  -5.552  -2.273  -8.561
  173   HE22  GLN  21          HE22      GLN  21  -6.496  -2.136  -9.998
  174    H    ARG  22           H        ARG  22  -3.735  -2.902  -4.907
  175    HA   ARG  22           HA       ARG  22  -4.690  -5.078  -3.371
  176    HB2  ARG  22           HB2      ARG  22  -1.926  -4.234  -4.320
  177    HB3  ARG  22           HB3      ARG  22  -2.142  -5.669  -3.333
  178    HG2  ARG  22           HG2      ARG  22  -3.587  -6.666  -5.041
  179    HG3  ARG  22           HG3      ARG  22  -3.438  -5.214  -6.030
  180    HD2  ARG  22           HD2      ARG  22  -1.082  -5.614  -6.392
  181    HD3  ARG  22           HD3      ARG  22  -1.065  -6.931  -5.213
  182    HE   ARG  22           HE       ARG  22  -2.841  -7.258  -7.499
  183   HH11  ARG  22          HH11      ARG  22   0.306  -8.019  -6.127
  184   HH12  ARG  22          HH12      ARG  22   0.570  -9.380  -7.175
  185   HH21  ARG  22          HH21      ARG  22  -2.513  -9.061  -8.839
  186   HH22  ARG  22          HH22      ARG  22  -1.037  -9.971  -8.719
  187    H    LEU  23           H        LEU  23  -2.649  -2.283  -2.574
  188    HA   LEU  23           HA       LEU  23  -1.585  -3.359  -0.157
  189    HB2  LEU  23           HB2      LEU  23  -1.579  -0.624  -1.469
  190    HB3  LEU  23           HB3      LEU  23  -0.826  -0.866   0.085
  191    HG   LEU  23           HG       LEU  23  -0.059  -2.280  -2.487
  192   HD11  LEU  23          HD11      LEU  23   2.028  -1.018  -2.328
  193   HD12  LEU  23          HD12      LEU  23   1.413  -0.165  -0.908
  194   HD13  LEU  23          HD13      LEU  23   0.626   0.038  -2.476
  195   HD21  LEU  23          HD21      LEU  23   0.268  -3.795  -0.647
  196   HD22  LEU  23          HD22      LEU  23   1.125  -2.563   0.282
  197   HD23  LEU  23          HD23      LEU  23   1.833  -3.207  -1.201
  198    H    GLU  24           H        GLU  24  -4.100  -0.919  -0.821
  199    HA   GLU  24           HA       GLU  24  -4.655  -0.419   1.933
  200    HB2  GLU  24           HB2      GLU  24  -6.619   0.834   1.147
  201    HB3  GLU  24           HB3      GLU  24  -5.177   1.254   0.237
  202    HG2  GLU  24           HG2      GLU  24  -6.491   1.038  -1.593
  203    HG3  GLU  24           HG3      GLU  24  -6.244  -0.688  -1.389
  204    H    LYS  25           H        LYS  25  -5.801  -2.798  -0.408
  205    HA   LYS  25           HA       LYS  25  -8.034  -3.796   1.054
  206    HB2  LYS  25           HB2      LYS  25  -7.450  -4.056  -1.459
  207    HB3  LYS  25           HB3      LYS  25  -6.333  -5.318  -0.986
  208    HG2  LYS  25           HG2      LYS  25  -9.320  -5.413  -0.454
  209    HG3  LYS  25           HG3      LYS  25  -8.554  -6.100  -1.882
  210    HD2  LYS  25           HD2      LYS  25  -7.210  -7.598  -0.393
  211    HD3  LYS  25           HD3      LYS  25  -8.081  -6.947   0.996
  212    HE2  LYS  25           HE2      LYS  25 -10.211  -7.757  -0.049
  213    HE3  LYS  25           HE3      LYS  25  -9.245  -8.533  -1.303
  214    HZ1  LYS  25           HZ1      LYS  25  -9.769 -10.137   0.357
  215    HZ2  LYS  25           HZ2      LYS  25  -9.211  -9.140   1.601
  216    HZ3  LYS  25           HZ3      LYS  25  -8.115  -9.795   0.491
  217    H    MET  26           H        MET  26  -4.592  -4.606   0.904
  218    HA   MET  26           HA       MET  26  -4.689  -6.907   2.655
  219    HB2  MET  26           HB2      MET  26  -2.337  -5.265   1.595
  220    HB3  MET  26           HB3      MET  26  -2.175  -6.764   2.503
  221    HG2  MET  26           HG2      MET  26  -3.250  -8.010   0.717
  222    HG3  MET  26           HG3      MET  26  -3.593  -6.530  -0.158
  223    HE1  MET  26           HE1      MET  26   0.678  -8.224   0.407
  224    HE2  MET  26           HE2      MET  26  -0.768  -8.998   1.052
  225    HE3  MET  26           HE3      MET  26  -0.196  -7.476   1.741
  226    H    CYS  27           H        CYS  27  -4.134  -3.478   2.991
  227    HA   CYS  27           HA       CYS  27  -3.098  -3.480   5.661
  228    HB2  CYS  27           HB2      CYS  27  -2.741  -1.600   4.094
  229    HB3  CYS  27           HB3      CYS  27  -4.470  -1.274   4.068
  230    H    LYS  28           H        LYS  28  -6.341  -3.412   4.244
  231    HA   LYS  28           HA       LYS  28  -7.757  -2.975   6.748
  232    HB2  LYS  28           HB2      LYS  28  -8.717  -3.892   3.985
  233    HB3  LYS  28           HB3      LYS  28  -9.794  -3.559   5.342
  234    HG2  LYS  28           HG2      LYS  28  -9.297  -1.220   5.298
  235    HG3  LYS  28           HG3      LYS  28  -7.921  -1.457   4.218
  236    HD2  LYS  28           HD2      LYS  28  -9.557  -2.244   2.443
  237    HD3  LYS  28           HD3      LYS  28 -10.872  -1.767   3.521
  238    HE2  LYS  28           HE2      LYS  28 -10.130   0.565   3.445
  239    HE3  LYS  28           HE3      LYS  28  -8.721   0.113   2.480
  240    HZ1  LYS  28           HZ1      LYS  28 -11.567  -0.064   1.644
  241    HZ2  LYS  28           HZ2      LYS  28 -10.268  -0.666   0.739
  242    HZ3  LYS  28           HZ3      LYS  28 -10.389   0.993   1.043
  243    H    GLU  29           H        GLU  29  -7.454  -5.642   4.448
  244    HA   GLU  29           HA       GLU  29  -8.245  -7.650   6.446
  245    HB2  GLU  29           HB2      GLU  29  -8.019  -7.904   3.410
  246    HB3  GLU  29           HB3      GLU  29  -8.661  -9.115   4.518
  247    HG2  GLU  29           HG2      GLU  29 -10.481  -7.531   5.138
  248    HG3  GLU  29           HG3      GLU  29  -9.849  -6.393   3.960
  249    H    GLY  30           H        GLY  30  -6.333  -7.809   7.537
  250    HA2  GLY  30           HA2      GLY  30  -4.393  -9.454   7.503
  251    HA3  GLY  30           HA3      GLY  30  -3.850  -8.551   6.085
  252    H    THR  31           H        THR  31  -2.159  -7.263   6.678
  253    HA   THR  31           HA       THR  31  -2.515  -5.447   8.980
  254    HB   THR  31           HB       THR  31  -0.109  -5.759   9.658
  255    HG1  THR  31           HG1      THR  31   0.442  -8.144   8.718
  256   HG21  THR  31          HG21      THR  31  -0.368  -7.876  10.856
  257   HG22  THR  31          HG22      THR  31  -1.709  -8.342   9.810
  258   HG23  THR  31          HG23      THR  31  -1.881  -6.969  10.908
  259    H    SER  32           H        SER  32  -1.522  -3.485   8.783
  260    HA   SER  32           HA       SER  32  -0.612  -2.429   6.302
  261    HB2  SER  32           HB2      SER  32  -0.046  -1.279   9.072
  262    HB3  SER  32           HB3      SER  32  -0.233  -0.401   7.551
  263    HG   SER  32           HG       SER  32  -2.241  -0.215   8.124
  264    H    GLU  33           H        GLU  33   0.841  -4.014   8.981
  265    HA   GLU  33           HA       GLU  33   3.565  -3.378   8.777
  266    HB2  GLU  33           HB2      GLU  33   2.308  -5.978   9.759
  267    HB3  GLU  33           HB3      GLU  33   3.908  -5.371  10.174
  268    HG2  GLU  33           HG2      GLU  33   2.964  -3.537  11.446
  269    HG3  GLU  33           HG3      GLU  33   1.337  -3.925  10.887
  270    H    ASP  34           H        ASP  34   1.613  -5.930   7.263
  271    HA   ASP  34           HA       ASP  34   3.817  -7.037   5.735
  272    HB2  ASP  34           HB2      ASP  34   1.811  -8.393   6.588
  273    HB3  ASP  34           HB3      ASP  34   0.836  -7.621   5.342
  274    H    ALA  35           H        ALA  35   1.119  -4.819   5.206
  275    HA   ALA  35           HA       ALA  35   1.106  -4.747   2.395
  276    HB1  ALA  35           HB1      ALA  35   0.276  -2.542   4.304
  277    HB2  ALA  35           HB2      ALA  35  -0.740  -3.886   3.781
  278    HB3  ALA  35           HB3      ALA  35  -0.194  -2.690   2.606
  279    H    GLU  36           H        GLU  36   2.883  -2.716   4.734
  280    HA   GLU  36           HA       GLU  36   4.030  -0.862   2.961
  281    HB2  GLU  36           HB2      GLU  36   5.635  -0.366   4.745
  282    HB3  GLU  36           HB3      GLU  36   4.017  -0.565   5.413
  283    HG2  GLU  36           HG2      GLU  36   4.561  -2.806   6.204
  284    HG3  GLU  36           HG3      GLU  36   6.141  -2.733   5.431
  285    H    ARG  37           H        ARG  37   4.945  -4.135   3.739
  286    HA   ARG  37           HA       ARG  37   7.603  -4.170   2.710
  287    HB2  ARG  37           HB2      ARG  37   5.641  -6.490   2.974
  288    HB3  ARG  37           HB3      ARG  37   7.388  -6.627   2.801
  289    HG2  ARG  37           HG2      ARG  37   7.679  -5.523   4.997
  290    HG3  ARG  37           HG3      ARG  37   5.928  -5.427   5.171
  291    HD2  ARG  37           HD2      ARG  37   5.763  -7.872   5.176
  292    HD3  ARG  37           HD3      ARG  37   7.503  -8.016   4.901
  293    HE   ARG  37           HE       ARG  37   6.440  -6.707   7.334
  294   HH11  ARG  37          HH11      ARG  37   8.416  -9.246   5.891
  295   HH12  ARG  37          HH12      ARG  37   9.094  -9.739   7.414
  296   HH21  ARG  37          HH21      ARG  37   7.352  -7.372   9.313
  297   HH22  ARG  37          HH22      ARG  37   8.493  -8.679   9.347
  298    H    MET  38           H        MET  38   4.417  -4.850   1.318
  299    HA   MET  38           HA       MET  38   5.440  -5.553  -1.304
  300    HB2  MET  38           HB2      MET  38   2.595  -4.891  -0.459
  301    HB3  MET  38           HB3      MET  38   3.077  -5.692  -1.944
  302    HG2  MET  38           HG2      MET  38   3.463  -6.856   0.825
  303    HG3  MET  38           HG3      MET  38   2.096  -7.204  -0.220
  304    HE1  MET  38           HE1      MET  38   5.546  -8.331   0.907
  305    HE2  MET  38           HE2      MET  38   6.160  -7.314  -0.396
  306    HE3  MET  38           HE3      MET  38   6.283  -9.068  -0.515
  307    H    ALA  39           H        ALA  39   4.462  -2.664   0.358
  308    HA   ALA  39           HA       ALA  39   3.954  -0.951  -1.866
  309    HB1  ALA  39           HB1      ALA  39   4.752  -0.231   0.975
  310    HB2  ALA  39           HB2      ALA  39   3.103  -0.489   0.407
  311    HB3  ALA  39           HB3      ALA  39   4.043   0.866  -0.218
  312    H    ARG  40           H        ARG  40   6.835  -1.615   0.106
  313    HA   ARG  40           HA       ARG  40   8.583   0.172  -1.308
  314    HB2  ARG  40           HB2      ARG  40  10.395  -0.829  -0.064
  315    HB3  ARG  40           HB3      ARG  40   9.027  -0.702   1.032
  316    HG2  ARG  40           HG2      ARG  40   8.562  -3.083   0.801
  317    HG3  ARG  40           HG3      ARG  40   9.824  -3.246  -0.415
  318    HD2  ARG  40           HD2      ARG  40  11.507  -2.608   1.338
  319    HD3  ARG  40           HD3      ARG  40  10.200  -2.622   2.531
  320    HE   ARG  40           HE       ARG  40  10.152  -5.079   1.185
  321   HH11  ARG  40          HH11      ARG  40  12.304  -3.369   3.381
  322   HH12  ARG  40          HH12      ARG  40  12.967  -4.829   4.047
  323   HH21  ARG  40          HH21      ARG  40  11.043  -6.986   2.071
  324   HH22  ARG  40          HH22      ARG  40  12.257  -6.864   3.310
  325    H    ASN  41           H        ASN  41   7.454  -3.080  -1.787
  326    HA   ASN  41           HA       ASN  41   9.540  -3.813  -3.718
  327    HB2  ASN  41           HB2      ASN  41   7.308  -5.335  -2.335
  328    HB3  ASN  41           HB3      ASN  41   8.084  -6.020  -3.758
  329   HD21  ASN  41          HD21      ASN  41   8.046  -6.893  -0.936
  330   HD22  ASN  41          HD22      ASN  41   9.702  -7.085  -0.505
  331    H    CYS  42           H        CYS  42   6.722  -2.083  -3.933
  332    HA   CYS  42           HA       CYS  42   5.455  -3.142  -6.218
  333    HB2  CYS  42           HB2      CYS  42   4.291  -1.488  -4.851
  334    HB3  CYS  42           HB3      CYS  42   5.522  -0.278  -5.192
  335    H    GLU  43           H        GLU  43   7.460  -0.139  -6.202
  336    HA   GLU  43           HA       GLU  43   8.739  -0.916  -8.746
  337    HB2  GLU  43           HB2      GLU  43   7.142   1.637  -8.312
  338    HB3  GLU  43           HB3      GLU  43   8.228   1.386  -9.674
  339    HG2  GLU  43           HG2      GLU  43   6.832  -0.485 -10.463
  340    HG3  GLU  43           HG3      GLU  43   5.752  -0.265  -9.081
  341    H    SER  44           H        SER  44   9.719  -0.615  -5.964
  342    HA   SER  44           HA       SER  44  11.676   1.578  -6.341
  343    HB2  SER  44           HB2      SER  44   9.920   2.194  -4.647
  344    HB3  SER  44           HB3      SER  44  10.388   0.788  -3.687
  345    HG   SER  44           HG       SER  44  11.987   3.046  -4.359
  Start of MODEL   15
    1    H1   ALA   1           H1       ALA   1  -7.118   5.236  13.767
    2    H2   ALA   1           H2       ALA   1  -6.623   3.689  13.310
    3    H3   ALA   1           H3       ALA   1  -8.220   4.163  13.058
    4    HA   ALA   1           HA       ALA   1  -7.505   5.837  11.482
    5    HB1  ALA   1           HB1      ALA   1  -5.146   5.867  10.738
    6    HB2  ALA   1           HB2      ALA   1  -4.744   4.668  11.970
    7    HB3  ALA   1           HB3      ALA   1  -5.291   6.275  12.451
    8    HA   PRO   2           HA       PRO   2  -8.294   1.954   9.101
    9    HB2  PRO   2           HB2      PRO   2 -10.075   2.992   7.313
   10    HB3  PRO   2           HB3      PRO   2 -10.526   2.677   9.005
   11    HG2  PRO   2           HG2      PRO   2  -9.752   5.287   7.717
   12    HG3  PRO   2           HG3      PRO   2 -11.082   4.945   8.850
   13    HD2  PRO   2           HD2      PRO   2  -8.686   6.021   9.644
   14    HD3  PRO   2           HD3      PRO   2  -9.697   5.034  10.710
   15    H    CYS   3           H        CYS   3  -5.820   2.963   8.661
   16    HA   CYS   3           HA       CYS   3  -4.115   2.823   7.230
   17    HB2  CYS   3           HB2      CYS   3  -5.412   0.829   6.375
   18    HB3  CYS   3           HB3      CYS   3  -6.111   1.868   5.139
   19    H    GLU   4           H        GLU   4  -5.661   5.306   7.453
   20    HA   GLU   4           HA       GLU   4  -5.917   6.666   4.964
   21    HB2  GLU   4           HB2      GLU   4  -5.340   7.911   7.688
   22    HB3  GLU   4           HB3      GLU   4  -6.105   8.699   6.314
   23    HG2  GLU   4           HG2      GLU   4  -8.114   7.420   6.588
   24    HG3  GLU   4           HG3      GLU   4  -7.344   6.335   7.749
   25    H    ASP   5           H        ASP   5  -3.440   6.698   7.488
   26    HA   ASP   5           HA       ASP   5  -1.577   8.472   6.429
   27    HB2  ASP   5           HB2      ASP   5  -1.604   7.721   8.781
   28    HB3  ASP   5           HB3      ASP   5  -1.180   6.090   8.287
   29    H    LEU   6           H        LEU   6  -1.887   4.968   6.009
   30    HA   LEU   6           HA       LEU   6   0.613   4.653   4.619
   31    HB2  LEU   6           HB2      LEU   6  -0.533   2.921   6.076
   32    HB3  LEU   6           HB3      LEU   6  -1.706   2.697   4.799
   33    HG   LEU   6           HG       LEU   6   1.228   2.297   4.133
   34   HD11  LEU   6          HD11      LEU   6   0.921   1.046   6.210
   35   HD12  LEU   6          HD12      LEU   6   1.177  -0.022   4.835
   36   HD13  LEU   6          HD13      LEU   6  -0.448   0.184   5.499
   37   HD21  LEU   6          HD21      LEU   6   0.348   0.586   2.574
   38   HD22  LEU   6          HD22      LEU   6  -0.386   2.161   2.288
   39   HD23  LEU   6          HD23      LEU   6  -1.295   0.915   3.143
   40    H    LYS   7           H        LYS   7  -2.843   4.677   3.687
   41    HA   LYS   7           HA       LYS   7  -2.479   4.017   0.962
   42    HB2  LYS   7           HB2      LYS   7  -4.630   3.790   2.109
   43    HB3  LYS   7           HB3      LYS   7  -4.760   5.540   2.276
   44    HG2  LYS   7           HG2      LYS   7  -4.875   5.751  -0.204
   45    HG3  LYS   7           HG3      LYS   7  -4.777   3.993  -0.349
   46    HD2  LYS   7           HD2      LYS   7  -7.012   5.590   0.964
   47    HD3  LYS   7           HD3      LYS   7  -7.101   4.732  -0.576
   48    HE2  LYS   7           HE2      LYS   7  -6.681   2.590   0.686
   49    HE3  LYS   7           HE3      LYS   7  -6.801   3.510   2.188
   50    HZ1  LYS   7           HZ1      LYS   7  -8.882   2.432   1.606
   51    HZ2  LYS   7           HZ2      LYS   7  -8.939   3.269   0.142
   52    HZ3  LYS   7           HZ3      LYS   7  -9.056   4.110   1.602
   53    H    GLU   8           H        GLU   8  -2.586   7.194   2.564
   54    HA   GLU   8           HA       GLU   8  -2.673   8.773   0.219
   55    HB2  GLU   8           HB2      GLU   8  -2.026  10.674   1.617
   56    HB3  GLU   8           HB3      GLU   8  -3.276   9.715   2.404
   57    HG2  GLU   8           HG2      GLU   8  -1.628   8.720   3.900
   58    HG3  GLU   8           HG3      GLU   8  -0.320   9.569   3.073
   59    H    ARG   9           H        ARG   9   0.008   7.386   2.079
   60    HA   ARG   9           HA       ARG   9   2.193   8.560   0.731
   61    HB2  ARG   9           HB2      ARG   9   1.979   5.755   1.914
   62    HB3  ARG   9           HB3      ARG   9   3.492   6.541   1.457
   63    HG2  ARG   9           HG2      ARG   9   3.208   8.225   3.160
   64    HG3  ARG   9           HG3      ARG   9   1.588   7.636   3.543
   65    HD2  ARG   9           HD2      ARG   9   2.635   5.450   4.247
   66    HD3  ARG   9           HD3      ARG   9   4.222   6.200   4.014
   67    HE   ARG   9           HE       ARG   9   2.212   6.904   6.035
   68   HH11  ARG   9          HH11      ARG   9   5.497   7.284   4.842
   69   HH12  ARG   9          HH12      ARG   9   6.049   8.070   6.286
   70   HH21  ARG   9          HH21      ARG   9   2.924   7.941   7.894
   71   HH22  ARG   9          HH22      ARG   9   4.584   8.445   8.023
   72    H    LEU  10           H        LEU  10   0.297   5.640  -0.027
   73    HA   LEU  10           HA       LEU  10   1.867   4.554  -2.077
   74    HB2  LEU  10           HB2      LEU  10  -1.168   4.422  -1.900
   75    HB3  LEU  10           HB3      LEU  10  -0.121   3.288  -2.744
   76    HG   LEU  10           HG       LEU  10  -0.325   3.661   0.269
   77   HD11  LEU  10          HD11      LEU  10  -1.281   1.412   0.301
   78   HD12  LEU  10          HD12      LEU  10  -1.217   1.341  -1.463
   79   HD13  LEU  10          HD13      LEU  10  -2.261   2.517  -0.658
   80   HD21  LEU  10          HD21      LEU  10   1.439   1.729  -1.269
   81   HD22  LEU  10          HD22      LEU  10   1.193   1.731   0.480
   82   HD23  LEU  10          HD23      LEU  10   1.975   3.103  -0.298
   83    H    LYS  11           H        LYS  11  -0.826   6.841  -2.226
   84    HA   LYS  11           HA       LYS  11  -0.918   7.092  -5.081
   85    HB2  LYS  11           HB2      LYS  11  -2.121   8.846  -2.905
   86    HB3  LYS  11           HB3      LYS  11  -2.551   8.901  -4.616
   87    HG2  LYS  11           HG2      LYS  11  -3.480   6.643  -4.500
   88    HG3  LYS  11           HG3      LYS  11  -2.946   6.474  -2.823
   89    HD2  LYS  11           HD2      LYS  11  -4.982   8.527  -3.806
   90    HD3  LYS  11           HD3      LYS  11  -5.392   6.992  -3.033
   91    HE2  LYS  11           HE2      LYS  11  -4.220   7.710  -0.979
   92    HE3  LYS  11           HE3      LYS  11  -3.791   9.239  -1.753
   93    HZ1  LYS  11           HZ1      LYS  11  -6.563   8.306  -1.208
   94    HZ2  LYS  11           HZ2      LYS  11  -6.133   9.784  -1.908
   95    HZ3  LYS  11           HZ3      LYS  11  -5.716   9.458  -0.306
   96    H    LYS  12           H        LYS  12   0.480   8.992  -2.431
   97    HA   LYS  12           HA       LYS  12   1.266  11.273  -3.961
   98    HB2  LYS  12           HB2      LYS  12   0.935  10.958  -1.351
   99    HB3  LYS  12           HB3      LYS  12   2.608  10.435  -1.356
  100    HG2  LYS  12           HG2      LYS  12   1.636  13.157  -2.317
  101    HG3  LYS  12           HG3      LYS  12   2.248  12.833  -0.698
  102    HD2  LYS  12           HD2      LYS  12   3.833  12.619  -3.294
  103    HD3  LYS  12           HD3      LYS  12   3.967  13.902  -2.088
  104    HE2  LYS  12           HE2      LYS  12   4.795  12.287  -0.434
  105    HE3  LYS  12           HE3      LYS  12   4.614  10.974  -1.601
  106    HZ1  LYS  12           HZ1      LYS  12   6.294  11.949  -2.969
  107    HZ2  LYS  12           HZ2      LYS  12   6.901  11.829  -1.398
