*HEADER    TRANSCRIPTION                           11-APR-12   2LRQ              
*TITLE     CHEMICAL SHIFT ASSIGNMENT AND SOLUTION STRUCTURE OF CHR145 FROM       
*TITLE    2 DROSOPHILA MELANOGASTER. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM    
*TITLE    3 TARGET FR822A                                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NUA4 COMPLEX SUBUNIT EAF3 HOMOLOG;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 11-94;                                        
*COMPND   5 SYNONYM: PROTEIN MRG15;                                              
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER;                        
*SOURCE   3 ORGANISM_COMMON: FRUIT FLY;                                          
*SOURCE   4 ORGANISM_TAXID: 7227;                                                
*SOURCE   5 GENE: MRG15, CG6363;                                                 
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET15NANO6HT_NESG                          
*KEYWDS    EPIGENETICS, LID COMPLEX, TRANSCRIPTION                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    H.LEE, D.LEE, E.KOHAN, H.JANJUA, R.XIAO, T.ACTON, J.K.EVERETT,        
*AUTHOR   2 G.MONTELIONE, J.H.PRESTEGARD, NORTHEAST STRUCTURAL GENOMICS          
*AUTHOR   3 CONSORTIUM (NESG)                                                    
*REVDAT   2   22-AUG-12 2LRQ    1                                               
*REVDAT   1   04-JUL-12 2LRQ    0                                                

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13    and name N   )
       ( resid 13    and name HN   )  0.7764  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 14    and name N   )
       ( resid 14    and name HN   )  4.8647  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15    and name N   )
       ( resid 15    and name HN   )  11.6252  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 16    and name N   )
       ( resid 16    and name HN   )  13.046  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17    and name N   )
       ( resid 17    and name HN   )  -3.5281  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18    and name N   )
       ( resid 18    and name HN   )  12.3442  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 19    and name N   )
       ( resid 19    and name HN   )  -2.515  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 20    and name N   )
       ( resid 20    and name HN   )  -12.2812  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21    and name N   )
       ( resid 21    and name HN   )  -9.0834  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22    and name N   )
       ( resid 22    and name HN   )  3.1524  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 23    and name N   )
       ( resid 23    and name HN   )  10.2308  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 27    and name N   )
       ( resid 27    and name HN   )  8.9478  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 28    and name N   )
       ( resid 28    and name HN   )  1.2506  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 29    and name N   )
       ( resid 29    and name HN   )  6.3875  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30    and name N   )
       ( resid 30    and name HN   )  2.083  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31    and name N   )
       ( resid 31    and name HN   )  12.9065  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 32    and name N   )
       ( resid 32    and name HN   )  8.2605  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33    and name N   )
       ( resid 33    and name HN   )  3.2512  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 34    and name N   )
       ( resid 34    and name HN   )  5.4761  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35    and name N   )
       ( resid 35    and name HN   )  8.2437  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 36    and name N   )
       ( resid 36    and name HN   )  9.8901  1.5

#assign ( resid 500  and name OO  )
#       ( resid 500  and name Z   )
#       ( resid 500  and name X   )
#       ( resid 500  and name Y   )
#       ( resid 38    and name N   )
#       ( resid 38    and name HN   )  -17.7254  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 40    and name N   )
       ( resid 40    and name HN   )  6.8119  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43    and name N   )