  108    HZ3  LYS  12           HZ3      LYS  12   6.388  13.320  -1.992
  109    H    LEU  13           H        LEU  13   2.810   8.227  -3.094
  110    HA   LEU  13           HA       LEU  13   5.426   8.803  -4.126
  111    HB2  LEU  13           HB2      LEU  13   4.026   6.381  -3.024
  112    HB3  LEU  13           HB3      LEU  13   5.405   6.076  -4.062
  113    HG   LEU  13           HG       LEU  13   6.914   7.224  -2.537
  114   HD11  LEU  13          HD11      LEU  13   4.543   7.906  -0.784
  115   HD12  LEU  13          HD12      LEU  13   5.471   9.047  -1.759
  116   HD13  LEU  13          HD13      LEU  13   6.244   8.210  -0.417
  117   HD21  LEU  13          HD21      LEU  13   6.753   5.768  -0.573
  118   HD22  LEU  13          HD22      LEU  13   6.421   4.876  -2.057
  119   HD23  LEU  13          HD23      LEU  13   5.088   5.357  -1.000
  120    H    GLY  14           H        GLY  14   2.425   7.670  -5.440
  121    HA2  GLY  14           HA2      GLY  14   1.700   7.601  -7.592
  122    HA3  GLY  14           HA3      GLY  14   3.262   8.222  -8.112
  123    H    MET  15           H        MET  15   2.231   5.230  -6.458
  124    HA   MET  15           HA       MET  15   3.615   3.536  -8.350
  125    HB2  MET  15           HB2      MET  15   2.751   1.700  -6.925
  126    HB3  MET  15           HB3      MET  15   3.602   2.915  -5.990
  127    HG2  MET  15           HG2      MET  15   1.377   3.861  -5.320
  128    HG3  MET  15           HG3      MET  15   0.613   2.523  -6.153
  129    HE1  MET  15           HE1      MET  15   3.443   3.203  -3.337
  130    HE2  MET  15           HE2      MET  15   4.056   1.856  -4.304
  131    HE3  MET  15           HE3      MET  15   3.517   1.580  -2.649
  132    H    SER  16           H        SER  16   2.201   1.600  -9.149
  133    HA   SER  16           HA       SER  16   0.389   2.581 -11.066
  134    HB2  SER  16           HB2      SER  16   0.792  -0.271 -10.056
  135    HB3  SER  16           HB3      SER  16  -0.023   0.166 -11.557
  136    HG   SER  16           HG       SER  16   2.659   0.917 -10.984
  137    H    GLU  17           H        GLU  17  -1.919   2.316 -11.241
  138    HA   GLU  17           HA       GLU  17  -3.396   2.770  -8.862
  139    HB2  GLU  17           HB2      GLU  17  -4.388   1.986 -11.642
  140    HB3  GLU  17           HB3      GLU  17  -5.434   2.508 -10.320
  141    HG2  GLU  17           HG2      GLU  17  -4.214   4.686 -10.269
  142    HG3  GLU  17           HG3      GLU  17  -3.284   4.165 -11.670
  143    H    GLU  18           H        GLU  18  -2.587  -0.191 -10.574
  144    HA   GLU  18           HA       GLU  18  -4.314  -1.878  -9.025
  145    HB2  GLU  18           HB2      GLU  18  -3.455  -2.619 -11.201
  146    HB3  GLU  18           HB3      GLU  18  -1.793  -2.470 -10.637
  147    HG2  GLU  18           HG2      GLU  18  -2.226  -4.322  -8.995
  148    HG3  GLU  18           HG3      GLU  18  -3.852  -4.486  -9.666
  149    H    CYS  19           H        CYS  19  -1.026  -0.561  -8.584
  150    HA   CYS  19           HA       CYS  19  -0.037  -2.440  -6.706
  151    HB2  CYS  19           HB2      CYS  19   1.414  -0.748  -7.916
  152    HB3  CYS  19           HB3      CYS  19   0.686   0.514  -6.955
  153    H    ARG  20           H        ARG  20  -1.456   0.805  -6.257
  154    HA   ARG  20           HA       ARG  20  -1.401   0.691  -3.429
  155    HB2  ARG  20           HB2      ARG  20  -3.016   2.741  -3.628
  156    HB3  ARG  20           HB3      ARG  20  -1.356   2.884  -4.163
  157    HG2  ARG  20           HG2      ARG  20  -2.704   4.045  -5.713
  158    HG3  ARG  20           HG3      ARG  20  -2.140   2.576  -6.512
  159    HD2  ARG  20           HD2      ARG  20  -4.566   3.209  -6.924
  160    HD3  ARG  20           HD3      ARG  20  -4.292   1.564  -6.357
  161    HE   ARG  20           HE       ARG  20  -5.473   2.015  -4.500
  162   HH11  ARG  20          HH11      ARG  20  -4.728   5.110  -6.034
  163   HH12  ARG  20          HH12      ARG  20  -5.710   6.019  -4.941
  164   HH21  ARG  20          HH21      ARG  20  -6.652   3.278  -3.006
  165   HH22  ARG  20          HH22      ARG  20  -6.789   4.984  -3.237
  166    H    GLN  21           H        GLN  21  -3.850  -0.320  -5.763
  167    HA   GLN  21           HA       GLN  21  -5.959  -0.744  -3.868
  168    HB2  GLN  21           HB2      GLN  21  -5.505  -1.712  -6.713
  169    HB3  GLN  21           HB3      GLN  21  -6.924  -2.199  -5.785
  170    HG2  GLN  21           HG2      GLN  21  -7.687   0.091  -5.606
  171    HG3  GLN  21           HG3      GLN  21  -6.188   0.702  -6.297
  172   HE21  GLN  21          HE21      GLN  21  -7.221   1.803  -7.973
  173   HE22  GLN  21          HE22      GLN  21  -7.998   0.996  -9.288
  174    H    ARG  22           H        ARG  22  -3.243  -2.694  -4.944
  175    HA   ARG  22           HA       ARG  22  -3.947  -5.164  -3.709
  176    HB2  ARG  22           HB2      ARG  22  -1.264  -3.939  -4.485
  177    HB3  ARG  22           HB3      ARG  22  -1.384  -5.540  -3.789
  178    HG2  ARG  22           HG2      ARG  22  -2.708  -6.298  -5.704
  179    HG3  ARG  22           HG3      ARG  22  -2.657  -4.676  -6.397
  180    HD2  ARG  22           HD2      ARG  22  -0.235  -4.832  -6.674
  181    HD3  ARG  22           HD3      ARG  22  -0.210  -6.399  -5.855
  182    HE   ARG  22           HE       ARG  22  -1.881  -6.306  -8.218
  183   HH11  ARG  22          HH11      ARG  22   1.383  -6.929  -7.029
  184   HH12  ARG  22          HH12      ARG  22   1.816  -7.904  -8.399
  185   HH21  ARG  22          HH21      ARG  22  -1.272  -7.581 -10.015
  186   HH22  ARG  22          HH22      ARG  22   0.320  -8.270 -10.077
  187    H    LEU  23           H        LEU  23  -2.086  -2.333  -2.692
  188    HA   LEU  23           HA       LEU  23  -1.054  -3.537  -0.307
  189    HB2  LEU  23           HB2      LEU  23  -0.946  -0.692  -1.358
  190    HB3  LEU  23           HB3      LEU  23  -0.014  -1.283  -0.001
  191    HG   LEU  23           HG       LEU  23   0.213  -2.319  -2.847
  192   HD11  LEU  23          HD11      LEU  23   2.140  -0.554  -1.344
  193   HD12  LEU  23          HD12      LEU  23   1.101  -0.067  -2.687
  194   HD13  LEU  23          HD13      LEU  23   2.382  -1.247  -2.954
  195   HD21  LEU  23          HD21      LEU  23   1.895  -3.017  -0.429
  196   HD22  LEU  23          HD22      LEU  23   2.159  -3.571  -2.087
  197   HD23  LEU  23          HD23      LEU  23   0.711  -4.066  -1.219
  198    H    GLU  24           H        GLU  24  -3.494  -1.022  -0.975
  199    HA   GLU  24           HA       GLU  24  -4.079  -0.333   1.705
  200    HB2  GLU  24           HB2      GLU  24  -6.004   0.827   0.840
  201    HB3  GLU  24           HB3      GLU  24  -4.711   1.015  -0.338
  202    HG2  GLU  24           HG2      GLU  24  -5.741  -0.804  -1.707
  203    HG3  GLU  24           HG3      GLU  24  -7.069  -0.887  -0.549
  204    H    LYS  25           H        LYS  25  -5.164  -2.893  -0.390
  205    HA   LYS  25           HA       LYS  25  -7.363  -3.928   1.078
  206    HB2  LYS  25           HB2      LYS  25  -7.081  -4.452  -1.268
  207    HB3  LYS  25           HB3      LYS  25  -5.476  -5.113  -0.993
  208    HG2  LYS  25           HG2      LYS  25  -6.498  -6.999   0.279
  209    HG3  LYS  25           HG3      LYS  25  -8.100  -6.342  -0.072
  210    HD2  LYS  25           HD2      LYS  25  -6.081  -7.327  -2.132
  211    HD3  LYS  25           HD3      LYS  25  -7.526  -8.192  -1.609
  212    HE2  LYS  25           HE2      LYS  25  -8.927  -6.344  -2.537
  213    HE3  LYS  25           HE3      LYS  25  -7.458  -5.543  -3.102
  214    HZ1  LYS  25           HZ1      LYS  25  -8.479  -6.786  -4.877
  215    HZ2  LYS  25           HZ2      LYS  25  -8.424  -8.216  -3.978
  216    HZ3  LYS  25           HZ3      LYS  25  -6.992  -7.481  -4.482
  217    H    MET  26           H        MET  26  -3.923  -4.898   0.855
  218    HA   MET  26           HA       MET  26  -4.010  -6.934   2.843
  219    HB2  MET  26           HB2      MET  26  -1.602  -5.369   1.808
  220    HB3  MET  26           HB3      MET  26  -1.519  -6.836   2.777
  221    HG2  MET  26           HG2      MET  26  -2.767  -8.018   0.917
  222    HG3  MET  26           HG3      MET  26  -2.556  -6.562  -0.051
  223    HE1  MET  26           HE1      MET  26   0.854  -9.381   1.305
  224    HE2  MET  26           HE2      MET  26  -0.864  -9.703   1.546
  225    HE3  MET  26           HE3      MET  26  -0.060  -8.441   2.483
  226    H    CYS  27           H        CYS  27  -3.647  -3.505   2.960
  227    HA   CYS  27           HA       CYS  27  -2.346  -3.135   5.444
  228    HB2  CYS  27           HB2      CYS  27  -2.532  -1.440   3.627
  229    HB3  CYS  27           HB3      CYS  27  -4.253  -1.293   3.952
  230    H    LYS  28           H        LYS  28  -5.786  -3.304   4.542
  231    HA   LYS  28           HA       LYS  28  -6.613  -2.883   7.334
  232    HB2  LYS  28           HB2      LYS  28  -8.939  -2.717   6.403
  233    HB3  LYS  28           HB3      LYS  28  -7.829  -1.495   5.804
  234    HG2  LYS  28           HG2      LYS  28  -7.680  -2.550   3.653
  235    HG3  LYS  28           HG3      LYS  28  -8.515  -3.992   4.226
  236    HD2  LYS  28           HD2      LYS  28  -9.964  -2.523   2.820
  237    HD3  LYS  28           HD3      LYS  28 -10.612  -2.765   4.443
  238    HE2  LYS  28           HE2      LYS  28  -9.861  -0.541   5.117
  239    HE3  LYS  28           HE3      LYS  28  -9.039  -0.318   3.568
  240    HZ1  LYS  28           HZ1      LYS  28 -11.194  -0.404   2.460
  241    HZ2  LYS  28           HZ2      LYS  28 -11.158   0.835   3.607
  242    HZ3  LYS  28           HZ3      LYS  28 -11.979  -0.605   3.940
  243    H    GLU  29           H        GLU  29  -7.085  -5.296   4.711
  244    HA   GLU  29           HA       GLU  29  -8.546  -7.092   6.486
  245    HB2  GLU  29           HB2      GLU  29  -7.723  -7.498   3.581
  246    HB3  GLU  29           HB3      GLU  29  -8.868  -8.487   4.488
  247    HG2  GLU  29           HG2      GLU  29 -10.346  -6.470   4.714
  248    HG3  GLU  29           HG3      GLU  29  -9.227  -5.579   3.686
  249    H    GLY  30           H        GLY  30  -5.287  -6.552   5.864
  250    HA2  GLY  30           HA2      GLY  30  -4.592  -9.171   7.113
  251    HA3  GLY  30           HA3      GLY  30  -3.542  -8.358   5.945
  252    H    THR  31           H        THR  31  -1.990  -7.087   6.793
  253    HA   THR  31           HA       THR  31  -2.628  -5.364   9.102
  254    HB   THR  31           HB       THR  31  -0.297  -5.547   9.985
  255    HG1  THR  31           HG1      THR  31  -0.027  -7.722   8.168
  256   HG21  THR  31          HG21      THR  31  -2.031  -6.983  11.027
  257   HG22  THR  31          HG22      THR  31  -0.441  -7.754  11.056
  258   HG23  THR  31          HG23      THR  31  -1.644  -8.260   9.870
  259    H    SER  32           H        SER  32  -1.540  -3.344   9.064
  260    HA   SER  32           HA       SER  32  -0.838  -2.195   6.597
  261    HB2  SER  32           HB2      SER  32  -0.115  -1.262   9.406
  262    HB3  SER  32           HB3      SER  32  -0.085  -0.268   7.947
  263    HG   SER  32           HG       SER  32  -2.340  -0.637   7.753
  264    H    GLU  33           H        GLU  33   1.020  -4.038   8.881
  265    HA   GLU  33           HA       GLU  33   3.663  -3.468   8.059
  266    HB2  GLU  33           HB2      GLU  33   2.541  -6.087   9.169
  267    HB3  GLU  33           HB3      GLU  33   4.247  -5.631   9.118
  268    HG2  GLU  33           HG2      GLU  33   3.833  -3.787  10.677
  269    HG3  GLU  33           HG3      GLU  33   2.107  -4.159  10.693
  270    H    ASP  34           H        ASP  34   1.269  -5.892   6.960
  271    HA   ASP  34           HA       ASP  34   2.853  -7.134   4.956
  272    HB2  ASP  34           HB2      ASP  34  -0.118  -7.069   5.535
  273    HB3  ASP  34           HB3      ASP  34   0.411  -7.699   3.980
  274    H    ALA  35           H        ALA  35   0.850  -4.261   4.929
  275    HA   ALA  35           HA       ALA  35   0.731  -3.890   2.108
  276    HB1  ALA  35           HB1      ALA  35  -0.030  -1.615   2.646
  277    HB2  ALA  35           HB2      ALA  35   0.415  -1.863   4.337
  278    HB3  ALA  35           HB3      ALA  35  -0.868  -2.832   3.610
  279    H    GLU  36           H        GLU  36   2.819  -2.329   4.630
  280    HA   GLU  36           HA       GLU  36   4.417  -0.880   2.770
  281    HB2  GLU  36           HB2      GLU  36   5.988  -0.492   4.657
  282    HB3  GLU  36           HB3      GLU  36   4.319  -0.171   5.119
  283    HG2  GLU  36           HG2      GLU  36   4.182  -2.212   6.371
  284    HG3  GLU  36           HG3      GLU  36   5.717  -2.786   5.731
  285    H    ARG  37           H        ARG  37   4.636  -4.091   4.104
  286    HA   ARG  37           HA       ARG  37   7.197  -4.951   3.368
  287    HB2  ARG  37           HB2      ARG  37   5.785  -6.247   4.844
  288    HB3  ARG  37           HB3      ARG  37   4.523  -6.377   3.629
  289    HG2  ARG  37           HG2      ARG  37   6.080  -7.829   2.276
  290    HG3  ARG  37           HG3      ARG  37   7.204  -7.794   3.639
  291    HD2  ARG  37           HD2      ARG  37   5.468  -8.801   5.089
  292    HD3  ARG  37           HD3      ARG  37   4.344  -8.824   3.725
  293    HE   ARG  37           HE       ARG  37   6.844 -10.250   3.309
  294   HH11  ARG  37          HH11      ARG  37   3.461 -10.547   4.317
  295   HH12  ARG  37          HH12      ARG  37   3.420 -12.262   4.038
  296   HH21  ARG  37          HH21      ARG  37   6.756 -12.488   2.995
  297   HH22  ARG  37          HH22      ARG  37   5.276 -13.350   3.288
  298    H    MET  38           H        MET  38   4.109  -5.278   1.582
  299    HA   MET  38           HA       MET  38   5.407  -6.275  -0.797
  300    HB2  MET  38           HB2      MET  38   2.522  -5.513  -0.241
  301    HB3  MET  38           HB3      MET  38   3.079  -6.203  -1.758
  302    HG2  MET  38           HG2      MET  38   3.381  -7.607   0.908
  303    HG3  MET  38           HG3      MET  38   1.991  -7.818  -0.149
  304    HE1  MET  38           HE1      MET  38   5.365  -9.224   0.864
  305    HE2  MET  38           HE2      MET  38   6.048  -8.073  -0.287
  306    HE3  MET  38           HE3      MET  38   6.110  -9.802  -0.627
  307    H    ALA  39           H        ALA  39   4.587  -3.157   0.441
  308    HA   ALA  39           HA       ALA  39   4.404  -1.671  -1.971
  309    HB1  ALA  39           HB1      ALA  39   3.593  -0.774   0.162
  310    HB2  ALA  39           HB2      ALA  39   4.767   0.319  -0.569
  311    HB3  ALA  39           HB3      ALA  39   5.246  -0.710   0.786
  312    H    ARG  40           H        ARG  40   7.153  -2.426   0.188
  313    HA   ARG  40           HA       ARG  40   9.089  -1.099  -1.477
  314    HB2  ARG  40           HB2      ARG  40  10.789  -2.105   0.019
  315    HB3  ARG  40           HB3      ARG  40   9.512  -1.270   0.897
  316    HG2  ARG  40           HG2      ARG  40   8.434  -3.534   1.268
  317    HG3  ARG  40           HG3      ARG  40   9.911  -4.262   0.625
  318    HD2  ARG  40           HD2      ARG  40   9.948  -4.217   3.070
  319    HD3  ARG  40           HD3      ARG  40  11.211  -3.171   2.417
  320    HE   ARG  40           HE       ARG  40   9.675  -1.265   2.873
  321   HH11  ARG  40          HH11      ARG  40   9.256  -4.228   4.759
  322   HH12  ARG  40          HH12      ARG  40   8.505  -3.411   6.095
  323   HH21  ARG  40          HH21      ARG  40   8.683  -0.222   4.639
  324   HH22  ARG  40          HH22      ARG  40   8.194  -1.146   6.020
  325    H    ASN  41           H        ASN  41   7.414  -3.948  -1.859
  326    HA   ASN  41           HA       ASN  41   9.414  -5.152  -3.679
  327    HB2  ASN  41           HB2      ASN  41   6.846  -6.200  -2.420
  328    HB3  ASN  41           HB3      ASN  41   7.479  -6.953  -3.886
  329   HD21  ASN  41          HD21      ASN  41   8.235  -6.206  -0.533
  330   HD22  ASN  41          HD22      ASN  41   9.401  -7.456  -0.330
  331    H    CYS  42           H        CYS  42   6.680  -3.107  -3.624
  332    HA   CYS  42           HA       CYS  42   6.099  -3.448  -6.485
  333    HB2  CYS  42           HB2      CYS  42   4.220  -3.161  -4.820
  334    HB3  CYS  42           HB3      CYS  42   4.812  -1.536  -4.493
  335    H    GLU  43           H        GLU  43   6.460  -0.476  -4.491
  336    HA   GLU  43           HA       GLU  43   8.556   0.526  -6.341
  337    HB2  GLU  43           HB2      GLU  43   6.548   2.185  -4.743
  338    HB3  GLU  43           HB3      GLU  43   7.806   2.820  -5.802
  339    HG2  GLU  43           HG2      GLU  43   5.410   1.171  -6.649
  340    HG3  GLU  43           HG3      GLU  43   5.609   2.908  -6.868
  341    H    SER  44           H        SER  44   7.344   1.405  -3.079
  342    HA   SER  44           HA       SER  44   9.707   0.729  -1.651
  343    HB2  SER  44           HB2      SER  44  10.357   3.149  -1.074
  344    HB3  SER  44           HB3      SER  44  10.755   2.643  -2.716
  345    HG   SER  44           HG       SER  44   8.380   4.046  -2.027
  Start of MODEL   16
    1    H1   ALA   1           H1       ALA   1  -3.424   7.056  13.164
    2    H2   ALA   1           H2       ALA   1  -3.210   8.582  12.481
    3    H3   ALA   1           H3       ALA   1  -2.178   7.321  12.053
    4    HA   ALA   1           HA       ALA   1  -5.072   7.469  11.475
    5    HB1  ALA   1           HB1      ALA   1  -4.358   7.730   9.113
    6    HB2  ALA   1           HB2      ALA   1  -2.670   7.751   9.633
    7    HB3  ALA   1           HB3      ALA   1  -3.762   9.047  10.123
    8    HA   PRO   2           HA       PRO   2  -4.617   2.988  11.690
    9    HB2  PRO   2           HB2      PRO   2  -6.947   2.264  10.326
   10    HB3  PRO   2           HB3      PRO   2  -6.899   2.770  12.023
   11    HG2  PRO   2           HG2      PRO   2  -7.577   4.396   9.594
   12    HG3  PRO   2           HG3      PRO   2  -8.377   4.365  11.185
   13    HD2  PRO   2           HD2      PRO   2  -6.684   6.349  10.532
   14    HD3  PRO   2           HD3      PRO   2  -6.730   5.703  12.189
   15    H    CYS   3           H        CYS   3  -5.786   4.127   8.488
   16    HA   CYS   3           HA       CYS   3  -3.511   2.851   7.148
   17    HB2  CYS   3           HB2      CYS   3  -5.375   1.154   7.218
   18    HB3  CYS   3           HB3      CYS   3  -6.384   2.273   6.309
   19    H    GLU   4           H        GLU   4  -5.170   5.527   7.697
   20    HA   GLU   4           HA       GLU   4  -5.799   6.603   5.135
   21    HB2  GLU   4           HB2      GLU   4  -5.157   8.213   7.643
   22    HB3  GLU   4           HB3      GLU   4  -6.131   8.710   6.264
   23    HG2  GLU   4           HG2      GLU   4  -7.858   7.067   6.866
   24    HG3  GLU   4           HG3      GLU   4  -6.876   6.521   8.225
   25    H    ASP   5           H        ASP   5  -3.100   7.103   7.399
   26    HA   ASP   5           HA       ASP   5  -1.449   8.742   5.879
   27    HB2  ASP   5           HB2      ASP   5  -1.015   8.363   8.262
   28    HB3  ASP   5           HB3      ASP   5  -0.689   6.657   7.983
   29    H    LEU   6           H        LEU   6  -1.722   5.207   5.991
   30    HA   LEU   6           HA       LEU   6   0.555   4.676   4.400
   31    HB2  LEU   6           HB2      LEU   6  -0.430   3.032   5.946
   32    HB3  LEU   6           HB3      LEU   6  -1.847   2.894   4.926
   33    HG   LEU   6           HG       LEU   6   0.762   2.325   3.538
   34   HD11  LEU   6          HD11      LEU   6   1.039   0.081   4.428
   35   HD12  LEU   6          HD12      LEU   6  -0.269   0.346   5.582
   36   HD13  LEU   6          HD13      LEU   6   1.222   1.284   5.708
   37   HD21  LEU   6          HD21      LEU   6  -0.530   0.468   2.521
   38   HD22  LEU   6          HD22      LEU   6  -1.349   2.017   2.338
   39   HD23  LEU   6          HD23      LEU   6  -1.907   0.868   3.554
   40    H    LYS   7           H        LYS   7  -2.949   4.892   3.585
   41    HA   LYS   7           HA       LYS   7  -2.688   4.099   0.880
   42    HB2  LYS   7           HB2      LYS   7  -4.846   4.174   2.221