       ( resid 43    and name HN   )  16.8713  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44    and name N   )
       ( resid 44    and name HN   )  14.4802  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45    and name N   )
       ( resid 45    and name HN   )  19.385  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 46    and name N   )
       ( resid 46    and name HN   )  2.375  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47    and name N   )
       ( resid 47    and name HN   )  13.595  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48    and name N   )
       ( resid 48    and name HN   )  9.7368  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 49    and name N   )
       ( resid 49    and name HN   )  -16.2621  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51    and name N   )
       ( resid 51    and name HN   )  11.8612  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54    and name N   )
       ( resid 54    and name HN   )  -8.4349  1.5

#assign ( resid 500  and name OO  )
#       ( resid 500  and name Z   )
#       ( resid 500  and name X   )
#       ( resid 500  and name Y   )
#       ( resid 55    and name N   )
#       ( resid 55    and name HN   )  -14.8925  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56    and name N   )
       ( resid 56    and name HN   )  -23.7639  1.5

#assign ( resid 500  and name OO  )
#       ( resid 500  and name Z   )
#       ( resid 500  and name X   )
#       ( resid 500  and name Y   )
#       ( resid 57    and name N   )
#       ( resid 57    and name HN   )  10.9201  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59    and name N   )
       ( resid 59    and name HN   )  9.6753  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61    and name N   )
       ( resid 61    and name HN   )  12.3705  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 63    and name N   )
       ( resid 63    and name HN   )  8.9377  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64    and name N   )
       ( resid 64    and name HN   )  -6.3884  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 65    and name N   )
       ( resid 65    and name HN   )  -17.0113  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66    and name N   )
       ( resid 66    and name HN   )  -26.8654  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67    and name N   )
       ( resid 67    and name HN   )  13.166  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70    and name N   )
       ( resid 70    and name HN   )  19.9376  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 71    and name N   )
       ( resid 71    and name HN   )  17.0746  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72    and name N   )
       ( resid 72    and name HN   )  18.3394  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73    and name N   )
       ( resid 73    and name HN   )  18.958  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74    and name N   )
       ( resid 74    and name HN   )  22.6443  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75    and name N   )
       ( resid 75    and name HN   )  17.342  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 77    and name N   )
       ( resid 77    and name HN   )  19.865  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 78    and name N   )
       ( resid 78    and name HN   )  18.6673  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79    and name N   )
       ( resid 79    and name HN   )  16.2432  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80    and name N   )
       ( resid 80    and name HN   )  12.8719  1.5



assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 13    and name N   )
       ( resid 13    and name HN   )  8.3567  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 14    and name N   )
       ( resid 14    and name HN   )  19.3588  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15    and name N   )
       ( resid 15    and name HN   )  13.5331  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 16    and name N   )
       ( resid 16    and name HN   )  -11.3856  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 17    and name N   )
       ( resid 17    and name HN   )  12.0833  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18    and name N   )
       ( resid 18    and name HN   )  -9.0613  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 19    and name N   )
       ( resid 19    and name HN   )  -9.5501  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 20    and name N   )
       ( resid 20    and name HN   )  -5.0115  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 21    and name N   )
       ( resid 21    and name HN   )  2.7243  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22    and name N   )
       ( resid 22    and name HN   )  5.5289  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 23    and name N   )
       ( resid 23    and name HN   )  16.7296  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 26    and name N   )
       ( resid 26    and name HN   )  7.4527  1.5

#assign ( resid 500  and name OO  )
#       ( resid 500  and name Z   )
#       ( resid 500  and name X   )
#       ( resid 500  and name Y   )
#       ( resid 27    and name N   )
#       ( resid 27    and name HN   )  18.3676  1.5

#assign ( resid 500  and name OO  )
#       ( resid 500  and name Z   )
#       ( resid 500  and name X   )
#       ( resid 500  and name Y   )
#       ( resid 28    and name N   )
#       ( resid 28    and name HN   )  15.3837  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 29    and name N   )
       ( resid 29    and name HN   )  4.6623  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 30    and name N   )
       ( resid 30    and name HN   )  -9.4354  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 31    and name N   )
       ( resid 31    and name HN   )  -6.881  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 32    and name N   )
       ( resid 32    and name HN   )  -3.787  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 33    and name N   )
       ( resid 33    and name HN   )  -11.4056  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 34    and name N   )
       ( resid 34    and name HN   )  -1.1476  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 35    and name N   )
       ( resid 35    and name HN   )  -0.0888  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 36    and name N   )
       ( resid 36    and name HN   )  9.736  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 38    and name N   )
       ( resid 38    and name HN   )  -8.0524  1.5

#assign ( resid 500  and name OO  )
#       ( resid 500  and name Z   )
#       ( resid 500  and name X   )
#       ( resid 500  and name Y   )
#       ( resid 42    and name N   )
#       ( resid 42    and name HN   )  -1.2241  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 43    and name N   )
       ( resid 43    and name HN   )  9.7357  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 44    and name N   )
       ( resid 44    and name HN   )  -1.8942  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 45    and name N   )
       ( resid 45    and name HN   )  -7.186  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 46    and name N   )
       ( resid 46    and name HN   )  -11.0597  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 47    and name N   )
       ( resid 47    and name HN   )  -10.008  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 48    and name N   )
       ( resid 48    and name HN   )  -3.8172  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 49    and name N   )
       ( resid 49    and name HN   )  -7.3511  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 51    and name N   )
       ( resid 51    and name HN   )  -0.5901  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 53    and name N   )
       ( resid 53    and name HN   )  -5.0533  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 54    and name N   )
       ( resid 54    and name HN   )  9.9081  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 55    and name N   )
       ( resid 55    and name HN   )  0.7433  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 56    and name N   )
       ( resid 56    and name HN   )  -7.2579  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 57    and name N   )
       ( resid 57    and name HN   )  -2.1728  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 58    and name N   )