   43    HB3  LYS   7           HB3      LYS   7  -4.861   5.922   1.997
   44    HG2  LYS   7           HG2      LYS   7  -4.847   5.490  -0.519
   45    HG3  LYS   7           HG3      LYS   7  -5.071   3.782  -0.151
   46    HD2  LYS   7           HD2      LYS   7  -7.262   4.502  -0.582
   47    HD3  LYS   7           HD3      LYS   7  -7.190   4.568   1.179
   48    HE2  LYS   7           HE2      LYS   7  -6.852   6.935  -0.701
   49    HE3  LYS   7           HE3      LYS   7  -8.304   6.554   0.218
   50    HZ1  LYS   7           HZ1      LYS   7  -6.864   6.800   2.256
   51    HZ2  LYS   7           HZ2      LYS   7  -7.198   8.213   1.400
   52    HZ3  LYS   7           HZ3      LYS   7  -5.687   7.480   1.245
   53    H    GLU   8           H        GLU   8  -2.632   7.283   2.435
   54    HA   GLU   8           HA       GLU   8  -2.332   8.839   0.065
   55    HB2  GLU   8           HB2      GLU   8  -1.610   9.505   2.947
   56    HB3  GLU   8           HB3      GLU   8  -1.648  10.665   1.622
   57    HG2  GLU   8           HG2      GLU   8  -4.005   9.125   2.722
   58    HG3  GLU   8           HG3      GLU   8  -3.658  10.831   2.988
   59    H    ARG   9           H        ARG   9  -0.078   7.180   2.199
   60    HA   ARG   9           HA       ARG   9   2.371   8.262   1.297
   61    HB2  ARG   9           HB2      ARG   9   1.905   6.767   3.367
   62    HB3  ARG   9           HB3      ARG   9   1.979   5.400   2.256
   63    HG2  ARG   9           HG2      ARG   9   4.315   6.213   1.624
   64    HG3  ARG   9           HG3      ARG   9   4.193   7.327   2.988
   65    HD2  ARG   9           HD2      ARG   9   4.176   4.302   3.048
   66    HD3  ARG   9           HD3      ARG   9   5.370   5.388   3.759
   67    HE   ARG   9           HE       ARG   9   3.277   6.127   5.162
   68   HH11  ARG   9          HH11      ARG   9   4.167   2.814   4.321
   69   HH12  ARG   9          HH12      ARG   9   3.414   2.142   5.735
   70   HH21  ARG   9          HH21      ARG   9   2.257   5.211   6.965
   71   HH22  ARG   9          HH22      ARG   9   2.334   3.500   7.228
   72    H    LEU  10           H        LEU  10   0.262   5.652   0.165
   73    HA   LEU  10           HA       LEU  10   1.998   4.431  -1.725
   74    HB2  LEU  10           HB2      LEU  10  -1.046   4.538  -1.917
   75    HB3  LEU  10           HB3      LEU  10   0.023   3.341  -2.634
   76    HG   LEU  10           HG       LEU  10  -0.607   3.676   0.307
   77   HD11  LEU  10          HD11      LEU  10  -2.427   2.669  -0.934
   78   HD12  LEU  10          HD12      LEU  10  -1.679   1.492   0.143
   79   HD13  LEU  10          HD13      LEU  10  -1.336   1.444  -1.589
   80   HD21  LEU  10          HD21      LEU  10   1.319   1.723  -0.980
   81   HD22  LEU  10          HD22      LEU  10   0.760   1.639   0.691
   82   HD23  LEU  10          HD23      LEU  10   1.713   3.018   0.155
   83    H    LYS  11           H        LYS  11  -0.530   6.905  -1.998
   84    HA   LYS  11           HA       LYS  11  -0.322   7.408  -4.788
   85    HB2  LYS  11           HB2      LYS  11  -1.309   9.264  -2.575
   86    HB3  LYS  11           HB3      LYS  11  -1.637   9.450  -4.298
   87    HG2  LYS  11           HG2      LYS  11  -2.954   7.373  -4.302
   88    HG3  LYS  11           HG3      LYS  11  -2.569   7.108  -2.599
   89    HD2  LYS  11           HD2      LYS  11  -4.813   8.032  -2.749
   90    HD3  LYS  11           HD3      LYS  11  -3.748   9.242  -2.032
   91    HE2  LYS  11           HE2      LYS  11  -5.232  10.312  -3.638
   92    HE3  LYS  11           HE3      LYS  11  -3.581  10.365  -4.256
   93    HZ1  LYS  11           HZ1      LYS  11  -5.662   8.410  -5.070
   94    HZ2  LYS  11           HZ2      LYS  11  -4.098   8.504  -5.700
   95    HZ3  LYS  11           HZ3      LYS  11  -5.191   9.760  -5.965
   96    H    LYS  12           H        LYS  12   1.362   8.676  -1.987
   97    HA   LYS  12           HA       LYS  12   2.761  10.825  -3.287
   98    HB2  LYS  12           HB2      LYS  12   2.222  10.839  -0.866
   99    HB3  LYS  12           HB3      LYS  12   3.230   9.417  -0.618
  100    HG2  LYS  12           HG2      LYS  12   4.343  11.459   0.158
  101    HG3  LYS  12           HG3      LYS  12   5.240  10.703  -1.163
  102    HD2  LYS  12           HD2      LYS  12   4.395  12.368  -2.739
  103    HD3  LYS  12           HD3      LYS  12   3.372  13.091  -1.491
  104    HE2  LYS  12           HE2      LYS  12   5.386  13.757  -0.225
  105    HE3  LYS  12           HE3      LYS  12   6.414  12.997  -1.444
  106    HZ1  LYS  12           HZ1      LYS  12   6.260  15.376  -1.778
  107    HZ2  LYS  12           HZ2      LYS  12   4.581  15.287  -1.914
  108    HZ3  LYS  12           HZ3      LYS  12   5.561  14.560  -3.081
  109    H    LEU  13           H        LEU  13   3.447   7.438  -2.574
  110    HA   LEU  13           HA       LEU  13   6.304   7.619  -3.095
  111    HB2  LEU  13           HB2      LEU  13   5.296   6.151  -1.328
  112    HB3  LEU  13           HB3      LEU  13   4.493   5.215  -2.573
  113    HG   LEU  13           HG       LEU  13   6.695   4.403  -3.390
  114   HD11  LEU  13          HD11      LEU  13   7.886   6.020  -1.116
  115   HD12  LEU  13          HD12      LEU  13   8.105   6.314  -2.844
  116   HD13  LEU  13          HD13      LEU  13   8.757   4.850  -2.113
  117   HD21  LEU  13          HD21      LEU  13   6.237   4.008  -0.402
  118   HD22  LEU  13          HD22      LEU  13   7.261   2.984  -1.419
  119   HD23  LEU  13          HD23      LEU  13   5.526   3.063  -1.716
  120    H    GLY  14           H        GLY  14   3.370   6.798  -4.778
  121    HA2  GLY  14           HA2      GLY  14   2.936   6.614  -7.011
  122    HA3  GLY  14           HA3      GLY  14   4.643   6.833  -7.343
  123    H    MET  15           H        MET  15   2.086   4.503  -6.936
  124    HA   MET  15           HA       MET  15   3.721   2.629  -8.448
  125    HB2  MET  15           HB2      MET  15   2.815   0.689  -7.163
  126    HB3  MET  15           HB3      MET  15   3.869   1.713  -6.199
  127    HG2  MET  15           HG2      MET  15   0.872   1.999  -6.094
  128    HG3  MET  15           HG3      MET  15   1.730   0.830  -5.098
  129    HE1  MET  15           HE1      MET  15   3.806   3.026  -2.713
  130    HE2  MET  15           HE2      MET  15   4.312   2.129  -4.145
  131    HE3  MET  15           HE3      MET  15   3.151   1.417  -3.018
  132    H    SER  16           H        SER  16   2.328   0.953  -9.515
  133    HA   SER  16           HA       SER  16   0.360   2.058 -11.170
  134    HB2  SER  16           HB2      SER  16   0.742  -0.869 -10.382
  135    HB3  SER  16           HB3      SER  16  -0.161  -0.302 -11.793
  136    HG   SER  16           HG       SER  16   2.559  -0.528 -11.402
  137    H    GLU  17           H        GLU  17  -2.024   1.726 -11.213
  138    HA   GLU  17           HA       GLU  17  -3.155   2.347  -8.700
  139    HB2  GLU  17           HB2      GLU  17  -4.115   3.053 -10.917
  140    HB3  GLU  17           HB3      GLU  17  -4.757   1.417 -11.106
  141    HG2  GLU  17           HG2      GLU  17  -6.063   1.688  -9.011
  142    HG3  GLU  17           HG3      GLU  17  -5.414   3.316  -8.809
  143    H    GLU  18           H        GLU  18  -3.065  -0.632 -10.530
  144    HA   GLU  18           HA       GLU  18  -4.605  -2.367  -9.030
  145    HB2  GLU  18           HB2      GLU  18  -3.606  -2.942 -11.211
  146    HB3  GLU  18           HB3      GLU  18  -1.991  -2.858 -10.521
  147    HG2  GLU  18           HG2      GLU  18  -2.631  -4.810  -9.033
  148    HG3  GLU  18           HG3      GLU  18  -4.122  -4.942  -9.962
  149    H    CYS  19           H        CYS  19  -1.475  -1.005  -8.328
  150    HA   CYS  19           HA       CYS  19  -0.591  -3.037  -6.503
  151    HB2  CYS  19           HB2      CYS  19   0.969  -1.484  -7.835
  152    HB3  CYS  19           HB3      CYS  19   0.512  -0.218  -6.722
  153    H    ARG  20           H        ARG  20  -1.855   0.332  -6.207
  154    HA   ARG  20           HA       ARG  20  -1.761   0.387  -3.363
  155    HB2  ARG  20           HB2      ARG  20  -3.801   1.993  -4.975
  156    HB3  ARG  20           HB3      ARG  20  -3.192   2.323  -3.358
  157    HG2  ARG  20           HG2      ARG  20  -2.003   3.848  -4.583
  158    HG3  ARG  20           HG3      ARG  20  -0.863   2.510  -4.577
  159    HD2  ARG  20           HD2      ARG  20  -0.945   3.335  -6.802
  160    HD3  ARG  20           HD3      ARG  20  -1.884   1.828  -6.772
  161    HE   ARG  20           HE       ARG  20  -3.902   3.127  -6.763
  162   HH11  ARG  20          HH11      ARG  20  -1.013   4.910  -7.728
  163   HH12  ARG  20          HH12      ARG  20  -1.911   6.144  -8.552
  164   HH21  ARG  20          HH21      ARG  20  -5.041   4.767  -7.817
  165   HH22  ARG  20          HH22      ARG  20  -4.195   6.062  -8.604
  166    H    GLN  21           H        GLN  21  -4.164  -0.712  -5.676
  167    HA   GLN  21           HA       GLN  21  -6.335  -1.141  -3.992
  168    HB2  GLN  21           HB2      GLN  21  -5.467  -2.629  -6.494
  169    HB3  GLN  21           HB3      GLN  21  -7.011  -2.918  -5.697
  170    HG2  GLN  21           HG2      GLN  21  -7.747  -0.658  -6.170
  171    HG3  GLN  21           HG3      GLN  21  -6.156  -0.229  -6.804
  172   HE21  GLN  21          HE21      GLN  21  -7.005   0.350  -8.834
  173   HE22  GLN  21          HE22      GLN  21  -7.591  -0.821  -9.963
  174    H    ARG  22           H        ARG  22  -3.485  -3.088  -4.693
  175    HA   ARG  22           HA       ARG  22  -4.222  -5.440  -3.191
  176    HB2  ARG  22           HB2      ARG  22  -1.588  -4.438  -4.342
  177    HB3  ARG  22           HB3      ARG  22  -1.701  -5.938  -3.443
  178    HG2  ARG  22           HG2      ARG  22  -3.157  -6.906  -5.125
  179    HG3  ARG  22           HG3      ARG  22  -3.216  -5.377  -6.007
  180    HD2  ARG  22           HD2      ARG  22  -0.898  -5.529  -6.604
  181    HD3  ARG  22           HD3      ARG  22  -0.620  -6.857  -5.473
  182    HE   ARG  22           HE       ARG  22  -2.520  -7.746  -7.299
  183   HH11  ARG  22          HH11      ARG  22   0.845  -6.703  -7.404
  184   HH12  ARG  22          HH12      ARG  22   1.245  -7.716  -8.759
  185   HH21  ARG  22          HH21      ARG  22  -1.957  -9.121  -9.026
  186   HH22  ARG  22          HH22      ARG  22  -0.346  -9.084  -9.674
  187    H    LEU  23           H        LEU  23  -2.397  -2.471  -2.570
  188    HA   LEU  23           HA       LEU  23  -1.077  -3.401  -0.200
  189    HB2  LEU  23           HB2      LEU  23  -1.405  -0.578  -1.293
  190    HB3  LEU  23           HB3      LEU  23  -0.289  -1.058  -0.031
  191    HG   LEU  23           HG       LEU  23  -0.191  -2.018  -2.901
  192   HD11  LEU  23          HD11      LEU  23   0.480   0.320  -2.742
  193   HD12  LEU  23          HD12      LEU  23   1.829  -0.725  -3.188
  194   HD13  LEU  23          HD13      LEU  23   1.698  -0.110  -1.536
  195   HD21  LEU  23          HD21      LEU  23   1.930  -3.070  -2.360
  196   HD22  LEU  23          HD22      LEU  23   0.620  -3.741  -1.394
  197   HD23  LEU  23          HD23      LEU  23   1.754  -2.596  -0.670
  198    H    GLU  24           H        GLU  24  -3.762  -1.092  -0.792
  199    HA   GLU  24           HA       GLU  24  -4.474  -0.648   1.888
  200    HB2  GLU  24           HB2      GLU  24  -6.579   0.228   1.081
  201    HB3  GLU  24           HB3      GLU  24  -5.326   0.719  -0.054
  202    HG2  GLU  24           HG2      GLU  24  -6.024  -0.967  -1.655
  203    HG3  GLU  24           HG3      GLU  24  -7.153  -1.664  -0.496
  204    H    LYS  25           H        LYS  25  -5.197  -3.286  -0.331
  205    HA   LYS  25           HA       LYS  25  -7.391  -4.441   1.038
  206    HB2  LYS  25           HB2      LYS  25  -6.819  -4.996  -1.310
  207    HB3  LYS  25           HB3      LYS  25  -5.314  -5.740  -0.790
  208    HG2  LYS  25           HG2      LYS  25  -7.013  -7.432  -1.353
  209    HG3  LYS  25           HG3      LYS  25  -6.556  -7.528   0.350
  210    HD2  LYS  25           HD2      LYS  25  -8.984  -7.785   0.091
  211    HD3  LYS  25           HD3      LYS  25  -8.618  -6.302   0.973
  212    HE2  LYS  25           HE2      LYS  25  -8.858  -5.069  -1.255
  213    HE3  LYS  25           HE3      LYS  25  -9.490  -6.575  -1.923
  214    HZ1  LYS  25           HZ1      LYS  25 -10.648  -4.981   0.288
  215    HZ2  LYS  25           HZ2      LYS  25 -11.217  -6.497  -0.182
  216    HZ3  LYS  25           HZ3      LYS  25 -11.291  -5.196  -1.259
  217    H    MET  26           H        MET  26  -3.908  -4.965   1.171
  218    HA   MET  26           HA       MET  26  -3.939  -6.954   3.234
  219    HB2  MET  26           HB2      MET  26  -1.738  -5.163   2.129
  220    HB3  MET  26           HB3      MET  26  -1.468  -6.443   3.301
  221    HG2  MET  26           HG2      MET  26  -2.643  -6.963   0.566
  222    HG3  MET  26           HG3      MET  26  -0.919  -7.008   0.906
  223    HE1  MET  26           HE1      MET  26  -4.111  -9.123   0.693
  224    HE2  MET  26           HE2      MET  26  -4.360  -8.555   2.344
  225    HE3  MET  26           HE3      MET  26  -3.990 -10.251   2.044
  226    H    CYS  27           H        CYS  27  -3.728  -3.471   3.115
  227    HA   CYS  27           HA       CYS  27  -2.780  -2.975   5.756
  228    HB2  CYS  27           HB2      CYS  27  -2.447  -1.399   3.904
  229    HB3  CYS  27           HB3      CYS  27  -4.182  -1.161   3.756
  230    H    LYS  28           H        LYS  28  -5.932  -3.503   4.386
  231    HA   LYS  28           HA       LYS  28  -7.335  -2.666   6.850
  232    HB2  LYS  28           HB2      LYS  28  -8.469  -3.485   4.129
  233    HB3  LYS  28           HB3      LYS  28  -9.408  -2.896   5.501
  234    HG2  LYS  28           HG2      LYS  28  -8.441  -0.694   5.320
  235    HG3  LYS  28           HG3      LYS  28  -7.270  -1.251   4.115
  236    HD2  LYS  28           HD2      LYS  28  -9.217  -1.798   2.595
  237    HD3  LYS  28           HD3      LYS  28 -10.286  -1.031   3.773
  238    HE2  LYS  28           HE2      LYS  28  -9.017   1.095   3.473
  239    HE3  LYS  28           HE3      LYS  28  -8.029   0.292   2.242
  240    HZ1  LYS  28           HZ1      LYS  28 -10.981   0.484   2.050
  241    HZ2  LYS  28           HZ2      LYS  28  -9.884   0.069   0.830
  242    HZ3  LYS  28           HZ3      LYS  28  -9.947   1.656   1.412
  243    H    GLU  29           H        GLU  29  -7.533  -5.306   4.448
  244    HA   GLU  29           HA       GLU  29  -8.474  -7.201   6.479
  245    HB2  GLU  29           HB2      GLU  29  -8.258  -7.541   3.447
  246    HB3  GLU  29           HB3      GLU  29  -9.054  -8.648   4.566
  247    HG2  GLU  29           HG2      GLU  29 -10.649  -6.808   5.165
  248    HG3  GLU  29           HG3      GLU  29  -9.897  -5.807   3.927
  249    H    GLY  30           H        GLY  30  -6.433  -7.166   7.544
  250    HA2  GLY  30           HA2      GLY  30  -4.717  -9.203   7.543
  251    HA3  GLY  30           HA3      GLY  30  -4.024  -8.226   6.242
  252    H    THR  31           H        THR  31  -2.322  -7.091   7.039
  253    HA   THR  31           HA       THR  31  -2.877  -5.125   9.158
  254    HB   THR  31           HB       THR  31  -0.399  -5.395   9.954
  255    HG1  THR  31           HG1      THR  31  -0.442  -7.304   8.123
  256   HG21  THR  31          HG21      THR  31  -2.345  -6.018  11.382
  257   HG22  THR  31          HG22      THR  31  -0.952  -7.071  11.636
  258   HG23  THR  31          HG23      THR  31  -2.318  -7.637  10.674
  259    H    SER  32           H        SER  32  -1.664  -3.187   8.924
  260    HA   SER  32           HA       SER  32  -1.033  -2.314   6.332
  261    HB2  SER  32           HB2      SER  32  -0.112  -1.056   8.953
  262    HB3  SER  32           HB3      SER  32  -0.290  -0.238   7.398
  263    HG   SER  32           HG       SER  32  -2.343  -0.002   7.805
  264    H    GLU  33           H        GLU  33   0.839  -4.117   8.550
  265    HA   GLU  33           HA       GLU  33   3.473  -3.639   7.770
  266    HB2  GLU  33           HB2      GLU  33   2.182  -6.281   8.569
  267    HB3  GLU  33           HB3      GLU  33   3.910  -5.943   8.576
  268    HG2  GLU  33           HG2      GLU  33   1.833  -4.590  10.313
  269    HG3  GLU  33           HG3      GLU  33   2.942  -5.856  10.830
  270    H    ASP  34           H        ASP  34   1.118  -6.038   6.444
  271    HA   ASP  34           HA       ASP  34   2.775  -7.171   4.468
  272    HB2  ASP  34           HB2      ASP  34  -0.259  -6.856   4.341
  273    HB3  ASP  34           HB3      ASP  34   0.694  -7.984   3.384
  274    H    ALA  35           H        ALA  35   0.620  -4.435   4.440
  275    HA   ALA  35           HA       ALA  35   0.588  -3.712   1.750
  276    HB1  ALA  35           HB1      ALA  35  -0.958  -2.817   3.429
  277    HB2  ALA  35           HB2      ALA  35  -0.145  -1.512   2.560
  278    HB3  ALA  35           HB3      ALA  35   0.361  -1.938   4.199
  279    H    GLU  36           H        GLU  36   2.761  -2.559   4.384
  280    HA   GLU  36           HA       GLU  36   4.118  -0.690   2.691
  281    HB2  GLU  36           HB2      GLU  36   5.602  -0.262   4.591
  282    HB3  GLU  36           HB3      GLU  36   3.928  -0.321   5.128
  283    HG2  GLU  36           HG2      GLU  36   4.266  -2.588   6.008
  284    HG3  GLU  36           HG3      GLU  36   5.926  -2.585   5.423
  285    H    ARG  37           H        ARG  37   4.760  -4.028   3.650
  286    HA   ARG  37           HA       ARG  37   7.458  -4.181   2.723
  287    HB2  ARG  37           HB2      ARG  37   5.458  -6.474   2.938
  288    HB3  ARG  37           HB3      ARG  37   7.208  -6.632   2.814
  289    HG2  ARG  37           HG2      ARG  37   5.624  -5.538   5.145
  290    HG3  ARG  37           HG3      ARG  37   6.566  -7.019   5.095
  291    HD2  ARG  37           HD2      ARG  37   8.642  -5.732   4.978
  292    HD3  ARG  37           HD3      ARG  37   7.735  -4.217   4.885
  293    HE   ARG  37           HE       ARG  37   7.075  -5.713   7.230
  294   HH11  ARG  37          HH11      ARG  37   9.532  -3.528   5.951
  295   HH12  ARG  37          HH12      ARG  37  10.008  -2.969   7.525
  296   HH21  ARG  37          HH21      ARG  37   7.720  -4.966   9.265
  297   HH22  ARG  37          HH22      ARG  37   8.982  -3.783   9.394
  298    H    MET  38           H        MET  38   4.304  -4.776   1.188
  299    HA   MET  38           HA       MET  38   5.453  -5.639  -1.321
  300    HB2  MET  38           HB2      MET  38   2.600  -4.932  -0.527
  301    HB3  MET  38           HB3      MET  38   3.048  -5.489  -2.132
  302    HG2  MET  38           HG2      MET  38   3.528  -7.133   0.359
  303    HG3  MET  38           HG3      MET  38   2.039  -7.212  -0.568
  304    HE1  MET  38           HE1      MET  38   5.605  -8.623  -0.158
  305    HE2  MET  38           HE2      MET  38   6.024  -7.379  -1.335
  306    HE3  MET  38           HE3      MET  38   6.083  -9.079  -1.794
  307    H    ALA  39           H        ALA  39   4.461  -2.605   0.132
  308    HA   ALA  39           HA       ALA  39   4.027  -1.049  -2.207
  309    HB1  ALA  39           HB1      ALA  39   4.155   0.900  -0.704
  310    HB2  ALA  39           HB2      ALA  39   4.819  -0.119   0.578
  311    HB3  ALA  39           HB3      ALA  39   3.171  -0.383   0.005
  312    H    ARG  40           H        ARG  40   6.859  -1.400  -0.089
  313    HA   ARG  40           HA       ARG  40   8.559   0.384  -1.534
  314    HB2  ARG  40           HB2      ARG  40  10.375  -0.546  -0.116
  315    HB3  ARG  40           HB3      ARG  40   8.957  -0.083   0.816
  316    HG2  ARG  40           HG2      ARG  40   8.259  -2.492   0.872
  317    HG3  ARG  40           HG3      ARG  40   9.769  -2.907   0.059
  318    HD2  ARG  40           HD2      ARG  40   9.560  -1.532   2.756
  319    HD3  ARG  40           HD3      ARG  40   9.859  -3.257   2.509
  320    HE   ARG  40           HE       ARG  40  11.821  -1.975   1.070
  321   HH11  ARG  40          HH11      ARG  40  10.836  -2.029   4.444
  322   HH12  ARG  40          HH12      ARG  40  12.434  -1.717   5.046
  323   HH21  ARG  40          HH21      ARG  40  13.914  -1.555   1.860