       ( resid 58    and name HN   )  -1.728  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 59    and name N   )
       ( resid 59    and name HN   )  -12.4656  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 61    and name N   )
       ( resid 61    and name HN   )  19.8864  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 63    and name N   )
       ( resid 63    and name HN   )  16.8894  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 64    and name N   )
       ( resid 64    and name HN   )  6.173  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 65    and name N   )
       ( resid 65    and name HN   )  -7.6953  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 66    and name N   )
       ( resid 66    and name HN   )  -9.9134  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 67    and name N   )
       ( resid 67    and name HN   )  9.6706  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 69    and name N   )
       ( resid 69    and name HN   )  -2.1784  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 70    and name N   )
       ( resid 70    and name HN   )  14.2888  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 71    and name N   )
       ( resid 71    and name HN   )  10.1991  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 72    and name N   )
       ( resid 72    and name HN   )  -3.0781  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 73    and name N   )
       ( resid 73    and name HN   )  1.9769  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 74    and name N   )
       ( resid 74    and name HN   )  14.3848  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 75    and name N   )
       ( resid 75    and name HN   )  4.8643  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 76    and name N   )
       ( resid 76    and name HN   )  5.1496  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 77    and name N   )
       ( resid 77    and name HN   )  12.4568  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 78    and name N   )
       ( resid 78    and name HN   )  13.972  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 79    and name N   )
       ( resid 79    and name HN   )  0.7955  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 80    and name N   )
       ( resid 80    and name HN   )  1.5622  1.5

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 81    and name N   )
       ( resid 81    and name HN   )  9.5784  1.5



assign ( resid    5 and name    HA ) ( resid    5 and name  HG2# )  4.00  2.20  0.00
assign ( resid    5 and name    HN ) ( resid    5 and name  HG2# )  5.75  3.95  0.00
assign ( resid    5 and name  HG2# ) ( resid    6 and name    HN )  5.72  3.92  0.00
assign ( resid    6 and name   HA# ) ( resid    7 and name    HN )  3.64  1.84  0.00
assign ( resid    6 and name   HA# ) ( resid    7 and name  HG2# )  5.79  3.99  0.00
assign ( resid    6 and name   HA# ) ( resid    8 and name    HN )  5.50  3.70  0.00
assign ( resid    7 and name    HA ) ( resid    7 and name  HG2# )  4.46  2.66  0.00
assign ( resid    7 and name    HB ) ( resid    8 and name    HN )  4.69  2.89  0.00
assign ( resid    7 and name    HN ) ( resid    7 and name    HB )  3.87  2.07  0.00
assign ( resid    7 and name    HN ) ( resid    7 and name  HG2# )  4.44  2.64  0.00
assign ( resid    7 and name    HN ) ( resid    8 and name    HN )  4.54  2.74  0.00
assign ( resid    7 and name  HG2# ) ( resid    8 and name    HA )  5.09  3.29  0.00
assign ( resid    7 and name  HG2# ) ( resid    8 and name    HN )  4.85  3.05  0.00
assign ( resid    7 and name  HG2# ) ( resid    8 and name   HB# )  5.36  3.56  0.00
assign ( resid    7 and name  HG2# ) ( resid    9 and name    HN )  5.81  4.01  0.00
assign ( resid    8 and name    HA ) ( resid    9 and name    HN )  3.25  1.45  0.00
assign ( resid    8 and name    HA ) ( resid    9 and name   HB# )  5.31  3.51  0.00
assign ( resid    8 and name    HN ) ( resid    8 and name   HB# )  3.76  1.96  0.00
assign ( resid    8 and name    HN ) ( resid    9 and name    HN )  5.08  3.28  0.00
assign ( resid    8 and name    HN ) ( resid    9 and name   HB# )  5.63  3.83  0.00
assign ( resid    8 and name   HB# ) ( resid    9 and name    HA )  5.31  3.51  0.00
assign ( resid    8 and name   HB# ) ( resid    9 and name   HB# )  5.20  3.40  0.00
assign ( resid    8 and name   HB1 ) ( resid    9 and name    HN )  4.94  3.14  0.00
assign ( resid    8 and name   HB2 ) ( resid    9 and name    HN )  4.94  3.14  0.00
assign ( resid    9 and name    HA ) ( resid   10 and name    HN )  3.56  1.76  0.00
assign ( resid    9 and name    HA ) ( resid   11 and name    HN )  4.91  3.11  0.00
assign ( resid    9 and name    HA ) ( resid   14 and name   HG# )  5.98  4.18  0.00
assign ( resid    9 and name    HN ) ( resid    9 and name   HB# )  3.22  1.42  0.00
assign ( resid    9 and name    HN ) ( resid   10 and name    HN )  4.93  3.13  0.00
assign ( resid    9 and name    HN ) ( resid   11 and name    HN )  6.00  4.20  0.00
assign ( resid    9 and name    HN ) ( resid   14 and name   HG# )  5.38  3.58  0.00
assign ( resid    9 and name   HB# ) ( resid   10 and name    HA )  4.73  2.93  0.00
assign ( resid    9 and name   HB# ) ( resid   10 and name    HN )  4.18  2.38  0.00
assign ( resid    9 and name   HB# ) ( resid   11 and name    HA )  6.00  4.20  0.00
assign ( resid    9 and name   HB# ) ( resid   11 and name    HB )  5.45  3.65  0.00
assign ( resid    9 and name   HB# ) ( resid   11 and name    HN )  3.98  2.18  0.00
assign ( resid    9 and name   HB# ) ( resid   14 and name    HN )  6.00  4.20  0.00
assign ( resid    9 and name   HB# ) ( resid   37 and name   HD1 )  6.00  4.20  0.00
assign ( resid    9 and name   HB# ) ( resid   37 and name   HD2 )  5.42  3.62  0.00
assign ( resid   10 and name    HN ) ( resid   11 and name    HN )  3.97  2.17  0.00
assign ( resid   10 and name    HN ) ( resid   11 and name  HG2# )  5.69  3.89  0.00
assign ( resid   10 and name   HB# ) ( resid   11 and name    HN )  4.08  2.28  0.00
assign ( resid   11 and name    HA ) ( resid   11 and name  HG2# )  3.70  1.90  0.00
assign ( resid   11 and name    HA ) ( resid   12 and name    HN )  3.45  1.65  0.00
assign ( resid   11 and name    HA ) ( resid   12 and name   HB1 )  6.00  4.20  0.00
assign ( resid   11 and name    HA ) ( resid   12 and name   HB2 )  6.00  4.20  0.00
assign ( resid   11 and name    HA ) ( resid   12 and name   HD# )  5.35  3.55  0.00
assign ( resid   11 and name    HA ) ( resid   13 and name    HN )  5.05  3.25  0.00
assign ( resid   11 and name    HA ) ( resid   42 and name  HG1# )  5.35  3.55  0.00
assign ( resid   11 and name    HB ) ( resid   12 and name    HN )  4.11  2.31  0.00
assign ( resid   11 and name    HB ) ( resid   12 and name   HD# )  5.98  4.18  0.00
assign ( resid   11 and name    HB ) ( resid   13 and name    HN )  3.99  2.19  0.00
assign ( resid   11 and name    HB ) ( resid   42 and name  HG1# )  4.93  3.13  0.00
assign ( resid   11 and name    HB ) ( resid   44 and name   HE# )  4.71  2.91  0.00
assign ( resid   11 and name    HN ) ( resid   11 and name    HB )  4.22  2.42  0.00
assign ( resid   11 and name    HN ) ( resid   11 and name  HG2# )  4.09  2.29  0.00
assign ( resid   11 and name    HN ) ( resid   12 and name    HA )  6.00  4.20  0.00
assign ( resid   11 and name    HN ) ( resid   12 and name    HN )  4.32  2.52  0.30
assign ( resid   11 and name    HN ) ( resid   37 and name   HB# )  5.51  3.71  0.00
assign ( resid   11 and name    HN ) ( resid   37 and name   HG# )  5.51  3.71  0.00
assign ( resid   11 and name    HN ) ( resid   42 and name  HG1# )  6.00  4.20  0.00
assign ( resid   11 and name    HN ) ( resid   44 and name   HE# )  6.00  4.20  0.00
assign ( resid   11 and name  HG2# ) ( resid   12 and name    HN )  3.72  1.92  0.00
assign ( resid   11 and name  HG2# ) ( resid   13 and name    HN )  4.62  2.82  0.00
assign ( resid   11 and name  HG2# ) ( resid   13 and name   HD# )  5.13  3.33  0.00
assign ( resid   11 and name  HG2# ) ( resid   37 and name    HA )  3.89  2.09  0.00
assign ( resid   11 and name  HG2# ) ( resid   37 and name   HB# )  4.52  2.72  0.00
assign ( resid   11 and name  HG2# ) ( resid   37 and name   HD2 )  5.00  3.20  0.30
assign ( resid   11 and name  HG2# ) ( resid   37 and name   HG# )  4.97  3.17  0.00
assign ( resid   11 and name  HG2# ) ( resid   38 and name    HN )  4.82  3.02  0.00
assign ( resid   11 and name  HG2# ) ( resid   42 and name    HN )  4.81  3.01  0.30
assign ( resid   11 and name  HG2# ) ( resid   42 and name  HG1# )  3.47  1.67  0.00
assign ( resid   11 and name  HG2# ) ( resid   44 and name   HE# )  4.20  2.40  0.00