  324   HH22  ARG  40          HH22      ARG  40  14.182  -1.444   3.573
  325    H    ASN  41           H        ASN  41   7.899  -3.066  -1.759
  326    HA   ASN  41           HA       ASN  41  10.036  -3.576  -3.691
  327    HB2  ASN  41           HB2      ASN  41   7.927  -5.327  -2.388
  328    HB3  ASN  41           HB3      ASN  41   8.762  -5.897  -3.827
  329   HD21  ASN  41          HD21      ASN  41   9.071  -5.278  -0.425
  330   HD22  ASN  41          HD22      ASN  41  10.652  -5.934  -0.254
  331    H    CYS  42           H        CYS  42   6.848  -2.424  -3.772
  332    HA   CYS  42           HA       CYS  42   6.213  -3.148  -6.503
  333    HB2  CYS  42           HB2      CYS  42   4.474  -2.695  -4.722
  334    HB3  CYS  42           HB3      CYS  42   4.938  -1.007  -4.751
  335    H    GLU  43           H        GLU  43   6.436   0.108  -5.041
  336    HA   GLU  43           HA       GLU  43   6.824   2.128  -5.998
  337    HB2  GLU  43           HB2      GLU  43   8.932   1.461  -4.875
  338    HB3  GLU  43           HB3      GLU  43   9.541   0.828  -6.406
  339    HG2  GLU  43           HG2      GLU  43   9.356   3.128  -7.386
  340    HG3  GLU  43           HG3      GLU  43   8.843   3.730  -5.811
  341    H    SER  44           H        SER  44   5.505   2.242  -7.745
  342    HA   SER  44           HA       SER  44   4.854   2.711  -9.836
  343    HB2  SER  44           HB2      SER  44   7.071   3.896 -10.060
  344    HB3  SER  44           HB3      SER  44   7.762   2.410 -10.719
  345    HG   SER  44           HG       SER  44   5.815   2.650 -12.246
  Start of MODEL   17
    1    H1   ALA   1           H1       ALA   1  -5.228   4.052  14.264
    2    H2   ALA   1           H2       ALA   1  -4.829   5.691  14.317
    3    H3   ALA   1           H3       ALA   1  -3.688   4.560  13.790
    4    HA   ALA   1           HA       ALA   1  -6.213   5.274  12.430
    5    HB1  ALA   1           HB1      ALA   1  -4.733   6.221  10.681
    6    HB2  ALA   1           HB2      ALA   1  -3.320   5.795  11.651
    7    HB3  ALA   1           HB3      ALA   1  -4.462   7.001  12.242
    8    HA   PRO   2           HA       PRO   2  -5.919   1.071  10.862
    9    HB2  PRO   2           HB2      PRO   2  -7.626   1.944   8.565
   10    HB3  PRO   2           HB3      PRO   2  -7.970   0.749   9.834
   11    HG2  PRO   2           HG2      PRO   2  -9.226   3.103   9.821
   12    HG3  PRO   2           HG3      PRO   2  -8.710   2.355  11.353
   13    HD2  PRO   2           HD2      PRO   2  -7.340   4.555   9.789
   14    HD3  PRO   2           HD3      PRO   2  -7.691   4.465  11.532
   15    H    CYS   3           H        CYS   3  -5.992   3.304   8.058
   16    HA   CYS   3           HA       CYS   3  -3.478   2.195   6.995
   17    HB2  CYS   3           HB2      CYS   3  -6.058   2.340   5.351
   18    HB3  CYS   3           HB3      CYS   3  -4.492   1.754   4.790
   19    H    GLU   4           H        GLU   4  -4.523   4.843   8.126
   20    HA   GLU   4           HA       GLU   4  -5.160   6.660   6.081
   21    HB2  GLU   4           HB2      GLU   4  -4.096   7.088   8.893
   22    HB3  GLU   4           HB3      GLU   4  -4.522   8.436   7.845
   23    HG2  GLU   4           HG2      GLU   4  -6.434   6.243   8.707
   24    HG3  GLU   4           HG3      GLU   4  -6.313   7.831   9.463
   25    H    ASP   5           H        ASP   5  -1.994   6.192   7.717
   26    HA   ASP   5           HA       ASP   5  -0.593   8.185   6.249
   27    HB2  ASP   5           HB2      ASP   5   0.441   5.745   7.753
   28    HB3  ASP   5           HB3      ASP   5   1.475   7.031   7.140
   29    H    LEU   6           H        LEU   6  -1.085   4.743   5.839
   30    HA   LEU   6           HA       LEU   6   0.791   4.274   3.760
   31    HB2  LEU   6           HB2      LEU   6  -0.227   2.639   5.423
   32    HB3  LEU   6           HB3      LEU   6  -1.683   2.652   4.449
   33    HG   LEU   6           HG       LEU   6   0.934   1.891   3.113
   34   HD11  LEU   6          HD11      LEU   6  -0.715  -0.002   4.798
   35   HD12  LEU   6          HD12      LEU   6   0.888   0.617   5.210
   36   HD13  LEU   6          HD13      LEU   6   0.684  -0.417   3.800
   37   HD21  LEU   6          HD21      LEU   6  -1.928   0.924   2.720
   38   HD22  LEU   6          HD22      LEU   6  -0.531   0.404   1.772
   39   HD23  LEU   6          HD23      LEU   6  -1.075   2.077   1.692
   40    H    LYS   7           H        LYS   7  -2.605   5.119   3.847
   41    HA   LYS   7           HA       LYS   7  -3.358   4.762   1.155
   42    HB2  LYS   7           HB2      LYS   7  -4.992   5.020   2.933
   43    HB3  LYS   7           HB3      LYS   7  -4.346   6.595   3.368
   44    HG2  LYS   7           HG2      LYS   7  -5.159   7.470   1.141
   45    HG3  LYS   7           HG3      LYS   7  -5.925   5.897   0.871
   46    HD2  LYS   7           HD2      LYS   7  -7.548   7.558   1.768
   47    HD3  LYS   7           HD3      LYS   7  -7.327   6.203   2.879
   48    HE2  LYS   7           HE2      LYS   7  -5.767   7.605   4.240
   49    HE3  LYS   7           HE3      LYS   7  -6.035   8.951   3.131
   50    HZ1  LYS   7           HZ1      LYS   7  -8.380   8.919   3.759
   51    HZ2  LYS   7           HZ2      LYS   7  -7.387   9.170   5.103
   52    HZ3  LYS   7           HZ3      LYS   7  -8.092   7.655   4.840
   53    H    GLU   8           H        GLU   8  -1.943   7.478   2.909
   54    HA   GLU   8           HA       GLU   8  -1.905   9.230   0.625
   55    HB2  GLU   8           HB2      GLU   8  -0.472   9.491   3.292
   56    HB3  GLU   8           HB3      GLU   8  -0.659  10.767   2.090
   57    HG2  GLU   8           HG2      GLU   8  -2.866   9.435   3.678
   58    HG3  GLU   8           HG3      GLU   8  -2.275  11.078   3.887
   59    H    ARG   9           H        ARG   9   0.320   6.902   2.063
   60    HA   ARG   9           HA       ARG   9   2.634   7.573   0.541
   61    HB2  ARG   9           HB2      ARG   9   1.720   4.939   1.770
   62    HB3  ARG   9           HB3      ARG   9   3.265   5.111   0.939
   63    HG2  ARG   9           HG2      ARG   9   4.033   6.725   2.569
   64    HG3  ARG   9           HG3      ARG   9   2.454   6.747   3.358
   65    HD2  ARG   9           HD2      ARG   9   2.723   4.403   4.025
   66    HD3  ARG   9           HD3      ARG   9   4.273   4.317   3.176
   67    HE   ARG   9           HE       ARG   9   4.667   6.363   4.871
   68   HH11  ARG   9          HH11      ARG   9   3.561   3.062   5.412
   69   HH12  ARG   9          HH12      ARG   9   4.193   2.973   7.021
   70   HH21  ARG   9          HH21      ARG   9   5.462   6.265   6.989
   71   HH22  ARG   9          HH22      ARG   9   5.281   4.810   7.915
   72    H    LEU  10           H        LEU  10  -0.278   5.729  -0.200
   73    HA   LEU  10           HA       LEU  10   0.572   4.396  -2.536
   74    HB2  LEU  10           HB2      LEU  10  -2.207   5.456  -1.881
   75    HB3  LEU  10           HB3      LEU  10  -1.842   4.263  -3.116
   76    HG   LEU  10           HG       LEU  10  -1.596   3.893  -0.110
   77   HD11  LEU  10          HD11      LEU  10  -3.432   2.559  -2.104
   78   HD12  LEU  10          HD12      LEU  10  -3.884   3.776  -0.905
   79   HD13  LEU  10          HD13      LEU  10  -3.319   2.194  -0.378
   80   HD21  LEU  10          HD21      LEU  10  -0.828   1.948  -2.301
   81   HD22  LEU  10          HD22      LEU  10  -0.934   1.564  -0.582
   82   HD23  LEU  10          HD23      LEU  10   0.259   2.727  -1.147
   83    H    LYS  11           H        LYS  11  -0.996   7.562  -2.090
   84    HA   LYS  11           HA       LYS  11  -0.792   8.230  -4.901
   85    HB2  LYS  11           HB2      LYS  11  -1.889  10.383  -4.229
   86    HB3  LYS  11           HB3      LYS  11  -2.788   8.936  -3.833
   87    HG2  LYS  11           HG2      LYS  11  -3.126  10.221  -1.936
   88    HG3  LYS  11           HG3      LYS  11  -1.766   9.217  -1.440
   89    HD2  LYS  11           HD2      LYS  11  -1.463  11.562  -0.732
   90    HD3  LYS  11           HD3      LYS  11  -0.210  11.090  -1.882
   91    HE2  LYS  11           HE2      LYS  11  -1.444  12.260  -3.688
   92    HE3  LYS  11           HE3      LYS  11  -2.703  12.708  -2.537
   93    HZ1  LYS  11           HZ1      LYS  11  -1.128  14.023  -1.327
   94    HZ2  LYS  11           HZ2      LYS  11  -1.109  14.500  -2.949
   95    HZ3  LYS  11           HZ3      LYS  11   0.139  13.537  -2.334
   96    H    LYS  12           H        LYS  12   1.136   8.833  -2.048
   97    HA   LYS  12           HA       LYS  12   2.564  11.152  -3.001
   98    HB2  LYS  12           HB2      LYS  12   2.328  10.642  -0.597
   99    HB3  LYS  12           HB3      LYS  12   3.268   9.164  -0.808
  100    HG2  LYS  12           HG2      LYS  12   5.255  10.512  -1.415
  101    HG3  LYS  12           HG3      LYS  12   4.313  11.994  -1.224
  102    HD2  LYS  12           HD2      LYS  12   4.928   9.980   0.966
  103    HD3  LYS  12           HD3      LYS  12   5.715  11.543   0.758
  104    HE2  LYS  12           HE2      LYS  12   3.485  12.654   1.113
  105    HE3  LYS  12           HE3      LYS  12   2.787  11.069   1.439
  106    HZ1  LYS  12           HZ1      LYS  12   4.256  10.853   3.332
  107    HZ2  LYS  12           HZ2      LYS  12   3.317  12.250   3.465
  108    HZ3  LYS  12           HZ3      LYS  12   4.945  12.361   3.013
  109    H    LEU  13           H        LEU  13   3.243   7.703  -2.782
  110    HA   LEU  13           HA       LEU  13   5.911   7.888  -3.865
  111    HB2  LEU  13           HB2      LEU  13   4.921   6.209  -2.137
  112    HB3  LEU  13           HB3      LEU  13   4.237   5.370  -3.510
  113    HG   LEU  13           HG       LEU  13   7.245   5.817  -3.268
  114   HD11  LEU  13          HD11      LEU  13   6.466   4.699  -1.204
  115   HD12  LEU  13          HD12      LEU  13   7.447   3.625  -2.206
  116   HD13  LEU  13          HD13      LEU  13   5.690   3.446  -2.182
  117   HD21  LEU  13          HD21      LEU  13   7.385   3.814  -4.714
  118   HD22  LEU  13          HD22      LEU  13   6.454   5.097  -5.483
  119   HD23  LEU  13          HD23      LEU  13   5.620   3.722  -4.759
  120    H    GLY  14           H        GLY  14   2.654   7.476  -5.003
  121    HA2  GLY  14           HA2      GLY  14   1.680   7.368  -7.056
  122    HA3  GLY  14           HA3      GLY  14   3.153   8.105  -7.666
  123    H    MET  15           H        MET  15   2.560   4.936  -6.194
  124    HA   MET  15           HA       MET  15   4.209   3.557  -8.114
  125    HB2  MET  15           HB2      MET  15   3.730   1.571  -6.789
  126    HB3  MET  15           HB3      MET  15   4.041   2.907  -5.697
  127    HG2  MET  15           HG2      MET  15   1.533   3.163  -5.463
  128    HG3  MET  15           HG3      MET  15   1.378   1.664  -6.369
  129    HE1  MET  15           HE1      MET  15   2.541   3.329  -2.995
  130    HE2  MET  15           HE2      MET  15   4.075   2.701  -3.607
  131    HE3  MET  15           HE3      MET  15   3.319   1.968  -2.190
  132    H    SER  16           H        SER  16   3.014   1.217  -8.729
  133    HA   SER  16           HA       SER  16   1.246   1.705 -10.847
  134    HB2  SER  16           HB2      SER  16   1.586  -0.888  -9.284
  135    HB3  SER  16           HB3      SER  16   0.989  -0.733 -10.939
  136    HG   SER  16           HG       SER  16   3.213   0.423 -11.136
  137    H    GLU  17           H        GLU  17  -0.979   1.778 -10.973
  138    HA   GLU  17           HA       GLU  17  -2.498   2.498  -8.713
  139    HB2  GLU  17           HB2      GLU  17  -3.502   1.566 -11.436
  140    HB3  GLU  17           HB3      GLU  17  -4.477   2.393 -10.221
  141    HG2  GLU  17           HG2      GLU  17  -2.890   4.344 -10.382
  142    HG3  GLU  17           HG3      GLU  17  -2.106   3.531 -11.734
  143    H    GLU  18           H        GLU  18  -1.970  -0.572 -10.285
  144    HA   GLU  18           HA       GLU  18  -4.104  -2.037  -9.092
  145    HB2  GLU  18           HB2      GLU  18  -3.140  -2.825 -11.184
  146    HB3  GLU  18           HB3      GLU  18  -1.535  -2.934 -10.465
  147    HG2  GLU  18           HG2      GLU  18  -2.262  -4.780  -9.025
  148    HG3  GLU  18           HG3      GLU  18  -3.916  -4.623  -9.612
  149    H    CYS  19           H        CYS  19  -0.676  -1.465  -8.355
  150    HA   CYS  19           HA       CYS  19  -0.330  -3.215  -6.210
  151    HB2  CYS  19           HB2      CYS  19   0.902  -0.512  -6.820
  152    HB3  CYS  19           HB3      CYS  19   1.418  -1.488  -5.464
  153    H    ARG  20           H        ARG  20  -1.382   0.212  -6.259
  154    HA   ARG  20           HA       ARG  20  -1.546   0.736  -3.523
  155    HB2  ARG  20           HB2      ARG  20  -3.417   1.824  -5.685
  156    HB3  ARG  20           HB3      ARG  20  -3.095   2.555  -4.111
  157    HG2  ARG  20           HG2      ARG  20  -0.709   2.848  -4.805
  158    HG3  ARG  20           HG3      ARG  20  -1.155   2.270  -6.415
  159    HD2  ARG  20           HD2      ARG  20  -2.339   4.683  -5.024
  160    HD3  ARG  20           HD3      ARG  20  -1.094   4.731  -6.270
  161    HE   ARG  20           HE       ARG  20  -3.507   3.392  -7.086
  162   HH11  ARG  20          HH11      ARG  20  -1.964   6.561  -6.861
  163   HH12  ARG  20          HH12      ARG  20  -2.969   7.263  -8.087
  164   HH21  ARG  20          HH21      ARG  20  -4.845   4.354  -8.645
  165   HH22  ARG  20          HH22      ARG  20  -4.604   6.012  -9.102
  166    H    GLN  21           H        GLN  21  -4.033  -0.459  -5.716
  167    HA   GLN  21           HA       GLN  21  -6.148  -0.618  -3.849
  168    HB2  GLN  21           HB2      GLN  21  -5.785  -2.122  -6.476
  169    HB3  GLN  21           HB3      GLN  21  -7.310  -1.923  -5.609
  170    HG2  GLN  21           HG2      GLN  21  -7.323   0.444  -5.987
  171    HG3  GLN  21           HG3      GLN  21  -5.664   0.429  -6.573
  172   HE21  GLN  21          HE21      GLN  21  -6.043   1.328  -8.535
  173   HE22  GLN  21          HE22      GLN  21  -6.995   0.608  -9.780
  174    H    ARG  22           H        ARG  22  -3.756  -3.036  -4.947
  175    HA   ARG  22           HA       ARG  22  -4.612  -5.239  -3.395
  176    HB2  ARG  22           HB2      ARG  22  -2.059  -4.489  -4.784
  177    HB3  ARG  22           HB3      ARG  22  -1.869  -5.618  -3.456
  178    HG2  ARG  22           HG2      ARG  22  -2.026  -6.913  -5.436
  179    HG3  ARG  22           HG3      ARG  22  -3.546  -7.116  -4.567
  180    HD2  ARG  22           HD2      ARG  22  -4.635  -5.505  -6.103
  181    HD3  ARG  22           HD3      ARG  22  -3.108  -5.306  -6.970
  182    HE   ARG  22           HE       ARG  22  -3.563  -7.997  -7.010
  183   HH11  ARG  22          HH11      ARG  22  -5.466  -5.249  -8.091
  184   HH12  ARG  22          HH12      ARG  22  -6.238  -6.137  -9.362
  185   HH21  ARG  22          HH21      ARG  22  -4.497  -9.123  -8.714
  186   HH22  ARG  22          HH22      ARG  22  -5.680  -8.350  -9.719
  187    H    LEU  23           H        LEU  23  -2.633  -2.397  -2.608
  188    HA   LEU  23           HA       LEU  23  -1.560  -3.465  -0.166
  189    HB2  LEU  23           HB2      LEU  23  -1.619  -0.612  -1.203
  190    HB3  LEU  23           HB3      LEU  23  -0.641  -1.198   0.123
  191    HG   LEU  23           HG       LEU  23  -0.376  -1.983  -2.777
  192   HD11  LEU  23          HD11      LEU  23   0.520   0.182  -2.355
  193   HD12  LEU  23          HD12      LEU  23   1.815  -0.964  -2.676
  194   HD13  LEU  23          HD13      LEU  23   1.493  -0.437  -1.018
  195   HD21  LEU  23          HD21      LEU  23   1.181  -3.082  -0.438
  196   HD22  LEU  23          HD22      LEU  23   1.578  -3.328  -2.138
  197   HD23  LEU  23          HD23      LEU  23   0.073  -3.964  -1.489
  198    H    GLU  24           H        GLU  24  -4.228  -1.244  -0.977
  199    HA   GLU  24           HA       GLU  24  -5.114  -0.696   1.623
  200    HB2  GLU  24           HB2      GLU  24  -6.710  -1.052  -0.943
  201    HB3  GLU  24           HB3      GLU  24  -7.423  -0.519   0.578
  202    HG2  GLU  24           HG2      GLU  24  -5.590   1.369   0.470
  203    HG3  GLU  24           HG3      GLU  24  -5.512   0.946  -1.239
  204    H    LYS  25           H        LYS  25  -5.548  -3.502  -0.485
  205    HA   LYS  25           HA       LYS  25  -7.462  -4.845   1.165
  206    HB2  LYS  25           HB2      LYS  25  -7.403  -5.331  -1.196
  207    HB3  LYS  25           HB3      LYS  25  -5.702  -5.772  -1.142
  208    HG2  LYS  25           HG2      LYS  25  -6.197  -7.815   0.075
  209    HG3  LYS  25           HG3      LYS  25  -7.885  -7.345   0.275
  210    HD2  LYS  25           HD2      LYS  25  -6.517  -7.989  -2.365
  211    HD3  LYS  25           HD3      LYS  25  -7.612  -9.055  -1.484
  212    HE2  LYS  25           HE2      LYS  25  -8.317  -6.399  -2.780
  213    HE3  LYS  25           HE3      LYS  25  -8.831  -8.003  -3.294
  214    HZ1  LYS  25           HZ1      LYS  25  -9.567  -6.702  -0.731
  215    HZ2  LYS  25           HZ2      LYS  25 -10.081  -8.226  -1.246
  216    HZ3  LYS  25           HZ3      LYS  25 -10.563  -6.842  -2.090
  217    H    MET  26           H        MET  26  -3.926  -4.957   0.890
  218    HA   MET  26           HA       MET  26  -3.532  -7.197   2.633
  219    HB2  MET  26           HB2      MET  26  -1.617  -4.997   1.769
  220    HB3  MET  26           HB3      MET  26  -1.145  -6.434   2.660
  221    HG2  MET  26           HG2      MET  26  -2.344  -6.457  -0.120
  222    HG3  MET  26           HG3      MET  26  -0.626  -6.531   0.232
  223    HE1  MET  26           HE1      MET  26  -3.635  -9.996   0.512
  224    HE2  MET  26           HE2      MET  26  -3.860  -8.459  -0.331
  225    HE3  MET  26           HE3      MET  26  -3.989  -8.537   1.427
  226    H    CYS  27           H        CYS  27  -3.856  -3.750   3.060
  227    HA   CYS  27           HA       CYS  27  -2.984  -3.643   5.787
  228    HB2  CYS  27           HB2      CYS  27  -2.934  -1.673   4.270
  229    HB3  CYS  27           HB3      CYS  27  -4.693  -1.674   4.224
  230    H    LYS  28           H        LYS  28  -6.152  -3.771   4.161
  231    HA   LYS  28           HA       LYS  28  -7.678  -3.421   6.595
  232    HB2  LYS  28           HB2      LYS  28  -8.547  -4.035   3.731
  233    HB3  LYS  28           HB3      LYS  28  -9.663  -3.678   5.050
  234    HG2  LYS  28           HG2      LYS  28  -8.845  -1.420   5.247
  235    HG3  LYS  28           HG3      LYS  28  -7.499  -1.749   4.151
  236    HD2  LYS  28           HD2      LYS  28  -9.244  -2.173   2.321
  237    HD3  LYS  28           HD3      LYS  28 -10.458  -1.543   3.442
  238    HE2  LYS  28           HE2      LYS  28  -9.228   0.596   3.559
  239    HE3  LYS  28           HE3      LYS  28  -8.010  -0.049   2.455
  240    HZ1  LYS  28           HZ1      LYS  28  -9.569   1.371   1.312
  241    HZ2  LYS  28           HZ2      LYS  28 -10.872   0.406   1.798
  242    HZ3  LYS  28           HZ3      LYS  28  -9.699  -0.215   0.750
  243    H    GLU  29           H        GLU  29  -6.807  -6.094   4.483
  244    HA   GLU  29           HA       GLU  29  -8.317  -8.040   6.142
  245    HB2  GLU  29           HB2      GLU  29  -7.258  -8.325   3.290
  246    HB3  GLU  29           HB3      GLU  29  -8.141  -9.562   4.180
  247    HG2  GLU  29           HG2      GLU  29 -10.115  -8.021   4.283
  248    HG3  GLU  29           HG3      GLU  29  -9.220  -6.871   3.291
  249    H    GLY  30           H        GLY  30  -5.620  -6.773   6.626
  250    HA2  GLY  30           HA2      GLY  30  -4.360  -9.131   7.710
  251    HA3  GLY  30           HA3      GLY  30  -3.419  -8.392   6.408
  252    H    THR  31           H        THR  31  -2.022  -6.854   7.030
  253    HA   THR  31           HA       THR  31  -2.744  -4.936   9.151
  254    HB   THR  31           HB       THR  31  -0.378  -4.943  10.042
  255    HG1  THR  31           HG1      THR  31  -0.168  -7.228   8.387
  256   HG21  THR  31          HG21      THR  31  -0.523  -6.981  11.428
  257   HG22  THR  31          HG22      THR  31  -1.760  -7.630  10.350
  258   HG23  THR  31          HG23      THR  31  -2.098  -6.192  11.315
  259    H    SER  32           H        SER  32  -1.694  -2.886   8.884
  260    HA   SER  32           HA       SER  32  -1.091  -2.048   6.252
  261    HB2  SER  32           HB2      SER  32  -0.392   0.102   7.337
  262    HB3  SER  32           HB3      SER  32  -1.959  -0.472   7.913
  263    HG   SER  32           HG       SER  32   0.330  -0.045   9.292
  264    H    GLU  33           H        GLU  33   0.891  -3.305   8.839
  265    HA   GLU  33           HA       GLU  33   3.472  -2.574   8.043
  266    HB2  GLU  33           HB2      GLU  33   2.579  -5.175   9.364
  267    HB3  GLU  33           HB3      GLU  33   4.221  -4.533   9.366
  268    HG2  GLU  33           HG2      GLU  33   3.514  -2.622  10.722
  269    HG3  GLU  33           HG3      GLU  33   1.834  -3.159  10.650
  270    H    ASP  34           H        ASP  34   1.492  -5.416   7.106
  271    HA   ASP  34           HA       ASP  34   3.399  -6.626   5.364
  272    HB2  ASP  34           HB2      ASP  34   0.363  -6.907   5.451
  273    HB3  ASP  34           HB3      ASP  34   1.402  -7.885   4.417
  274    H    ALA  35           H        ALA  35   0.852  -4.247   4.908
  275    HA   ALA  35           HA       ALA  35   0.694  -4.330   2.074
  276    HB1  ALA  35           HB1      ALA  35  -0.172  -2.195   4.035
  277    HB2  ALA  35           HB2      ALA  35  -1.145  -3.547   3.458
  278    HB3  ALA  35           HB3      ALA  35  -0.653  -2.279   2.334
  279    H    GLU  36           H        GLU  36   2.365  -2.043   4.305
  280    HA   GLU  36           HA       GLU  36   3.566  -0.538   2.190
  281    HB2  GLU  36           HB2      GLU  36   4.955   0.523   3.909
  282    HB3  GLU  36           HB3      GLU  36   3.263   0.483   4.393
  283    HG2  GLU  36           HG2      GLU  36   3.733  -1.437   5.881
  284    HG3  GLU  36           HG3      GLU  36   5.428  -1.393   5.399
  285    H    ARG  37           H        ARG  37   4.488  -3.443   3.942
  286    HA   ARG  37           HA       ARG  37   7.148  -3.685   2.997
  287    HB2  ARG  37           HB2      ARG  37   6.262  -5.017   4.874
  288    HB3  ARG  37           HB3      ARG  37   5.159  -5.851   3.782
  289    HG2  ARG  37           HG2      ARG  37   7.051  -6.884   2.608
  290    HG3  ARG  37           HG3      ARG  37   8.191  -5.986   3.614
  291    HD2  ARG  37           HD2      ARG  37   7.317  -7.159   5.619
  292    HD3  ARG  37           HD3      ARG  37   6.229  -8.086   4.585
  293    HE   ARG  37           HE       ARG  37   8.251  -9.025   3.507
  294   HH11  ARG  37          HH11      ARG  37   8.533  -7.732   6.760
  295   HH12  ARG  37          HH12      ARG  37   9.918  -8.695   7.157
  296   HH21  ARG  37          HH21      ARG  37  10.072 -10.276   4.016
  297   HH22  ARG  37          HH22      ARG  37  10.796 -10.149   5.588
  298    H    MET  38           H        MET  38   4.014  -4.590   1.544
  299    HA   MET  38           HA       MET  38   5.250  -5.776  -0.804
  300    HB2  MET  38           HB2      MET  38   2.359  -5.003  -0.249
  301    HB3  MET  38           HB3      MET  38   2.905  -5.857  -1.685
  302    HG2  MET  38           HG2      MET  38   3.104  -6.912   1.150
  303    HG3  MET  38           HG3      MET  38   1.863  -7.350  -0.016
  304    HE1  MET  38           HE1      MET  38   5.859  -7.459   0.557
  305    HE2  MET  38           HE2      MET  38   6.002  -9.208   0.390
  306    HE3  MET  38           HE3      MET  38   4.962  -8.525   1.641
  307    H    ALA  39           H        ALA  39   4.256  -2.589   0.200
  308    HA   ALA  39           HA       ALA  39   3.947  -1.304  -2.305
  309    HB1  ALA  39           HB1      ALA  39   4.192   0.788  -1.047
  310    HB2  ALA  39           HB2      ALA  39   4.827  -0.103   0.341
  311    HB3  ALA  39           HB3      ALA  39   3.158  -0.348  -0.177
  312    H    ARG  40           H        ARG  40   6.733  -1.694  -0.166
  313    HA   ARG  40           HA       ARG  40   8.604  -0.206  -1.712
  314    HB2  ARG  40           HB2      ARG  40  10.284  -1.150  -0.214
  315    HB3  ARG  40           HB3      ARG  40   8.869  -0.647   0.702
  316    HG2  ARG  40           HG2      ARG  40   8.108  -2.992   0.806
  317    HG3  ARG  40           HG3      ARG  40   9.556  -3.499  -0.070
  318    HD2  ARG  40           HD2      ARG  40   9.494  -2.143   2.645
  319    HD3  ARG  40           HD3      ARG  40   9.767  -3.862   2.362
  320    HE   ARG  40           HE       ARG  40  11.750  -2.876   0.935
  321   HH11  ARG  40          HH11      ARG  40  10.698  -1.835   4.133
  322   HH12  ARG  40          HH12      ARG  40  12.276  -1.302   4.613
  323   HH21  ARG  40          HH21      ARG  40  13.795  -2.157   1.546
  324   HH22  ARG  40          HH22      ARG  40  14.052  -1.491   3.127
  325    H    ASN  41           H        ASN  41   7.242  -3.291  -2.154
  326    HA   ASN  41           HA       ASN  41   9.448  -4.333  -3.813
  327    HB2  ASN  41           HB2      ASN  41   6.823  -5.610  -2.911
  328    HB3  ASN  41           HB3      ASN  41   8.035  -6.411  -3.909
  329   HD21  ASN  41          HD21      ASN  41   6.942  -6.903  -1.153
  330   HD22  ASN  41          HD22      ASN  41   8.338  -7.108  -0.166
  331    H    CYS  42           H        CYS  42   6.502  -2.611  -4.114
  332    HA   CYS  42           HA       CYS  42   5.915  -3.385  -6.848
  333    HB2  CYS  42           HB2      CYS  42   4.048  -2.695  -5.417
  334    HB3  CYS  42           HB3      CYS  42   4.809  -1.134  -5.127
  335    H    GLU  43           H        GLU  43   7.156  -0.453  -5.205
  336    HA   GLU  43           HA       GLU  43   8.092   1.466  -5.884
  337    HB2  GLU  43           HB2      GLU  43  10.002   0.059  -6.541
  338    HB3  GLU  43           HB3      GLU  43   9.257  -0.275  -8.102
  339    HG2  GLU  43           HG2      GLU  43   9.408   2.185  -8.626
  340    HG3  GLU  43           HG3      GLU  43  10.308   2.408  -7.130
  341    H    SER  44           H        SER  44   7.542   0.138  -9.140
  342    HA   SER  44           HA       SER  44   5.183   1.394  -9.869
  343    HB2  SER  44           HB2      SER  44   6.393   3.554  -9.618
  344    HB3  SER  44           HB3      SER  44   7.655   3.003 -10.718
  345    HG   SER  44           HG       SER  44   5.012   2.922 -11.620
  Start of MODEL   18
    1    H1   ALA   1           H1       ALA   1  -2.692   5.827  12.567
    2    H2   ALA   1           H2       ALA   1  -3.698   4.706  13.331
    3    H3   ALA   1           H3       ALA   1  -4.105   6.344  13.342
    4    HA   ALA   1           HA       ALA   1  -5.447   5.111  11.775
    5    HB1  ALA   1           HB1      ALA   1  -3.502   7.051  10.494
    6    HB2  ALA   1           HB2      ALA   1  -4.964   7.484  11.382
    7    HB3  ALA   1           HB3      ALA   1  -5.089   6.607   9.857
    8    HA   PRO   2           HA       PRO   2  -2.810   1.723  10.313
    9    HB2  PRO   2           HB2      PRO   2  -4.771   0.034   9.388
   10    HB3  PRO   2           HB3      PRO   2  -4.436   0.255  11.117
   11    HG2  PRO   2           HG2      PRO   2  -6.599   1.501   9.447
   12    HG3  PRO   2           HG3      PRO   2  -6.693   0.826  11.090
   13    HD2  PRO   2           HD2      PRO   2  -6.505   3.512  10.627
   14    HD3  PRO   2           HD3      PRO   2  -5.833   2.750  12.082
   15    H    CYS   3           H        CYS   3  -5.350   3.097   8.198
   16    HA   CYS   3           HA       CYS   3  -3.850   2.172   5.817
   17    HB2  CYS   3           HB2      CYS   3  -6.822   2.639   6.205
   18    HB3  CYS   3           HB3      CYS   3  -6.080   2.328   4.638
   19    H    GLU   4           H        GLU   4  -4.758   5.079   7.482
   20    HA   GLU   4           HA       GLU   4  -4.988   6.783   5.184
   21    HB2  GLU   4           HB2      GLU   4  -4.503   7.410   8.109
   22    HB3  GLU   4           HB3      GLU   4  -4.525   8.678   6.886
   23    HG2  GLU   4           HG2      GLU   4  -6.838   7.984   6.257
   24    HG3  GLU   4           HG3      GLU   4  -6.819   6.816   7.581
   25    H    ASP   5           H        ASP   5  -2.271   6.106   7.420
   26    HA   ASP   5           HA       ASP   5  -0.318   7.750   6.220
   27    HB2  ASP   5           HB2      ASP   5   0.081   5.110   7.701
   28    HB3  ASP   5           HB3      ASP   5   1.370   6.254   7.324
   29    H    LEU   6           H        LEU   6  -1.394   4.499   5.521
   30    HA   LEU   6           HA       LEU   6   0.596   3.887   3.566
   31    HB2  LEU   6           HB2      LEU   6  -0.626   2.235   5.018
   32    HB3  LEU   6           HB3      LEU   6  -2.073   2.535   4.078
   33    HG   LEU   6           HG       LEU   6   0.415   1.558   2.644
   34   HD11  LEU   6          HD11      LEU   6  -1.478  -0.259   4.144
   35   HD12  LEU   6          HD12      LEU   6   0.209   0.056   4.558
   36   HD13  LEU   6          HD13      LEU   6  -0.186  -0.763   3.050
   37   HD21  LEU   6          HD21      LEU   6  -1.224   0.457   1.154
   38   HD22  LEU   6          HD22      LEU   6  -1.527   2.187   1.265
   39   HD23  LEU   6          HD23      LEU   6  -2.550   1.060   2.157
   40    H    LYS   7           H        LYS   7  -2.680   5.210   3.508
   41    HA   LYS   7           HA       LYS   7  -3.102   5.221   0.706
   42    HB2  LYS   7           HB2      LYS   7  -4.922   5.590   2.332
   43    HB3  LYS   7           HB3      LYS   7  -4.169   7.085   2.864
   44    HG2  LYS   7           HG2      LYS   7  -6.001   7.679   1.436
   45    HG3  LYS   7           HG3      LYS   7  -4.518   8.016   0.539
   46    HD2  LYS   7           HD2      LYS   7  -6.132   6.964  -0.947
   47    HD3  LYS   7           HD3      LYS   7  -4.804   5.831  -0.679
   48    HE2  LYS   7           HE2      LYS   7  -6.179   4.590   0.940
   49    HE3  LYS   7           HE3      LYS   7  -7.474   5.777   0.776
   50    HZ1  LYS   7           HZ1      LYS   7  -7.705   5.136  -1.530
   51    HZ2  LYS   7           HZ2      LYS   7  -7.915   3.811  -0.501
   52    HZ3  LYS   7           HZ3      LYS   7  -6.473   3.994  -1.356
   53    H    GLU   8           H        GLU   8  -1.526   7.470   2.943
   54    HA   GLU   8           HA       GLU   8  -0.948   9.512   1.071
   55    HB2  GLU   8           HB2      GLU   8   0.467   8.803   3.668
   56    HB3  GLU   8           HB3      GLU   8   0.769  10.269   2.736
   57    HG2  GLU   8           HG2      GLU   8  -1.768   9.500   4.201
   58    HG3  GLU   8           HG3      GLU   8  -0.681  10.837   4.558
   59    H    ARG   9           H        ARG   9   0.712   6.498   1.941
   60    HA   ARG   9           HA       ARG   9   3.068   6.936   0.394
   61    HB2  ARG   9           HB2      ARG   9   1.717   4.313   1.157
   62    HB3  ARG   9           HB3      ARG   9   3.320   4.429   0.432
   63    HG2  ARG   9           HG2      ARG   9   4.139   5.664   2.392
   64    HG3  ARG   9           HG3      ARG   9   2.529   5.614   3.119
   65    HD2  ARG   9           HD2      ARG   9   2.645   3.143   3.196
   66    HD3  ARG   9           HD3      ARG   9   4.258   3.195   2.478
   67    HE   ARG   9           HE       ARG   9   5.056   4.279   4.481
   68   HH11  ARG   9          HH11      ARG   9   1.871   2.816   4.789
   69   HH12  ARG   9          HH12      ARG   9   1.971   2.700   6.513
   70   HH21  ARG   9          HH21      ARG   9   5.174   4.101   6.722
   71   HH22  ARG   9          HH22      ARG   9   3.845   3.433   7.613
   72    H    LEU  10           H        LEU  10  -0.140   5.649  -0.392
   73    HA   LEU  10           HA       LEU  10   0.433   4.783  -3.035
   74    HB2  LEU  10           HB2      LEU  10  -2.213   5.670  -1.811
   75    HB3  LEU  10           HB3      LEU  10  -2.052   4.841  -3.353
   76    HG   LEU  10           HG       LEU  10  -1.498   3.679  -0.584
   77   HD11  LEU  10          HD11      LEU  10  -3.834   3.706  -1.188
   78   HD12  LEU  10          HD12      LEU  10  -3.200   2.063  -1.134
   79   HD13  LEU  10          HD13      LEU  10  -3.473   2.851  -2.692
   80   HD21  LEU  10          HD21      LEU  10   0.266   2.898  -2.055
   81   HD22  LEU  10          HD22      LEU  10  -0.926   2.399  -3.259
   82   HD23  LEU  10          HD23      LEU  10  -0.861   1.599  -1.686
   83    H    LYS  11           H        LYS  11  -0.769   7.862  -1.726
   84    HA   LYS  11           HA       LYS  11  -1.187   9.138  -4.259
   85    HB2  LYS  11           HB2      LYS  11  -0.962  10.271  -1.450
   86    HB3  LYS  11           HB3      LYS  11  -1.501  11.187  -2.852
   87    HG2  LYS  11           HG2      LYS  11  -3.546  10.009  -2.996
   88    HG3  LYS  11           HG3      LYS  11  -2.958   8.675  -2.002
   89    HD2  LYS  11           HD2      LYS  11  -4.573  10.098  -0.772
   90    HD3  LYS  11           HD3      LYS  11  -2.985  10.089  -0.005
   91    HE2  LYS  11           HE2      LYS  11  -2.504  12.305  -1.044
   92    HE3  LYS  11           HE3      LYS  11  -4.120  12.299  -1.756
   93    HZ1  LYS  11           HZ1      LYS  11  -3.533  12.218   1.154
   94    HZ2  LYS  11           HZ2      LYS  11  -5.068  12.297   0.448
   95    HZ3  LYS  11           HZ3      LYS  11  -3.998  13.597   0.290
   96    H    LYS  12           H        LYS  12   1.335   9.432  -1.746
   97    HA   LYS  12           HA       LYS  12   2.665  11.646  -3.011
   98    HB2  LYS  12           HB2      LYS  12   2.465  11.221  -0.498
   99    HB3  LYS  12           HB3      LYS  12   3.658   9.950  -0.685
  100    HG2  LYS  12           HG2      LYS  12   4.280  12.789  -1.505
  101    HG3  LYS  12           HG3      LYS  12   4.401  12.295   0.183
  102    HD2  LYS  12           HD2      LYS  12   6.074  10.581  -0.427
  103    HD3  LYS  12           HD3      LYS  12   5.918  11.011  -2.130
  104    HE2  LYS  12           HE2      LYS  12   6.738  13.319  -1.538
  105    HE3  LYS  12           HE3      LYS  12   7.049  12.728   0.098
  106    HZ1  LYS  12           HZ1      LYS  12   8.268  11.668  -2.395
  107    HZ2  LYS  12           HZ2      LYS  12   8.559  11.087  -0.836
  108    HZ3  LYS  12           HZ3      LYS  12   9.035  12.653  -1.255
  109    H    LEU  13           H        LEU  13   3.338   8.153  -2.647
  110    HA   LEU  13           HA       LEU  13   5.931   8.342  -3.921
  111    HB2  LEU  13           HB2      LEU  13   5.370   6.662  -2.146
  112    HB3  LEU  13           HB3      LEU  13   4.274   5.883  -3.272
  113    HG   LEU  13           HG       LEU  13   6.226   5.368  -4.769
  114   HD11  LEU  13          HD11      LEU  13   7.714   7.171  -4.094
  115   HD12  LEU  13          HD12      LEU  13   8.507   5.611  -3.905
  116   HD13  LEU  13          HD13      LEU  13   7.888   6.461  -2.486
  117   HD21  LEU  13          HD21      LEU  13   6.474   4.295  -1.943
  118   HD22  LEU  13          HD22      LEU  13   7.162   3.558  -3.395
  119   HD23  LEU  13          HD23      LEU  13   5.414   3.669  -3.209
  120    H    GLY  14           H        GLY  14   2.635   7.773  -4.914
  121    HA2  GLY  14           HA2      GLY  14   1.618   7.484  -6.941
  122    HA3  GLY  14           HA3      GLY  14   3.008   8.323  -7.612
  123    H    MET  15           H        MET  15   2.111   5.112  -6.350
  124    HA   MET  15           HA       MET  15   4.006   3.758  -8.126
  125    HB2  MET  15           HB2      MET  15   3.516   1.768  -6.841
  126    HB3  MET  15           HB3      MET  15   3.796   3.101  -5.730
  127    HG2  MET  15           HG2      MET  15   1.306   3.327  -5.466
  128    HG3  MET  15           HG3      MET  15   1.118   1.909  -6.488
  129    HE1  MET  15           HE1      MET  15   2.442   3.258  -3.025
  130    HE2  MET  15           HE2      MET  15   3.913   2.562  -3.716
  131    HE3  MET  15           HE3      MET  15   3.135   1.791  -2.335
  132    H    SER  16           H        SER  16   2.751   1.387  -8.726
  133    HA   SER  16           HA       SER  16   0.999   2.014 -10.878
  134    HB2  SER  16           HB2      SER  16   1.507  -0.685  -9.547
  135    HB3  SER  16           HB3      SER  16   0.783  -0.434 -11.137
  136    HG   SER  16           HG       SER  16   2.920   0.800 -11.460
  137    H    GLU  17           H        GLU  17  -1.229   1.692 -11.075
  138    HA   GLU  17           HA       GLU  17  -2.868   2.262  -8.848
  139    HB2  GLU  17           HB2      GLU  17  -3.700   1.150 -11.562
  140    HB3  GLU  17           HB3      GLU  17  -4.767   1.930 -10.393
  141    HG2  GLU  17           HG2      GLU  17  -3.378   4.016 -10.633
  142    HG3  GLU  17           HG3      GLU  17  -2.499   3.224 -11.936
  143    H    GLU  18           H        GLU  18  -1.907  -0.720 -10.386
  144    HA   GLU  18           HA       GLU  18  -3.842  -2.497  -9.318
  145    HB2  GLU  18           HB2      GLU  18  -2.484  -3.074 -11.291
  146    HB3  GLU  18           HB3      GLU  18  -1.007  -2.951 -10.339
  147    HG2  GLU  18           HG2      GLU  18  -1.726  -4.900  -8.977
  148    HG3  GLU  18           HG3      GLU  18  -3.187  -5.040  -9.960
  149    H    CYS  19           H        CYS  19  -0.566  -1.471  -8.371
  150    HA   CYS  19           HA       CYS  19  -0.118  -3.153  -6.188
  151    HB2  CYS  19           HB2      CYS  19   0.866  -0.317  -6.691
  152    HB3  CYS  19           HB3      CYS  19   1.524  -1.409  -5.489
  153    H    ARG  20           H        ARG  20  -1.563   0.099  -6.374
  154    HA   ARG  20           HA       ARG  20  -2.043   0.722  -3.720
  155    HB2  ARG  20           HB2      ARG  20  -3.925   1.223  -6.061
  156    HB3  ARG  20           HB3      ARG  20  -4.022   2.009  -4.482
  157    HG2  ARG  20           HG2      ARG  20  -1.699   2.928  -4.942
  158    HG3  ARG  20           HG3      ARG  20  -1.912   2.353  -6.607
  159    HD2  ARG  20           HD2      ARG  20  -3.820   4.190  -5.152
  160    HD3  ARG  20           HD3      ARG  20  -2.566   4.729  -6.273
  161    HE   ARG  20           HE       ARG  20  -4.656   2.864  -7.183
  162   HH11  ARG  20          HH11      ARG  20  -3.159   6.031  -7.437
  163   HH12  ARG  20          HH12      ARG  20  -4.041   6.452  -8.868
  164   HH21  ARG  20          HH21      ARG  20  -5.858   3.488  -9.002
  165   HH22  ARG  20          HH22      ARG  20  -5.564   5.019  -9.754
  166    H    GLN  21           H        GLN  21  -4.111  -1.019  -5.967
  167    HA   GLN  21           HA       GLN  21  -6.328  -1.366  -4.301
  168    HB2  GLN  21           HB2      GLN  21  -5.445  -3.012  -6.715
  169    HB3  GLN  21           HB3      GLN  21  -7.068  -3.048  -6.020
  170    HG2  GLN  21           HG2      GLN  21  -7.534  -0.820  -6.694
  171    HG3  GLN  21           HG3      GLN  21  -5.835  -0.460  -6.991
  172   HE21  GLN  21          HE21      GLN  21  -6.095   0.243  -9.056
  173   HE22  GLN  21          HE22      GLN  21  -6.543  -0.774 -10.375
  174    H    ARG  22           H        ARG  22  -3.451  -3.369  -4.817
  175    HA   ARG  22           HA       ARG  22  -4.234  -5.577  -3.155
  176    HB2  ARG  22           HB2      ARG  22  -1.608  -4.696  -4.388
  177    HB3  ARG  22           HB3      ARG  22  -1.602  -5.938  -3.151
  178    HG2  ARG  22           HG2      ARG  22  -1.571  -7.019  -5.296
  179    HG3  ARG  22           HG3      ARG  22  -3.139  -7.310  -4.546
  180    HD2  ARG  22           HD2      ARG  22  -4.134  -5.535  -5.936
  181    HD3  ARG  22           HD3      ARG  22  -2.564  -5.244  -6.687
  182    HE   ARG  22           HE       ARG  22  -2.872  -7.803  -7.282
  183   HH11  ARG  22          HH11      ARG  22  -5.249  -5.207  -7.469
  184   HH12  ARG  22          HH12      ARG  22  -6.119  -5.926  -8.782
  185   HH21  ARG  22          HH21      ARG  22  -4.015  -8.719  -9.043
  186   HH22  ARG  22          HH22      ARG  22  -5.417  -7.914  -9.676
  187    H    LEU  23           H        LEU  23  -2.603  -2.497  -2.646
  188    HA   LEU  23           HA       LEU  23  -1.652  -3.144  -0.010
  189    HB2  LEU  23           HB2      LEU  23  -1.825  -0.546  -1.531
  190    HB3  LEU  23           HB3      LEU  23  -1.057  -0.728   0.034
  191    HG   LEU  23           HG       LEU  23  -0.214  -2.098  -2.534
  192   HD11  LEU  23          HD11      LEU  23   1.835  -0.838  -2.366
  193   HD12  LEU  23          HD12      LEU  23   1.200   0.029  -0.963
  194   HD13  LEU  23          HD13      LEU  23   0.428   0.200  -2.545
  195   HD21  LEU  23          HD21      LEU  23   0.154  -3.638  -0.722
  196   HD22  LEU  23          HD22      LEU  23   0.982  -2.394   0.222
  197   HD23  LEU  23          HD23      LEU  23   1.693  -2.994  -1.278
  198    H    GLU  24           H        GLU  24  -4.506  -1.634  -1.305
  199    HA   GLU  24           HA       GLU  24  -5.685  -0.494   0.951
  200    HB2  GLU  24           HB2      GLU  24  -6.929  -1.942  -1.435
  201    HB3  GLU  24           HB3      GLU  24  -7.900  -1.134  -0.210
  202    HG2  GLU  24           HG2      GLU  24  -5.910   0.188  -2.067
  203    HG3  GLU  24           HG3      GLU  24  -7.668   0.205  -2.236
  204    H    LYS  25           H        LYS  25  -5.737  -3.746  -0.386
  205    HA   LYS  25           HA       LYS  25  -7.627  -4.683   1.594
  206    HB2  LYS  25           HB2      LYS  25  -7.482  -6.799   0.423
  207    HB3  LYS  25           HB3      LYS  25  -7.822  -5.503  -0.681
  208    HG2  LYS  25           HG2      LYS  25  -5.617  -5.606  -1.605
  209    HG3  LYS  25           HG3      LYS  25  -5.041  -6.664  -0.317
  210    HD2  LYS  25           HD2      LYS  25  -7.150  -7.434  -2.374
  211    HD3  LYS  25           HD3      LYS  25  -5.438  -7.854  -2.487
  212    HE2  LYS  25           HE2      LYS  25  -5.581  -9.189  -0.451
  213    HE3  LYS  25           HE3      LYS  25  -7.248  -8.676  -0.181
  214    HZ1  LYS  25           HZ1      LYS  25  -7.899  -9.817  -2.177
  215    HZ2  LYS  25           HZ2      LYS  25  -7.108 -10.887  -1.134
  216    HZ3  LYS  25           HZ3      LYS  25  -6.302 -10.275  -2.488
  217    H    MET  26           H        MET  26  -4.159  -5.045   0.928
  218    HA   MET  26           HA       MET  26  -3.616  -6.906   3.000
  219    HB2  MET  26           HB2      MET  26  -1.820  -4.955   1.519
  220    HB3  MET  26           HB3      MET  26  -1.219  -6.049   2.754
  221    HG2  MET  26           HG2      MET  26  -2.596  -6.961   0.217
  222    HG3  MET  26           HG3      MET  26  -0.853  -6.830   0.410
  223    HE1  MET  26           HE1      MET  26  -3.839  -9.209   0.611
  224    HE2  MET  26           HE2      MET  26  -4.037  -8.551   2.237
  225    HE3  MET  26           HE3      MET  26  -3.524 -10.225   2.016
  226    H    CYS  27           H        CYS  27  -3.961  -3.389   2.970
  227    HA   CYS  27           HA       CYS  27  -3.112  -3.011   5.700
  228    HB2  CYS  27           HB2      CYS  27  -3.146  -1.138   4.065
  229    HB3  CYS  27           HB3      CYS  27  -4.903  -1.255   3.973
  230    H    LYS  28           H        LYS  28  -6.250  -3.440   4.086
  231    HA   LYS  28           HA       LYS  28  -7.786  -2.778   6.453
  232    HB2  LYS  28           HB2      LYS  28  -8.511  -3.414   3.575
  233    HB3  LYS  28           HB3      LYS  28  -9.752  -3.157   4.796
  234    HG2  LYS  28           HG2      LYS  28  -9.290  -0.872   4.992
  235    HG3  LYS  28           HG3      LYS  28  -7.626  -1.046   4.438
  236    HD2  LYS  28           HD2      LYS  28  -9.134   0.161   2.824
  237    HD3  LYS  28           HD3      LYS  28  -8.315  -1.241   2.143
  238    HE2  LYS  28           HE2      LYS  28 -10.661  -1.085   1.400
  239    HE3  LYS  28           HE3      LYS  28 -10.372  -2.562   2.321
  240    HZ1  LYS  28           HZ1      LYS  28 -11.352  -1.490   4.258
  241    HZ2  LYS  28           HZ2      LYS  28 -12.440  -1.515   2.966
  242    HZ3  LYS  28           HZ3      LYS  28 -11.633  -0.083   3.363
  243    H    GLU  29           H        GLU  29  -8.003  -5.551   4.191
  244    HA   GLU  29           HA       GLU  29  -9.096  -7.272   6.320
  245    HB2  GLU  29           HB2      GLU  29  -9.586  -8.855   4.441
  246    HB3  GLU  29           HB3      GLU  29 -10.330  -7.276   4.218
  247    HG2  GLU  29           HG2      GLU  29  -8.428  -6.678   2.683
  248    HG3  GLU  29           HG3      GLU  29  -7.863  -8.342   2.818
  249    H    GLY  30           H        GLY  30  -6.130  -6.346   5.779
  250    HA2  GLY  30           HA2      GLY  30  -4.907  -8.987   6.361
  251    HA3  GLY  30           HA3      GLY  30  -4.179  -7.896   5.184
  252    H    THR  31           H        THR  31  -2.270  -7.703   6.406
  253    HA   THR  31           HA       THR  31  -2.422  -6.139   8.928
  254    HB   THR  31           HB       THR  31   0.008  -7.043   9.209
  255    HG1  THR  31           HG1      THR  31   0.636  -8.654   7.909
  256   HG21  THR  31          HG21      THR  31  -2.288  -9.038   9.328
  257   HG22  THR  31          HG22      THR  31  -1.842  -7.897  10.603
  258   HG23  THR  31          HG23      THR  31  -0.742  -9.205  10.156
  259    H    SER  32           H        SER  32  -1.898  -4.066   8.664
  260    HA   SER  32           HA       SER  32  -1.046  -2.866   6.270
  261    HB2  SER  32           HB2      SER  32  -0.934  -1.650   9.066
  262    HB3  SER  32           HB3      SER  32  -1.024  -0.769   7.538
  263    HG   SER  32           HG       SER  32  -3.082  -0.841   7.950
  264    H    GLU  33           H        GLU  33   0.774  -4.166   8.939
  265    HA   GLU  33           HA       GLU  33   3.236  -2.767   8.546
  266    HB2  GLU  33           HB2      GLU  33   2.659  -5.413   9.939
  267    HB3  GLU  33           HB3      GLU  33   4.167  -4.500  10.069
  268    HG2  GLU  33           HG2      GLU  33   2.942  -2.610  11.080
  269    HG3  GLU  33           HG3      GLU  33   1.433  -3.517  10.959
  270    H    ASP  34           H        ASP  34   1.886  -5.791   7.268
  271    HA   ASP  34           HA       ASP  34   4.251  -6.466   5.731
  272    HB2  ASP  34           HB2      ASP  34   1.402  -7.547   5.761
  273    HB3  ASP  34           HB3      ASP  34   2.576  -8.080   4.550
  274    H    ALA  35           H        ALA  35   1.258  -4.712   5.246
  275    HA   ALA  35           HA       ALA  35   1.240  -4.596   2.415
  276    HB1  ALA  35           HB1      ALA  35  -0.484  -2.874   2.701
  277    HB2  ALA  35           HB2      ALA  35  -0.059  -2.711   4.407
  278    HB3  ALA  35           HB3      ALA  35  -0.751  -4.220   3.816
  279    H    GLU  36           H        GLU  36   2.550  -2.324   4.858
  280    HA   GLU  36           HA       GLU  36   3.358  -0.268   3.093
  281    HB2  GLU  36           HB2      GLU  36   4.829   0.489   4.932
  282    HB3  GLU  36           HB3      GLU  36   3.210   0.102   5.509
  283    HG2  GLU  36           HG2      GLU  36   4.007  -2.062   6.348
  284    HG3  GLU  36           HG3      GLU  36   5.628  -1.712   5.750
  285    H    ARG  37           H        ARG  37   4.859  -3.314   3.995
  286    HA   ARG  37           HA       ARG  37   7.425  -2.903   2.822
  287    HB2  ARG  37           HB2      ARG  37   6.831  -4.661   4.547
  288    HB3  ARG  37           HB3      ARG  37   5.952  -5.524   3.291
  289    HG2  ARG  37           HG2      ARG  37   8.197  -5.588   2.004
  290    HG3  ARG  37           HG3      ARG  37   8.939  -5.074   3.523
  291    HD2  ARG  37           HD2      ARG  37   7.418  -7.632   2.959
  292    HD3  ARG  37           HD3      ARG  37   9.107  -7.460   3.437
  293    HE   ARG  37           HE       ARG  37   8.145  -6.537   5.617
  294   HH11  ARG  37          HH11      ARG  37   6.481  -9.001   3.725
  295   HH12  ARG  37          HH12      ARG  37   5.647  -9.655   5.100
  296   HH21  ARG  37          HH21      ARG  37   6.997  -7.372   7.384
  297   HH22  ARG  37          HH22      ARG  37   5.942  -8.735   7.169
  298    H    MET  38           H        MET  38   4.410  -4.512   1.716
  299    HA   MET  38           HA       MET  38   5.267  -5.249  -0.851
  300    HB2  MET  38           HB2      MET  38   2.410  -4.572  -0.071
  301    HB3  MET  38           HB3      MET  38   2.931  -5.621  -1.382
  302    HG2  MET  38           HG2      MET  38   3.074  -6.167   1.589
  303    HG3  MET  38           HG3      MET  38   2.087  -6.994   0.392
  304    HE1  MET  38           HE1      MET  38   3.120  -8.588  -1.489
  305    HE2  MET  38           HE2      MET  38   4.842  -8.940  -1.636
  306    HE3  MET  38           HE3      MET  38   4.243  -7.316  -1.977
  307    H    ALA  39           H        ALA  39   4.165  -2.181   0.410
  308    HA   ALA  39           HA       ALA  39   3.585  -0.753  -1.936
  309    HB1  ALA  39           HB1      ALA  39   4.834   0.295   0.629
  310    HB2  ALA  39           HB2      ALA  39   3.104   0.106   0.331
  311    HB3  ALA  39           HB3      ALA  39   4.044   1.270  -0.607
  312    H    ARG  40           H        ARG  40   6.633  -1.303  -0.222
  313    HA   ARG  40           HA       ARG  40   8.342   0.005  -2.094
  314    HB2  ARG  40           HB2      ARG  40   8.984  -2.213  -0.101
  315    HB3  ARG  40           HB3      ARG  40  10.172  -1.200  -0.923
  316    HG2  ARG  40           HG2      ARG  40   9.340   0.781   0.264
  317    HG3  ARG  40           HG3      ARG  40   8.081  -0.186   1.041
  318    HD2  ARG  40           HD2      ARG  40   9.785  -1.501   2.216
  319    HD3  ARG  40           HD3      ARG  40  11.073  -0.617   1.390
  320    HE   ARG  40           HE       ARG  40   9.502   1.261   2.722
  321   HH11  ARG  40          HH11      ARG  40  11.613  -1.405   3.633
  322   HH12  ARG  40          HH12      ARG  40  12.040  -0.708   5.159
  323   HH21  ARG  40          HH21      ARG  40  10.066   2.142   4.748
  324   HH22  ARG  40          HH22      ARG  40  11.166   1.299   5.788
  325    H    ASN  41           H        ASN  41   7.174  -3.334  -1.674
  326    HA   ASN  41           HA       ASN  41   8.908  -4.617  -3.523
  327    HB2  ASN  41           HB2      ASN  41   6.247  -5.472  -2.329
  328    HB3  ASN  41           HB3      ASN  41   7.116  -6.488  -3.467
  329   HD21  ASN  41          HD21      ASN  41   8.724  -4.533  -0.974
  330   HD22  ASN  41          HD22      ASN  41   9.259  -5.886  -0.051
  331    H    CYS  42           H        CYS  42   5.979  -2.805  -3.982
  332    HA   CYS  42           HA       CYS  42   5.011  -3.726  -6.429
  333    HB2  CYS  42           HB2      CYS  42   3.729  -2.084  -5.205
  334    HB3  CYS  42           HB3      CYS  42   5.057  -0.927  -5.242
  335    H    GLU  43           H        GLU  43   7.581  -1.321  -5.795
  336    HA   GLU  43           HA       GLU  43   8.745  -1.717  -8.423
  337    HB2  GLU  43           HB2      GLU  43   6.974  -0.028  -8.890
  338    HB3  GLU  43           HB3      GLU  43   7.640   1.016  -7.636
  339    HG2  GLU  43           HG2      GLU  43   9.789   1.123  -8.958
  340    HG3  GLU  43           HG3      GLU  43   8.981   0.210 -10.230
  341    H    SER  44           H        SER  44   8.724   0.218  -5.426
  342    HA   SER  44           HA       SER  44  11.361   1.269  -5.688
  343    HB2  SER  44           HB2      SER  44   9.525   2.361  -4.389
  344    HB3  SER  44           HB3      SER  44   9.573   1.039  -3.224
  345    HG   SER  44           HG       SER  44  11.418   3.111  -3.655
  Start of MODEL   19
    1    H1   ALA   1           H1       ALA   1  -2.421   5.643  12.841
    2    H2   ALA   1           H2       ALA   1  -2.754   4.503  14.045
    3    H3   ALA   1           H3       ALA   1  -3.649   5.934  13.971
    4    HA   ALA   1           HA       ALA   1  -4.910   4.062  13.131
    5    HB1  ALA   1           HB1      ALA   1  -4.134   6.118  11.030
    6    HB2  ALA   1           HB2      ALA   1  -5.359   6.323  12.281
    7    HB3  ALA   1           HB3      ALA   1  -5.599   5.133  11.001
    8    HA   PRO   2           HA       PRO   2  -3.044   0.583  11.088
    9    HB2  PRO   2           HB2      PRO   2  -5.164   0.815   8.944
   10    HB3  PRO   2           HB3      PRO   2  -4.672  -0.604   9.899
   11    HG2  PRO   2           HG2      PRO   2  -6.917   0.710  10.480
   12    HG3  PRO   2           HG3      PRO   2  -5.885   0.049  11.766
   13    HD2  PRO   2           HD2      PRO   2  -6.251   2.894  10.926
   14    HD3  PRO   2           HD3      PRO   2  -5.871   2.228  12.528
   15    H    CYS   3           H        CYS   3  -4.281   2.540   8.368
   16    HA   CYS   3           HA       CYS   3  -1.630   2.633   7.085
   17    HB2  CYS   3           HB2      CYS   3  -4.107   1.308   5.943
   18    HB3  CYS   3           HB3      CYS   3  -2.852   1.950   4.887
   19    H    GLU   4           H        GLU   4  -3.394   4.605   8.380
   20    HA   GLU   4           HA       GLU   4  -4.570   6.359   6.523
   21    HB2  GLU   4           HB2      GLU   4  -4.787   6.473   9.011
   22    HB3  GLU   4           HB3      GLU   4  -3.123   7.014   9.129
   23    HG2  GLU   4           HG2      GLU   4  -5.278   8.582   7.673
   24    HG3  GLU   4           HG3      GLU   4  -4.953   8.778   9.389
   25    H    ASP   5           H        ASP   5  -1.265   6.308   7.896
   26    HA   ASP   5           HA       ASP   5  -0.112   8.369   6.349
   27    HB2  ASP   5           HB2      ASP   5   1.293   5.952   7.569
   28    HB3  ASP   5           HB3      ASP   5   2.071   7.449   7.064
   29    H    LEU   6           H        LEU   6  -0.134   4.864   5.977
   30    HA   LEU   6           HA       LEU   6   1.525   4.505   3.791
   31    HB2  LEU   6           HB2      LEU   6   0.766   2.693   5.237
   32    HB3  LEU   6           HB3      LEU   6  -0.883   2.910   4.708
   33    HG   LEU   6           HG       LEU   6   1.136   2.122   2.600
   34   HD11  LEU   6          HD11      LEU   6   1.701   0.635   4.469
   35   HD12  LEU   6          HD12      LEU   6   0.958  -0.245   3.134
   36   HD13  LEU   6          HD13      LEU   6   0.010   0.127   4.576
   37   HD21  LEU   6          HD21      LEU   6  -0.759   0.807   1.688
   38   HD22  LEU   6          HD22      LEU   6  -1.215   2.493   1.919
   39   HD23  LEU   6          HD23      LEU   6  -1.756   1.273   3.072
   40    H    LYS   7           H        LYS   7  -1.959   5.194   3.869
   41    HA   LYS   7           HA       LYS   7  -2.459   4.711   1.111
   42    HB2  LYS   7           HB2      LYS   7  -4.177   4.566   2.883
   43    HB3  LYS   7           HB3      LYS   7  -4.105   6.312   3.099
   44    HG2  LYS   7           HG2      LYS   7  -5.015   6.691   0.882
   45    HG3  LYS   7           HG3      LYS   7  -4.878   4.976   0.480
   46    HD2  LYS   7           HD2      LYS   7  -6.694   6.145   2.622
   47    HD3  LYS   7           HD3      LYS   7  -7.210   5.637   1.013
   48    HE2  LYS   7           HE2      LYS   7  -6.584   3.309   1.530
   49    HE3  LYS   7           HE3      LYS   7  -5.999   3.803   3.122
   50    HZ1  LYS   7           HZ1      LYS   7  -8.217   4.479   3.702
   51    HZ2  LYS   7           HZ2      LYS   7  -8.211   2.860   3.224
   52    HZ3  LYS   7           HZ3      LYS   7  -8.800   4.051   2.176
   53    H    GLU   8           H        GLU   8  -1.707   7.617   2.967
   54    HA   GLU   8           HA       GLU   8  -2.085   9.496   0.878
   55    HB2  GLU   8           HB2      GLU   8  -0.226   9.761   3.274
   56    HB3  GLU   8           HB3      GLU   8  -0.862  11.077   2.284
   57    HG2  GLU   8           HG2      GLU   8  -2.393   9.278   4.168
   58    HG3  GLU   8           HG3      GLU   8  -2.099  11.006   4.342
   59    H    ARG   9           H        ARG   9   0.652   7.545   1.935
   60    HA   ARG   9           HA       ARG   9   2.656   8.614   0.244
   61    HB2  ARG   9           HB2      ARG   9   2.366   5.876   1.521
   62    HB3  ARG   9           HB3      ARG   9   3.819   6.417   0.681
   63    HG2  ARG   9           HG2      ARG   9   4.197   8.163   2.307
   64    HG3  ARG   9           HG3      ARG   9   2.647   7.843   3.093
   65    HD2  ARG   9           HD2      ARG   9   4.589   6.896   4.328
   66    HD3  ARG   9           HD3      ARG   9   3.412   5.676   3.829
   67    HE   ARG   9           HE       ARG   9   5.398   5.895   1.851
   68   HH11  ARG   9          HH11      ARG   9   5.039   4.644   5.116
   69   HH12  ARG   9          HH12      ARG   9   6.290   3.470   4.902
   70   HH21  ARG   9          HH21      ARG   9   6.998   4.359   1.619
   71   HH22  ARG   9          HH22      ARG   9   7.390   3.306   2.934
   72    H    LEU  10           H        LEU  10   0.232   6.040  -0.182
   73    HA   LEU  10           HA       LEU  10   1.062   4.928  -2.613
   74    HB2  LEU  10           HB2      LEU  10  -1.842   5.369  -1.791
   75    HB3  LEU  10           HB3      LEU  10  -1.262   4.208  -2.973
   76    HG   LEU  10           HG       LEU  10  -0.989   4.108   0.038
   77   HD11  LEU  10          HD11      LEU  10  -2.128   1.971  -0.139
   78   HD12  LEU  10          HD12      LEU  10  -2.230   2.147  -1.893
   79   HD13  LEU  10          HD13      LEU  10  -3.088   3.274  -0.838
   80   HD21  LEU  10          HD21      LEU  10   0.472   2.345  -1.941
   81   HD22  LEU  10          HD22      LEU  10   0.353   2.054  -0.203
   82   HD23  LEU  10          HD23      LEU  10   1.188   3.484  -0.797
   83    H    LYS  11           H        LYS  11  -1.065   7.688  -1.933
   84    HA   LYS  11           HA       LYS  11  -1.533   8.310  -4.722
   85    HB2  LYS  11           HB2      LYS  11  -2.249   9.775  -2.157
   86    HB3  LYS  11           HB3      LYS  11  -2.832  10.219  -3.761
   87    HG2  LYS  11           HG2      LYS  11  -4.056   8.125  -3.967
   88    HG3  LYS  11           HG3      LYS  11  -3.360   7.514  -2.464
   89    HD2  LYS  11           HD2      LYS  11  -5.214   9.924  -2.684
   90    HD3  LYS  11           HD3      LYS  11  -5.719   8.301  -2.200
   91    HE2  LYS  11           HE2      LYS  11  -4.234   8.421  -0.232
   92    HE3  LYS  11           HE3      LYS  11  -3.701  10.030  -0.723
   93    HZ1  LYS  11           HZ1      LYS  11  -5.949  10.822  -0.447
   94    HZ2  LYS  11           HZ2      LYS  11  -5.373  10.133   0.986
   95    HZ3  LYS  11           HZ3      LYS  11  -6.463   9.282   0.018
   96    H    LYS  12           H        LYS  12   0.737   9.312  -2.264
   97    HA   LYS  12           HA       LYS  12   1.484  11.851  -3.277
   98    HB2  LYS  12           HB2      LYS  12   1.969  11.315  -0.987
   99    HB3  LYS  12           HB3      LYS  12   2.823   9.851  -1.436
  100    HG2  LYS  12           HG2      LYS  12   3.987  12.454  -2.367
  101    HG3  LYS  12           HG3      LYS  12   4.093  12.087  -0.647
  102    HD2  LYS  12           HD2      LYS  12   5.335  10.021  -1.121
  103    HD3  LYS  12           HD3      LYS  12   5.114  10.252  -2.856
  104    HE2  LYS  12           HE2      LYS  12   6.725  12.050  -1.014
  105    HE3  LYS  12           HE3      LYS  12   7.381  10.898  -2.175
  106    HZ1  LYS  12           HZ1      LYS  12   7.432  13.118  -3.072
  107    HZ2  LYS  12           HZ2      LYS  12   5.772  13.310  -2.825
  108    HZ3  LYS  12           HZ3      LYS  12   6.331  12.185  -3.958
  109    H    LEU  13           H        LEU  13   2.826   8.602  -3.774
  110    HA   LEU  13           HA       LEU  13   4.667   9.617  -5.839
  111    HB2  LEU  13           HB2      LEU  13   5.830   7.470  -5.651
  112    HB3  LEU  13           HB3      LEU  13   5.721   8.297  -4.111
  113    HG   LEU  13           HG       LEU  13   3.598   6.672  -3.780
  114   HD11  LEU  13          HD11      LEU  13   3.983   4.438  -4.720
  115   HD12  LEU  13          HD12      LEU  13   5.296   5.083  -5.707
  116   HD13  LEU  13          HD13      LEU  13   3.643   5.643  -5.957
  117   HD21  LEU  13          HD21      LEU  13   6.448   5.725  -3.379
  118   HD22  LEU  13          HD22      LEU  13   5.011   5.094  -2.565
  119   HD23  LEU  13          HD23      LEU  13   5.523   6.756  -2.281
  120    H    GLY  14           H        GLY  14   1.665   8.055  -5.483
  121    HA2  GLY  14           HA2      GLY  14   0.112   8.107  -7.258
  122    HA3  GLY  14           HA3      GLY  14   1.416   7.873  -8.417
  123    H    MET  15           H        MET  15   2.711   5.783  -7.782
  124    HA   MET  15           HA       MET  15   2.960   3.693  -7.971
  125    HB2  MET  15           HB2      MET  15   1.938   3.959  -5.543
  126    HB3  MET  15           HB3      MET  15   0.585   3.064  -6.232
  127    HG2  MET  15           HG2      MET  15   2.097   1.285  -6.887
  128    HG3  MET  15           HG3      MET  15   3.466   2.166  -6.252
  129    HE1  MET  15           HE1      MET  15   3.019   1.962  -2.442
  130    HE2  MET  15           HE2      MET  15   2.595   3.315  -3.490
  131    HE3  MET  15           HE3      MET  15   4.080   2.403  -3.780
  132    H    SER  16           H        SER  16   2.196   1.676  -8.899
  133    HA   SER  16           HA       SER  16   0.458   1.967 -11.100
  134    HB2  SER  16           HB2      SER  16   1.305  -0.601  -9.679
  135    HB3  SER  16           HB3      SER  16   0.649  -0.494 -11.316
  136    HG   SER  16           HG       SER  16   2.547   1.014 -11.627
  137    H    GLU  17           H        GLU  17  -1.725   1.588 -11.309
  138    HA   GLU  17           HA       GLU  17  -3.409   1.948  -9.101
  139    HB2  GLU  17           HB2      GLU  17  -3.972   0.911 -11.906
  140    HB3  GLU  17           HB3      GLU  17  -5.253   1.215 -10.733
  141    HG2  GLU  17           HG2      GLU  17  -4.746   3.557 -10.653
  142    HG3  GLU  17           HG3      GLU  17  -3.284   3.349 -11.615
  143    H    GLU  18           H        GLU  18  -2.101  -1.008 -10.460
  144    HA   GLU  18           HA       GLU  18  -3.904  -2.763  -9.063
  145    HB2  GLU  18           HB2      GLU  18  -2.787  -3.453 -11.176
  146    HB3  GLU  18           HB3      GLU  18  -1.219  -3.299 -10.392
  147    HG2  GLU  18           HG2      GLU  18  -1.819  -5.133  -8.833
  148    HG3  GLU  18           HG3      GLU  18  -3.383  -5.288  -9.631
  149    H    CYS  19           H        CYS  19  -0.657  -1.370  -8.538
  150    HA   CYS  19           HA       CYS  19   0.125  -3.021  -6.385
  151    HB2  CYS  19           HB2      CYS  19   1.045  -0.239  -7.274
  152    HB3  CYS  19           HB3      CYS  19   1.716  -1.071  -5.871
  153    H    ARG  20           H        ARG  20  -1.258   0.313  -6.367
  154    HA   ARG  20           HA       ARG  20  -1.295   0.465  -3.529
  155    HB2  ARG  20           HB2      ARG  20  -2.903   2.486  -3.965
  156    HB3  ARG  20           HB3      ARG  20  -1.219   2.590  -4.428
  157    HG2  ARG  20           HG2      ARG  20  -2.545   3.613  -6.122
  158    HG3  ARG  20           HG3      ARG  20  -1.865   2.127  -6.774
  159    HD2  ARG  20           HD2      ARG  20  -4.263   2.572  -7.402
  160    HD3  ARG  20           HD3      ARG  20  -3.975   1.010  -6.650
  161    HE   ARG  20           HE       ARG  20  -5.317   1.589  -4.927
  162   HH11  ARG  20          HH11      ARG  20  -4.610   4.516  -6.758
  163   HH12  ARG  20          HH12      ARG  20  -5.741   5.482  -5.880
  164   HH21  ARG  20          HH21      ARG  20  -6.734   2.955  -3.716
  165   HH22  ARG  20          HH22      ARG  20  -6.929   4.611  -4.177
  166    H    GLN  21           H        GLN  21  -3.721  -0.702  -5.843
  167    HA   GLN  21           HA       GLN  21  -5.862  -0.964  -3.975
  168    HB2  GLN  21           HB2      GLN  21  -5.318  -2.179  -6.701
  169    HB3  GLN  21           HB3      GLN  21  -6.684  -2.750  -5.743
  170    HG2  GLN  21           HG2      GLN  21  -7.588  -0.454  -5.669
  171    HG3  GLN  21           HG3      GLN  21  -6.237   0.117  -6.643
  172   HE21  GLN  21          HE21      GLN  21  -6.233  -0.337  -8.871
  173   HE22  GLN  21          HE22      GLN  21  -7.606  -0.945  -9.700
  174    H    ARG  22           H        ARG  22  -3.141  -3.073  -4.849
  175    HA   ARG  22           HA       ARG  22  -3.828  -5.362  -3.341
  176    HB2  ARG  22           HB2      ARG  22  -1.099  -4.181  -3.995
  177    HB3  ARG  22           HB3      ARG  22  -1.306  -5.729  -3.204
  178    HG2  ARG  22           HG2      ARG  22  -2.314  -6.686  -5.163
  179    HG3  ARG  22           HG3      ARG  22  -2.386  -5.112  -5.961
  180    HD2  ARG  22           HD2      ARG  22   0.073  -5.006  -6.008
  181    HD3  ARG  22           HD3      ARG  22   0.168  -6.541  -5.141
  182    HE   ARG  22           HE       ARG  22  -1.241  -6.586  -7.683
  183   HH11  ARG  22          HH11      ARG  22   1.807  -7.179  -6.016
  184   HH12  ARG  22          HH12      ARG  22   2.422  -8.203  -7.274
  185   HH21  ARG  22          HH21      ARG  22  -0.376  -7.888  -9.335
  186   HH22  ARG  22          HH22      ARG  22   1.192  -8.599  -9.143
  187    H    LEU  23           H        LEU  23  -2.150  -2.342  -2.503
  188    HA   LEU  23           HA       LEU  23  -1.180  -3.239   0.027
  189    HB2  LEU  23           HB2      LEU  23  -1.399  -0.418  -1.059
  190    HB3  LEU  23           HB3      LEU  23  -0.374  -0.942   0.264
  191    HG   LEU  23           HG       LEU  23  -0.112  -1.739  -2.643
  192   HD11  LEU  23          HD11      LEU  23   0.694   0.467  -2.287
  193   HD12  LEU  23          HD12      LEU  23   2.032  -0.630  -2.611
  194   HD13  LEU  23          HD13      LEU  23   1.726  -0.079  -0.959
  195   HD21  LEU  23          HD21      LEU  23   1.884  -3.006  -2.049
  196   HD22  LEU  23          HD22      LEU  23   0.444  -3.662  -1.285
  197   HD23  LEU  23          HD23      LEU  23   1.577  -2.701  -0.335
  198    H    GLU  24           H        GLU  24  -3.782  -0.975  -0.893
  199    HA   GLU  24           HA       GLU  24  -4.935  -0.545   1.610
  200    HB2  GLU  24           HB2      GLU  24  -6.308  -0.860  -1.094
  201    HB3  GLU  24           HB3      GLU  24  -7.083  -0.198   0.344
  202    HG2  GLU  24           HG2      GLU  24  -5.656   1.745   0.321
  203    HG3  GLU  24           HG3      GLU  24  -4.612   1.032  -0.909
  204    H    LYS  25           H        LYS  25  -5.186  -3.316  -0.612
  205    HA   LYS  25           HA       LYS  25  -7.332  -4.654   0.741
  206    HB2  LYS  25           HB2      LYS  25  -7.033  -5.227  -1.557
  207    HB3  LYS  25           HB3      LYS  25  -5.320  -5.544  -1.338
  208    HG2  LYS  25           HG2      LYS  25  -5.798  -7.602  -0.110
  209    HG3  LYS  25           HG3      LYS  25  -7.530  -7.269  -0.168
  210    HD2  LYS  25           HD2      LYS  25  -5.762  -7.774  -2.590
  211    HD3  LYS  25           HD3      LYS  25  -6.799  -8.979  -1.822
  212    HE2  LYS  25           HE2      LYS  25  -7.721  -6.428  -3.203
  213    HE3  LYS  25           HE3      LYS  25  -7.911  -8.079  -3.798
  214    HZ1  LYS  25           HZ1      LYS  25  -9.949  -7.327  -2.815
  215    HZ2  LYS  25           HZ2      LYS  25  -9.172  -6.932  -1.367
  216    HZ3  LYS  25           HZ3      LYS  25  -9.297  -8.548  -1.843
  217    H    MET  26           H        MET  26  -3.815  -4.671   1.055
  218    HA   MET  26           HA       MET  26  -3.744  -6.936   2.846
  219    HB2  MET  26           HB2      MET  26  -1.572  -4.837   2.492
  220    HB3  MET  26           HB3      MET  26  -1.384  -6.452   3.158
  221    HG2  MET  26           HG2      MET  26  -1.865  -5.670   0.280
  222    HG3  MET  26           HG3      MET  26  -0.451  -6.455   0.953
  223    HE1  MET  26           HE1      MET  26  -1.788 -10.096   1.597
  224    HE2  MET  26           HE2      MET  26  -1.715  -8.790   2.782
  225    HE3  MET  26           HE3      MET  26  -0.382  -9.035   1.650
  226    H    CYS  27           H        CYS  27  -4.039  -3.453   3.085
  227    HA   CYS  27           HA       CYS  27  -3.649  -3.180   5.897
  228    HB2  CYS  27           HB2      CYS  27  -4.937  -1.378   3.831
  229    HB3  CYS  27           HB3      CYS  27  -4.711  -0.914   5.511
  230    H    LYS  28           H        LYS  28  -6.496  -3.794   3.885
  231    HA   LYS  28           HA       LYS  28  -8.361  -3.297   6.115
  232    HB2  LYS  28           HB2      LYS  28  -8.874  -3.879   3.175
  233    HB3  LYS  28           HB3      LYS  28 -10.128  -3.520   4.362
  234    HG2  LYS  28           HG2      LYS  28  -9.266  -1.252   4.643
  235    HG3  LYS  28           HG3      LYS  28  -7.912  -1.594   3.560
  236    HD2  LYS  28           HD2      LYS  28 -10.864  -1.586   2.791
  237    HD3  LYS  28           HD3      LYS  28  -9.696  -0.321   2.398
  238    HE2  LYS  28           HE2      LYS  28  -8.454  -1.847   0.954
  239    HE3  LYS  28           HE3      LYS  28  -9.455  -3.208   1.453
  240    HZ1  LYS  28           HZ1      LYS  28 -11.326  -2.247   0.379
  241    HZ2  LYS  28           HZ2      LYS  28 -10.046  -2.294  -0.725
  242    HZ3  LYS  28           HZ3      LYS  28 -10.476  -0.836   0.009
  243    H    GLU  29           H        GLU  29  -7.249  -5.853   3.982
  244    HA   GLU  29           HA       GLU  29  -9.099  -7.852   5.175
  245    HB2  GLU  29           HB2      GLU  29  -7.853  -7.771   2.385
  246    HB3  GLU  29           HB3      GLU  29  -8.977  -8.997   2.968
  247    HG2  GLU  29           HG2      GLU  29 -10.806  -7.509   2.963
  248    HG3  GLU  29           HG3      GLU  29  -9.770  -6.083   2.937
  249    H    GLY  30           H        GLY  30  -6.154  -6.919   5.757
  250    HA2  GLY  30           HA2      GLY  30  -5.148  -9.591   6.406
  251    HA3  GLY  30           HA3      GLY  30  -4.160  -8.656   5.288
  252    H    THR  31           H        THR  31  -2.545  -7.594   6.264
  253    HA   THR  31           HA       THR  31  -2.946  -6.259   8.863
  254    HB   THR  31           HB       THR  31  -0.581  -6.859   9.509
  255    HG1  THR  31           HG1      THR  31   0.400  -8.630   8.353
  256   HG21  THR  31          HG21      THR  31  -1.042  -9.183  10.229
  257   HG22  THR  31          HG22      THR  31  -2.402  -9.266   9.107
  258   HG23  THR  31          HG23      THR  31  -2.453  -8.153  10.476
  259    H    SER  32           H        SER  32  -2.179  -4.263   8.920
  260    HA   SER  32           HA       SER  32  -1.477  -2.788   6.632
  261    HB2  SER  32           HB2      SER  32  -1.103  -0.932   8.314
  262    HB3  SER  32           HB3      SER  32  -2.649  -1.760   8.503
  263    HG   SER  32           HG       SER  32  -0.451  -1.688  10.189
  264    H    GLU  33           H        GLU  33   0.454  -4.424   9.032
  265    HA   GLU  33           HA       GLU  33   2.953  -3.117   8.655
  266    HB2  GLU  33           HB2      GLU  33   2.373  -5.923   9.705
  267    HB3  GLU  33           HB3      GLU  33   3.895  -5.051   9.892
  268    HG2  GLU  33           HG2      GLU  33   2.722  -3.328  11.244
  269    HG3  GLU  33           HG3      GLU  33   1.221  -4.253  11.103
  270    H    ASP  34           H        ASP  34   1.424  -5.954   7.152
  271    HA   ASP  34           HA       ASP  34   3.745  -6.626   5.540
  272    HB2  ASP  34           HB2      ASP  34   2.218  -8.408   6.302
  273    HB3  ASP  34           HB3      ASP  34   0.885  -7.647   5.432
  274    H    ALA  35           H        ALA  35   0.910  -4.616   5.253
  275    HA   ALA  35           HA       ALA  35   0.647  -4.375   2.459
  276    HB1  ALA  35           HB1      ALA  35  -0.573  -2.289   2.936
  277    HB2  ALA  35           HB2      ALA  35   0.043  -2.299   4.594
  278    HB3  ALA  35           HB3      ALA  35  -1.047  -3.575   4.050
  279    H    GLU  36           H        GLU  36   2.520  -2.372   4.763
  280    HA   GLU  36           HA       GLU  36   3.734  -0.687   2.804
  281    HB2  GLU  36           HB2      GLU  36   5.245   0.020   4.645
  282    HB3  GLU  36           HB3      GLU  36   3.549   0.045   5.123
  283    HG2  GLU  36           HG2      GLU  36   3.842  -2.103   6.294
  284    HG3  GLU  36           HG3      GLU  36   5.536  -2.139   5.815
  285    H    ARG  37           H        ARG  37   4.580  -3.796   4.197
  286    HA   ARG  37           HA       ARG  37   7.209  -4.115   3.223
  287    HB2  ARG  37           HB2      ARG  37   6.321  -5.547   4.964
  288    HB3  ARG  37           HB3      ARG  37   5.021  -6.104   3.925
  289    HG2  ARG  37           HG2      ARG  37   6.643  -7.332   2.524
  290    HG3  ARG  37           HG3      ARG  37   7.965  -6.739   3.538
  291    HD2  ARG  37           HD2      ARG  37   7.008  -7.908   5.493
  292    HD3  ARG  37           HD3      ARG  37   5.668  -8.488   4.504
  293    HE   ARG  37           HE       ARG  37   7.148  -9.933   3.365
  294   HH11  ARG  37          HH11      ARG  37   8.746  -8.309   6.054
  295   HH12  ARG  37          HH12      ARG  37  10.048  -9.453   6.115
  296   HH21  ARG  37          HH21      ARG  37   8.880 -11.391   3.453
  297   HH22  ARG  37          HH22      ARG  37  10.122 -11.189   4.650
  298    H    MET  38           H        MET  38   4.031  -4.763   1.745
  299    HA   MET  38           HA       MET  38   5.092  -5.859  -0.705
  300    HB2  MET  38           HB2      MET  38   2.293  -4.842  -0.059
  301    HB3  MET  38           HB3      MET  38   2.732  -5.727  -1.510
  302    HG2  MET  38           HG2      MET  38   2.971  -6.887   1.277
  303    HG3  MET  38           HG3      MET  38   1.535  -7.049   0.276
  304    HE1  MET  38           HE1      MET  38   4.945  -8.494   1.212
  305    HE2  MET  38           HE2      MET  38   5.545  -7.608  -0.193
  306    HE3  MET  38           HE3      MET  38   5.472  -9.368  -0.223
  307    H    ALA  39           H        ALA  39   4.326  -2.671   0.500
  308    HA   ALA  39           HA       ALA  39   4.049  -1.216  -1.919
  309    HB1  ALA  39           HB1      ALA  39   3.328  -0.335   0.272
  310    HB2  ALA  39           HB2      ALA  39   4.425   0.789  -0.531
  311    HB3  ALA  39           HB3      ALA  39   5.010  -0.223   0.796
  312    H    ARG  40           H        ARG  40   6.839  -1.873   0.175
  313    HA   ARG  40           HA       ARG  40   8.774  -0.602  -1.568
  314    HB2  ARG  40           HB2      ARG  40  10.450  -1.460   0.058
  315    HB3  ARG  40           HB3      ARG  40   9.154  -0.552   0.832
  316    HG2  ARG  40           HG2      ARG  40   8.070  -2.681   1.494
  317    HG3  ARG  40           HG3      ARG  40   9.395  -3.582   0.751
  318    HD2  ARG  40           HD2      ARG  40  10.979  -2.616   2.326
  319    HD3  ARG  40           HD3      ARG  40   9.717  -1.594   3.017
  320    HE   ARG  40           HE       ARG  40   8.750  -3.469   4.040
  321   HH11  ARG  40          HH11      ARG  40  11.705  -4.354   2.332
  322   HH12  ARG  40          HH12      ARG  40  11.877  -5.858   3.178
  323   HH21  ARG  40          HH21      ARG  40   9.024  -5.419   5.178
  324   HH22  ARG  40          HH22      ARG  40  10.358  -6.464   4.792
  325    H    ASN  41           H        ASN  41   7.091  -3.292  -2.094
  326    HA   ASN  41           HA       ASN  41   9.279  -4.653  -3.553
  327    HB2  ASN  41           HB2      ASN  41   6.715  -5.729  -2.333
  328    HB3  ASN  41           HB3      ASN  41   7.592  -6.628  -3.569
  329   HD21  ASN  41          HD21      ASN  41   7.115  -6.900  -0.529
  330   HD22  ASN  41          HD22      ASN  41   8.668  -7.349   0.062
  331    H    CYS  42           H        CYS  42   6.470  -2.718  -3.902
  332    HA   CYS  42           HA       CYS  42   6.252  -3.345  -6.778
  333    HB2  CYS  42           HB2      CYS  42   4.096  -2.920  -5.709
  334    HB3  CYS  42           HB3      CYS  42   4.673  -1.377  -5.076
  335    H    GLU  43           H        GLU  43   6.564  -0.328  -4.858
  336    HA   GLU  43           HA       GLU  43   7.627   1.632  -5.190
  337    HB2  GLU  43           HB2      GLU  43   9.846  -0.148  -6.253
  338    HB3  GLU  43           HB3      GLU  43  10.042   1.501  -5.662
  339    HG2  GLU  43           HG2      GLU  43   9.369   0.767  -3.396
  340    HG3  GLU  43           HG3      GLU  43   9.160  -0.878  -3.994
  341    H    SER  44           H        SER  44   5.949   1.978  -6.977
  342    HA   SER  44           HA       SER  44   6.925   2.009  -9.709
  343    HB2  SER  44           HB2      SER  44   4.415   3.333  -8.593
  344    HB3  SER  44           HB3      SER  44   4.746   2.913 -10.274
  345    HG   SER  44           HG       SER  44   4.597   0.748  -9.739
  Start of MODEL   20
    1    H1   ALA   1           H1       ALA   1  -4.206   7.089  12.658
    2    H2   ALA   1           H2       ALA   1  -3.475   8.549  12.206
    3    H3   ALA   1           H3       ALA   1  -2.934   7.089  11.540
    4    HA   ALA   1           HA       ALA   1  -5.617   8.273  11.149
    5    HB1  ALA   1           HB1      ALA   1  -3.292   8.097   9.198
    6    HB2  ALA   1           HB2      ALA   1  -3.845   9.561  10.006
    7    HB3  ALA   1           HB3      ALA   1  -4.896   8.752   8.848
    8    HA   PRO   2           HA       PRO   2  -6.274   3.800  10.730
    9    HB2  PRO   2           HB2      PRO   2  -8.998   3.858  10.229
   10    HB3  PRO   2           HB3      PRO   2  -8.300   4.071  11.846
   11    HG2  PRO   2           HG2      PRO   2  -9.285   6.163   9.939
   12    HG3  PRO   2           HG3      PRO   2  -9.488   6.071  11.702
   13    HD2  PRO   2           HD2      PRO   2  -7.638   7.680  10.536
   14    HD3  PRO   2           HD3      PRO   2  -7.373   6.942  12.127
   15    H    CYS   3           H        CYS   3  -5.003   3.669   8.888
   16    HA   CYS   3           HA       CYS   3  -4.514   2.769   6.923
   17    HB2  CYS   3           HB2      CYS   3  -6.908   1.775   6.962
   18    HB3  CYS   3           HB3      CYS   3  -7.302   3.060   5.825
   19    H    GLU   4           H        GLU   4  -6.103   5.811   7.235
   20    HA   GLU   4           HA       GLU   4  -5.961   6.913   4.683
   21    HB2  GLU   4           HB2      GLU   4  -7.202   7.978   6.472
   22    HB3  GLU   4           HB3      GLU   4  -5.741   8.210   7.427
   23    HG2  GLU   4           HG2      GLU   4  -4.893   9.782   5.663
   24    HG3  GLU   4           HG3      GLU   4  -6.424   9.598   4.806
   25    H    ASP   5           H        ASP   5  -3.559   6.981   7.323
   26    HA   ASP   5           HA       ASP   5  -1.582   8.573   6.156
   27    HB2  ASP   5           HB2      ASP   5  -1.596   7.935   8.554
   28    HB3  ASP   5           HB3      ASP   5  -1.237   6.265   8.133
   29    H    LEU   6           H        LEU   6  -2.258   5.142   5.827
   30    HA   LEU   6           HA       LEU   6   0.155   4.428   4.458
   31    HB2  LEU   6           HB2      LEU   6  -1.479   2.992   5.900
   32    HB3  LEU   6           HB3      LEU   6  -2.438   2.850   4.445
   33    HG   LEU   6           HG       LEU   6   0.479   2.030   4.377
   34   HD11  LEU   6          HD11      LEU   6  -1.743   0.253   5.420
   35   HD12  LEU   6          HD12      LEU   6  -0.412   0.920   6.366
   36   HD13  LEU   6          HD13      LEU   6  -0.078  -0.242   5.086
   37   HD21  LEU   6          HD21      LEU   6  -1.958   0.977   2.899
   38   HD22  LEU   6          HD22      LEU   6  -0.294   0.429   2.673
   39   HD23  LEU   6          HD23      LEU   6  -0.744   2.079   2.247
   40    H    LYS   7           H        LYS   7  -3.239   4.942   3.485
   41    HA   LYS   7           HA       LYS   7  -3.116   4.458   0.744
   42    HB2  LYS   7           HB2      LYS   7  -4.910   6.270   2.394
   43    HB3  LYS   7           HB3      LYS   7  -5.187   5.986   0.676
   44    HG2  LYS   7           HG2      LYS   7  -5.630   3.649   1.051
   45    HG3  LYS   7           HG3      LYS   7  -5.108   3.759   2.735
   46    HD2  LYS   7           HD2      LYS   7  -7.625   3.693   2.364
   47    HD3  LYS   7           HD3      LYS   7  -7.029   5.025   3.357
   48    HE2  LYS   7           HE2      LYS   7  -8.796   5.714   1.734
   49    HE3  LYS   7           HE3      LYS   7  -7.281   6.586   1.502
   50    HZ1  LYS   7           HZ1      LYS   7  -8.336   5.822  -0.579
   51    HZ2  LYS   7           HZ2      LYS   7  -8.113   4.217  -0.086
   52    HZ3  LYS   7           HZ3      LYS   7  -6.776   5.206  -0.372
   53    H    GLU   8           H        GLU   8  -2.885   7.592   2.441
   54    HA   GLU   8           HA       GLU   8  -2.763   9.273   0.204
   55    HB2  GLU   8           HB2      GLU   8  -1.967  11.032   1.745
   56    HB3  GLU   8           HB3      GLU   8  -3.295  10.129   2.469
   57    HG2  GLU   8           HG2      GLU   8  -1.730   8.859   3.849
   58    HG3  GLU   8           HG3      GLU   8  -0.360   9.655   3.087
   59    H    ARG   9           H        ARG   9  -0.235   7.600   2.037
   60    HA   ARG   9           HA       ARG   9   1.991   8.806   0.755
   61    HB2  ARG   9           HB2      ARG   9   1.672   6.316   2.437
   62    HB3  ARG   9           HB3      ARG   9   3.205   6.665   1.641
   63    HG2  ARG   9           HG2      ARG   9   3.318   8.839   2.821
   64    HG3  ARG   9           HG3      ARG   9   1.807   8.456   3.653
   65    HD2  ARG   9           HD2      ARG   9   4.414   6.910   3.863
   66    HD3  ARG   9           HD3      ARG   9   3.751   7.992   5.095
   67    HE   ARG   9           HE       ARG   9   1.752   6.322   4.924
   68   HH11  ARG   9          HH11      ARG   9   5.145   5.456   4.872
   69   HH12  ARG   9          HH12      ARG   9   4.878   3.893   5.570
   70   HH21  ARG   9          HH21      ARG   9   1.406   4.304   5.847
   71   HH22  ARG   9          HH22      ARG   9   2.744   3.236   6.129
   72    H    LEU  10           H        LEU  10   0.140   5.780   0.135
   73    HA   LEU  10           HA       LEU  10   1.777   4.627  -1.832
   74    HB2  LEU  10           HB2      LEU  10  -1.265   4.562  -1.824
   75    HB3  LEU  10           HB3      LEU  10  -0.207   3.417  -2.634
   76    HG   LEU  10           HG       LEU  10  -0.624   3.730   0.349
   77   HD11  LEU  10          HD11      LEU  10  -1.288   1.452  -1.506
   78   HD12  LEU  10          HD12      LEU  10  -2.426   2.588  -0.775
   79   HD13  LEU  10          HD13      LEU  10  -1.520   1.475   0.244
   80   HD21  LEU  10          HD21      LEU  10   1.731   3.256   0.036
   81   HD22  LEU  10          HD22      LEU  10   1.365   1.929  -1.068
   82   HD23  LEU  10          HD23      LEU  10   0.923   1.808   0.637
   83    H    LYS  11           H        LYS  11  -0.769   7.034  -2.110
   84    HA   LYS  11           HA       LYS  11  -0.817   7.241  -4.948
   85    HB2  LYS  11           HB2      LYS  11  -1.811   9.209  -2.853
   86    HB3  LYS  11           HB3      LYS  11  -2.243   9.216  -4.563
   87    HG2  LYS  11           HG2      LYS  11  -3.283   6.940  -4.237
   88    HG3  LYS  11           HG3      LYS  11  -2.975   7.103  -2.506
   89    HD2  LYS  11           HD2      LYS  11  -4.713   8.964  -4.181
   90    HD3  LYS  11           HD3      LYS  11  -5.312   7.714  -3.091
   91    HE2  LYS  11           HE2      LYS  11  -4.386   8.894  -1.159
   92    HE3  LYS  11           HE3      LYS  11  -3.638  10.097  -2.214
   93    HZ1  LYS  11           HZ1      LYS  11  -5.707  10.893  -1.232
   94    HZ2  LYS  11           HZ2      LYS  11  -6.556   9.628  -1.961
   95    HZ3  LYS  11           HZ3      LYS  11  -5.818  10.808  -2.918
   96    H    LYS  12           H        LYS  12   0.691   9.159  -2.353
   97    HA   LYS  12           HA       LYS  12   1.779  11.220  -4.008
   98    HB2  LYS  12           HB2      LYS  12   1.324  11.447  -1.550
   99    HB3  LYS  12           HB3      LYS  12   2.640  10.326  -1.224
  100    HG2  LYS  12           HG2      LYS  12   4.182  11.994  -2.410
  101    HG3  LYS  12           HG3      LYS  12   2.826  13.126  -2.373
  102    HD2  LYS  12           HD2      LYS  12   2.781  12.952   0.112
  103    HD3  LYS  12           HD3      LYS  12   4.158  11.847   0.041
  104    HE2  LYS  12           HE2      LYS  12   4.142  14.760  -0.818
  105    HE3  LYS  12           HE3      LYS  12   4.923  14.096   0.617
  106    HZ1  LYS  12           HZ1      LYS  12   6.379  12.805  -0.843
  107    HZ2  LYS  12           HZ2      LYS  12   6.517  14.464  -1.138
  108    HZ3  LYS  12           HZ3      LYS  12   5.644  13.490  -2.204
  109    H    LEU  13           H        LEU  13   2.858   8.086  -3.020
  110    HA   LEU  13           HA       LEU  13   5.676   8.416  -3.393
  111    HB2  LEU  13           HB2      LEU  13   4.358   6.838  -1.810
  112    HB3  LEU  13           HB3      LEU  13   4.121   5.811  -3.207
  113    HG   LEU  13           HG       LEU  13   6.552   5.432  -3.342
  114   HD11  LEU  13          HD11      LEU  13   6.781   7.188  -0.885
  115   HD12  LEU  13          HD12      LEU  13   7.389   7.565  -2.501
  116   HD13  LEU  13          HD13      LEU  13   8.078   6.221  -1.594
  117   HD21  LEU  13          HD21      LEU  13   5.412   4.932  -0.570
  118   HD22  LEU  13          HD22      LEU  13   6.793   4.089  -1.283
  119   HD23  LEU  13          HD23      LEU  13   5.190   3.906  -1.992
  120    H    GLY  14           H        GLY  14   2.951   7.504  -5.374
  121    HA2  GLY  14           HA2      GLY  14   2.739   7.502  -7.643
  122    HA3  GLY  14           HA3      GLY  14   4.403   8.052  -7.756
  123    H    MET  15           H        MET  15   2.835   5.058  -6.612
  124    HA   MET  15           HA       MET  15   4.563   3.401  -8.343
  125    HB2  MET  15           HB2      MET  15   3.696   1.504  -7.037
  126    HB3  MET  15           HB3      MET  15   4.288   2.750  -5.951
  127    HG2  MET  15           HG2      MET  15   1.907   3.487  -5.606
  128    HG3  MET  15           HG3      MET  15   1.397   2.119  -6.583
  129    HE1  MET  15           HE1      MET  15   4.371   2.230  -3.936
  130    HE2  MET  15           HE2      MET  15   3.516   1.673  -2.500
  131    HE3  MET  15           HE3      MET  15   3.116   3.238  -3.209
  132    H    SER  16           H        SER  16   2.816   1.276  -8.902
  133    HA   SER  16           HA       SER  16   0.936   2.394 -10.817
  134    HB2  SER  16           HB2      SER  16   1.549  -0.494 -10.054
  135    HB3  SER  16           HB3      SER  16   0.432  -0.015 -11.334
  136    HG   SER  16           HG       SER  16   3.191   0.667 -11.231
  137    H    GLU  17           H        GLU  17  -1.330   2.254 -10.663
  138    HA   GLU  17           HA       GLU  17  -2.523   2.591  -8.148
  139    HB2  GLU  17           HB2      GLU  17  -3.799   1.918 -10.825
  140    HB3  GLU  17           HB3      GLU  17  -4.716   2.368  -9.386
  141    HG2  GLU  17           HG2      GLU  17  -3.561   4.543  -9.333
  142    HG3  GLU  17           HG3      GLU  17  -2.673   4.111 -10.792
  143    H    GLU  18           H        GLU  18  -1.986  -0.275 -10.049
  144    HA   GLU  18           HA       GLU  18  -3.941  -1.992  -8.906
  145    HB2  GLU  18           HB2      GLU  18  -2.739  -3.807 -10.032
  146    HB3  GLU  18           HB3      GLU  18  -2.913  -2.430 -11.108
  147    HG2  GLU  18           HG2      GLU  18  -0.559  -1.780 -10.642
  148    HG3  GLU  18           HG3      GLU  18  -0.386  -3.201  -9.615
  149    H    CYS  19           H        CYS  19  -0.525  -1.250  -8.196
  150    HA   CYS  19           HA       CYS  19  -0.057  -3.114  -6.134
  151    HB2  CYS  19           HB2      CYS  19   1.071  -0.365  -6.773
  152    HB3  CYS  19           HB3      CYS  19   1.582  -1.229  -5.344
  153    H    ARG  20           H        ARG  20  -1.300   0.246  -6.100
  154    HA   ARG  20           HA       ARG  20  -1.257   0.747  -3.344
  155    HB2  ARG  20           HB2      ARG  20  -3.403   1.733  -5.278
  156    HB3  ARG  20           HB3      ARG  20  -3.031   2.416  -3.695
  157    HG2  ARG  20           HG2      ARG  20  -0.822   3.125  -4.552
  158    HG3  ARG  20           HG3      ARG  20  -1.270   2.502  -6.153
  159    HD2  ARG  20           HD2      ARG  20  -2.764   4.616  -4.575
  160    HD3  ARG  20           HD3      ARG  20  -1.751   4.919  -5.997
  161    HE   ARG  20           HE       ARG  20  -3.627   3.096  -6.828
  162   HH11  ARG  20          HH11      ARG  20  -3.849   6.311  -5.451
  163   HH12  ARG  20          HH12      ARG  20  -5.352   6.671  -6.226
  164   HH21  ARG  20          HH21      ARG  20  -5.630   3.572  -7.813
  165   HH22  ARG  20          HH22      ARG  20  -6.360   5.121  -7.562
  166    H    GLN  21           H        GLN  21  -3.917  -0.472  -5.338
  167    HA   GLN  21           HA       GLN  21  -5.843  -0.507  -3.302
  168    HB2  GLN  21           HB2      GLN  21  -5.726  -1.922  -5.993
  169    HB3  GLN  21           HB3      GLN  21  -7.169  -1.890  -4.978
  170    HG2  GLN  21           HG2      GLN  21  -7.393   0.481  -5.195
  171    HG3  GLN  21           HG3      GLN  21  -5.789   0.647  -5.903
  172   HE21  GLN  21          HE21      GLN  21  -5.497   0.176  -8.074
  173   HE22  GLN  21          HE22      GLN  21  -6.804   0.003  -9.170
  174    H    ARG  22           H        ARG  22  -3.527  -2.917  -4.409
  175    HA   ARG  22           HA       ARG  22  -4.441  -5.163  -2.894
  176    HB2  ARG  22           HB2      ARG  22  -1.696  -4.460  -4.015
  177    HB3  ARG  22           HB3      ARG  22  -2.097  -6.023  -3.336
  178    HG2  ARG  22           HG2      ARG  22  -3.682  -6.469  -5.096
  179    HG3  ARG  22           HG3      ARG  22  -3.536  -4.818  -5.705
  180    HD2  ARG  22           HD2      ARG  22  -1.073  -5.338  -6.136
  181    HD3  ARG  22           HD3      ARG  22  -1.471  -7.031  -5.819
  182    HE   ARG  22           HE       ARG  22  -3.295  -6.351  -7.684
  183   HH11  ARG  22          HH11      ARG  22   0.198  -5.911  -7.621
  184   HH12  ARG  22          HH12      ARG  22   0.351  -5.991  -9.345
  185   HH21  ARG  22          HH21      ARG  22  -3.067  -6.436  -9.941
  186   HH22  ARG  22          HH22      ARG  22  -1.491  -6.287 -10.659
  187    H    LEU  23           H        LEU  23  -2.284  -2.444  -2.281
  188    HA   LEU  23           HA       LEU  23  -1.180  -3.400   0.193
  189    HB2  LEU  23           HB2      LEU  23  -1.270  -0.580  -0.935
  190    HB3  LEU  23           HB3      LEU  23  -0.197  -1.151   0.316
  191    HG   LEU  23           HG       LEU  23  -0.169  -1.990  -2.583
  192   HD11  LEU  23          HD11      LEU  23   1.891  -0.409  -1.056
  193   HD12  LEU  23          HD12      LEU  23   0.763   0.217  -2.260
  194   HD13  LEU  23          HD13      LEU  23   2.002  -0.936  -2.742
  195   HD21  LEU  23          HD21      LEU  23   1.606  -2.993  -0.360
  196   HD22  LEU  23          HD22      LEU  23   1.816  -3.326  -2.079
  197   HD23  LEU  23          HD23      LEU  23   0.387  -3.912  -1.242
  198    H    GLU  24           H        GLU  24  -3.730  -1.152  -0.707
  199    HA   GLU  24           HA       GLU  24  -4.645  -0.388   1.838
  200    HB2  GLU  24           HB2      GLU  24  -6.067  -0.500  -0.852
  201    HB3  GLU  24           HB3      GLU  24  -6.738   0.272   0.587
  202    HG2  GLU  24           HG2      GLU  24  -4.977   1.929   0.598
  203    HG3  GLU  24           HG3      GLU  24  -4.114   1.095  -0.692
  204    H    LYS  25           H        LYS  25  -5.210  -3.182  -0.209
  205    HA   LYS  25           HA       LYS  25  -7.474  -4.235   1.214
  206    HB2  LYS  25           HB2      LYS  25  -6.961  -4.818  -1.143
  207    HB3  LYS  25           HB3      LYS  25  -5.493  -5.635  -0.622
  208    HG2  LYS  25           HG2      LYS  25  -6.839  -7.294   0.620
  209    HG3  LYS  25           HG3      LYS  25  -8.319  -6.450   0.156
  210    HD2  LYS  25           HD2      LYS  25  -6.375  -7.851  -1.718
  211    HD3  LYS  25           HD3      LYS  25  -7.990  -8.409  -1.278
  212    HE2  LYS  25           HE2      LYS  25  -8.960  -6.400  -2.382
  213    HE3  LYS  25           HE3      LYS  25  -7.337  -5.885  -2.842
  214    HZ1  LYS  25           HZ1      LYS  25  -8.404  -6.979  -4.664
  215    HZ2  LYS  25           HZ2      LYS  25  -8.709  -8.358  -3.736
  216    HZ3  LYS  25           HZ3      LYS  25  -7.117  -7.933  -4.124
  217    H    MET  26           H        MET  26  -3.960  -4.732   1.269
  218    HA   MET  26           HA       MET  26  -3.862  -6.643   3.373
  219    HB2  MET  26           HB2      MET  26  -1.836  -4.654   2.293
  220    HB3  MET  26           HB3      MET  26  -1.448  -5.797   3.577
  221    HG2  MET  26           HG2      MET  26  -2.378  -6.549   0.794
  222    HG3  MET  26           HG3      MET  26  -0.711  -6.605   1.379
  223    HE1  MET  26           HE1      MET  26  -2.007  -9.155   0.072
  224    HE2  MET  26           HE2      MET  26  -1.579 -10.418   1.226
  225    HE3  MET  26           HE3      MET  26  -0.400  -9.179   0.798
  226    H    CYS  27           H        CYS  27  -4.017  -3.164   3.274
  227    HA   CYS  27           HA       CYS  27  -3.350  -2.538   5.962
  228    HB2  CYS  27           HB2      CYS  27  -3.219  -0.895   4.148
  229    HB3  CYS  27           HB3      CYS  27  -4.952  -1.017   3.872
  230    H    LYS  28           H        LYS  28  -6.282  -3.717   4.480
  231    HA   LYS  28           HA       LYS  28  -7.977  -2.987   6.797
  232    HB2  LYS  28           HB2      LYS  28  -8.748  -3.869   3.981
  233    HB3  LYS  28           HB3      LYS  28  -9.891  -3.442   5.254
  234    HG2  LYS  28           HG2      LYS  28  -9.179  -1.146   5.243
  235    HG3  LYS  28           HG3      LYS  28  -7.808  -1.512   4.192
  236    HD2  LYS  28           HD2      LYS  28  -9.420  -2.114   2.368
  237    HD3  LYS  28           HD3      LYS  28 -10.755  -1.642   3.426
  238    HE2  LYS  28           HE2      LYS  28  -9.876   0.657   3.502
  239    HE3  LYS  28           HE3      LYS  28  -8.528   0.182   2.466
  240    HZ1  LYS  28           HZ1      LYS  28 -10.361   1.289   1.285
  241    HZ2  LYS  28           HZ2      LYS  28 -11.381   0.001   1.676
  242    HZ3  LYS  28           HZ3      LYS  28 -10.032  -0.256   0.692
  243    H    GLU  29           H        GLU  29  -7.076  -5.737   4.745
  244    HA   GLU  29           HA       GLU  29  -8.790  -7.607   6.198
  245    HB2  GLU  29           HB2      GLU  29  -7.024  -8.156   3.777
  246    HB3  GLU  29           HB3      GLU  29  -8.326  -9.175   4.379
  247    HG2  GLU  29           HG2      GLU  29  -8.650  -6.417   3.151
  248    HG3  GLU  29           HG3      GLU  29  -8.949  -7.945   2.328
  249    H    GLY  30           H        GLY  30  -5.413  -6.776   5.852
  250    HA2  GLY  30           HA2      GLY  30  -4.594  -9.063   7.593
  251    HA3  GLY  30           HA3      GLY  30  -3.598  -8.427   6.286
  252    H    THR  31           H        THR  31  -1.884  -7.492   7.259
  253    HA   THR  31           HA       THR  31  -2.375  -5.543   9.456
  254    HB   THR  31           HB       THR  31  -0.092  -5.889  10.243
  255    HG1  THR  31           HG1      THR  31   0.335  -7.958   8.360
  256   HG21  THR  31          HG21      THR  31  -1.748  -7.485  11.121
  257   HG22  THR  31          HG22      THR  31  -0.165  -8.258  10.966
  258   HG23  THR  31          HG23      THR  31  -1.427  -8.574   9.773
  259    H    SER  32           H        SER  32  -0.920  -3.693   9.456
  260    HA   SER  32           HA       SER  32  -0.784  -2.289   7.031
  261    HB2  SER  32           HB2      SER  32   0.781  -1.761   9.589
  262    HB3  SER  32           HB3      SER  32   0.380  -0.577   8.340
  263    HG   SER  32           HG       SER  32  -1.563  -0.393   9.154
  264    H    GLU  33           H        GLU  33   1.520  -4.420   8.667
  265    HA   GLU  33           HA       GLU  33   3.850  -3.680   7.256
  266    HB2  GLU  33           HB2      GLU  33   3.168  -6.299   8.632
  267    HB3  GLU  33           HB3      GLU  33   4.731  -5.971   7.888
  268    HG2  GLU  33           HG2      GLU  33   4.671  -3.819   9.458
  269    HG3  GLU  33           HG3      GLU  33   3.540  -4.798  10.392
  270    H    ASP  34           H        ASP  34   1.367  -6.157   6.553
  271    HA   ASP  34           HA       ASP  34   2.598  -7.402   4.354
  272    HB2  ASP  34           HB2      ASP  34  -0.376  -6.929   4.851
  273    HB3  ASP  34           HB3      ASP  34   0.263  -8.018   3.623
  274    H    ALA  35           H        ALA  35   0.891  -4.367   4.558
  275    HA   ALA  35           HA       ALA  35   0.684  -3.777   1.780
  276    HB1  ALA  35           HB1      ALA  35   0.125  -1.512   2.529
  277    HB2  ALA  35           HB2      ALA  35   0.643  -1.918   4.168
  278    HB3  ALA  35           HB3      ALA  35  -0.757  -2.725   3.458
  279    H    GLU  36           H        GLU  36   3.027  -2.779   4.335
  280    HA   GLU  36           HA       GLU  36   4.497  -1.051   2.588
  281    HB2  GLU  36           HB2      GLU  36   6.042  -0.697   4.404
  282    HB3  GLU  36           HB3      GLU  36   4.419  -0.764   5.081
  283    HG2  GLU  36           HG2      GLU  36   4.862  -3.147   5.730
  284    HG3  GLU  36           HG3      GLU  36   6.526  -2.938   5.187
  285    H    ARG  37           H        ARG  37   4.798  -4.450   3.440
  286    HA   ARG  37           HA       ARG  37   7.389  -5.027   2.492
  287    HB2  ARG  37           HB2      ARG  37   4.919  -6.826   2.421
  288    HB3  ARG  37           HB3      ARG  37   6.577  -7.375   2.206
  289    HG2  ARG  37           HG2      ARG  37   7.107  -6.732   4.516
  290    HG3  ARG  37           HG3      ARG  37   5.469  -6.135   4.739
  291    HD2  ARG  37           HD2      ARG  37   4.697  -8.534   4.159
  292    HD3  ARG  37           HD3      ARG  37   6.382  -9.005   4.387
  293    HE   ARG  37           HE       ARG  37   4.444  -8.503   6.393
  294   HH11  ARG  37          HH11      ARG  37   7.915  -8.081   5.850
  295   HH12  ARG  37          HH12      ARG  37   8.288  -8.119   7.543
  296   HH21  ARG  37          HH21      ARG  37   4.955  -8.518   8.578
  297   HH22  ARG  37          HH22      ARG  37   6.604  -8.366   9.096
  298    H    MET  38           H        MET  38   4.223  -5.238   0.867
  299    HA   MET  38           HA       MET  38   5.374  -5.846  -1.692
  300    HB2  MET  38           HB2      MET  38   2.521  -5.279  -0.854
  301    HB3  MET  38           HB3      MET  38   2.985  -5.704  -2.495
  302    HG2  MET  38           HG2      MET  38   3.452  -7.468  -0.075
  303    HG3  MET  38           HG3      MET  38   2.082  -7.613  -1.168
  304    HE1  MET  38           HE1      MET  38   6.404  -9.039  -2.036
  305    HE2  MET  38           HE2      MET  38   5.708  -8.771  -0.438
  306    HE3  MET  38           HE3      MET  38   6.134  -7.396  -1.457
  307    H    ALA  39           H        ALA  39   4.609  -2.908  -0.026
  308    HA   ALA  39           HA       ALA  39   4.416  -1.173  -2.301
  309    HB1  ALA  39           HB1      ALA  39   4.791   0.657  -0.687
  310    HB2  ALA  39           HB2      ALA  39   5.249  -0.517   0.553
  311    HB3  ALA  39           HB3      ALA  39   3.600  -0.495  -0.076
  312    H    ARG  40           H        ARG  40   7.103  -2.151  -0.167
  313    HA   ARG  40           HA       ARG  40   9.086  -0.558  -1.554
  314    HB2  ARG  40           HB2      ARG  40  10.707  -1.480   0.019
  315    HB3  ARG  40           HB3      ARG  40   9.266  -0.944   0.874
  316    HG2  ARG  40           HG2      ARG  40   8.483  -3.283   1.030
  317    HG3  ARG  40           HG3      ARG  40   9.937  -3.829   0.194
  318    HD2  ARG  40           HD2      ARG  40  10.125  -4.163   2.606
  319    HD3  ARG  40           HD3      ARG  40  11.315  -2.984   2.045
  320    HE   ARG  40           HE       ARG  40   9.398  -1.340   2.842
  321   HH11  ARG  40          HH11      ARG  40  10.620  -4.200   4.508
  322   HH12  ARG  40          HH12      ARG  40  10.267  -3.572   6.084
  323   HH21  ARG  40          HH21      ARG  40   9.007  -0.517   4.907
  324   HH22  ARG  40          HH22      ARG  40   9.351  -1.480   6.309
  325    H    ASN  41           H        ASN  41   7.627  -3.473  -2.294
  326    HA   ASN  41           HA       ASN  41   9.837  -4.202  -4.134
  327    HB2  ASN  41           HB2      ASN  41   7.818  -6.096  -2.853
  328    HB3  ASN  41           HB3      ASN  41   8.953  -6.559  -4.116
  329   HD21  ASN  41          HD21      ASN  41   8.512  -6.261  -0.779
  330   HD22  ASN  41          HD22      ASN  41  10.133  -6.555  -0.286
  331    H    CYS  42           H        CYS  42   7.016  -2.620  -4.125
  332    HA   CYS  42           HA       CYS  42   5.655  -3.770  -6.390
  333    HB2  CYS  42           HB2      CYS  42   4.254  -2.430  -4.991
  334    HB3  CYS  42           HB3      CYS  42   5.414  -1.105  -4.954
  335    H    GLU  43           H        GLU  43   7.582  -0.782  -5.967
  336    HA   GLU  43           HA       GLU  43   8.711  -0.714  -8.560
  337    HB2  GLU  43           HB2      GLU  43   6.255  -0.356  -9.121
  338    HB3  GLU  43           HB3      GLU  43   6.288   1.110  -8.149
  339    HG2  GLU  43           HG2      GLU  43   8.055   2.008  -9.675
  340    HG3  GLU  43           HG3      GLU  43   7.854   0.571 -10.675
  341    H    SER  44           H        SER  44   7.189   1.282  -6.076
  342    HA   SER  44           HA       SER  44   9.045   3.428  -6.064
  343    HB2  SER  44           HB2      SER  44   7.054   2.581  -3.906
  344    HB3  SER  44           HB3      SER  44   7.786   4.177  -4.094
  345    HG   SER  44           HG       SER  44   6.750   4.181  -6.221