assign ( resid   12 and name    HA ) ( resid   12 and name  HD1# )  4.40  2.60  0.00
assign ( resid   12 and name    HA ) ( resid   12 and name  HD2# )  4.40  2.60  0.00
assign ( resid   12 and name    HN ) ( resid   12 and name   HB1 )  4.18  2.38  0.00
assign ( resid   12 and name    HN ) ( resid   12 and name   HB2 )  4.18  2.38  0.00
assign ( resid   12 and name    HN ) ( resid   12 and name   HD# )  4.15  2.35  0.00
assign ( resid   12 and name    HN ) ( resid   13 and name    HN )  4.05  2.25  0.00
assign ( resid   12 and name    HN ) ( resid   13 and name   HD# )  5.00  3.20  0.00
assign ( resid   12 and name    HN ) ( resid   44 and name   HE# )  5.71  3.91  0.00
assign ( resid   12 and name   HB# ) ( resid   13 and name   HB# )  5.70  3.90  0.00
assign ( resid   12 and name   HB1 ) ( resid   13 and name    HN )  5.21  3.41  0.00
assign ( resid   12 and name   HB2 ) ( resid   13 and name    HN )  5.21  3.41  0.00
assign ( resid   12 and name   HD# ) ( resid   13 and name    HN )  4.71  2.91  0.00
assign ( resid   12 and name   HD# ) ( resid   13 and name   HD# )  5.06  3.26  0.00
assign ( resid   12 and name   HD# ) ( resid   13 and name   HE# )  5.39  3.59  0.00
assign ( resid   12 and name  HD1# ) ( resid   13 and name    HN )  5.83  4.03  0.00
assign ( resid   12 and name  HD2# ) ( resid   13 and name    HN )  5.83  4.03  0.00
assign ( resid   13 and name    HA ) ( resid   13 and name   HD# )  4.63  2.83  0.00
assign ( resid   13 and name    HA ) ( resid   14 and name    HN )  3.56  1.76  0.00
assign ( resid   13 and name    HA ) ( resid   14 and name  HG1# )  5.33  3.53  0.30
assign ( resid   13 and name    HA ) ( resid   14 and name  HG2# )  5.33  3.53  0.00
assign ( resid   13 and name    HN ) ( resid   13 and name   HB1 )  4.40  2.60  0.00
assign ( resid   13 and name    HN ) ( resid   13 and name   HB2 )  4.40  2.60  0.00
assign ( resid   13 and name    HN ) ( resid   13 and name   HD# )  4.24  2.44  0.00
assign ( resid   13 and name    HN ) ( resid   14 and name    HN )  5.02  3.22  0.00
assign ( resid   13 and name    HN ) ( resid   14 and name   HG# )  5.19  3.39  0.00
assign ( resid   13 and name    HN ) ( resid   32 and name   HG# )  5.98  4.18  0.00
assign ( resid   13 and name    HN ) ( resid   35 and name  HG2# )  5.12  3.32  0.30
assign ( resid   13 and name    HN ) ( resid   44 and name   HE# )  4.20  2.40  0.00
assign ( resid   13 and name   HB# ) ( resid   14 and name    HA )  4.97  3.17  0.00
assign ( resid   13 and name   HB# ) ( resid   14 and name    HN )  4.26  2.46  0.00
assign ( resid   13 and name   HB# ) ( resid   14 and name   HG# )  5.81  4.01  0.00
assign ( resid   13 and name   HB# ) ( resid   35 and name  HG2# )  4.42  2.62  0.00
assign ( resid   13 and name   HB# ) ( resid   44 and name   HD# )  4.48  2.68  0.00
assign ( resid   13 and name   HB1 ) ( resid   44 and name   HE# )  5.06  3.26  0.00
assign ( resid   13 and name   HB2 ) ( resid   44 and name   HE# )  5.06  3.26  0.00
assign ( resid   13 and name   HD# ) ( resid   14 and name    HN )  4.90  3.10  0.00
assign ( resid   13 and name   HD# ) ( resid   14 and name  HG2# )  6.00  4.20  0.00
assign ( resid   13 and name   HD# ) ( resid   19 and name   HG# )  4.36  2.56  0.00
assign ( resid   13 and name   HD# ) ( resid   32 and name    HB )  5.14  3.34  0.30
assign ( resid   13 and name   HD# ) ( resid   32 and name  HG1# )  4.85  3.05  0.00
assign ( resid   13 and name   HD# ) ( resid   32 and name  HG2# )  4.85  3.05  0.00
assign ( resid   13 and name   HD# ) ( resid   61 and name    HA )  5.84  4.04  0.00
assign ( resid   13 and name   HD# ) ( resid   64 and name  HG1# )  5.21  3.41  0.00
assign ( resid   13 and name   HD# ) ( resid   64 and name  HG2# )  5.21  3.41  0.00
assign ( resid   13 and name   HE# ) ( resid   32 and name   HG# )  4.64  2.84  0.00
assign ( resid   13 and name   HE# ) ( resid   64 and name    HA )  6.00  4.20  0.00
assign ( resid   13 and name   HE# ) ( resid   64 and name    HB )  5.41  3.61  0.00
assign ( resid   13 and name   HE# ) ( resid   64 and name   HG# )  4.00  2.20  0.00
assign ( resid   13 and name   HE# ) ( resid   64 and name  HG1# )  4.68  2.88  0.00
assign ( resid   13 and name   HE# ) ( resid   64 and name  HG2# )  4.68  2.88  0.00
assign ( resid   13 and name   HE# ) ( resid   65 and name    HN )  6.00  4.20  0.00
assign ( resid   13 and name   HE# ) ( resid   66 and name    HA )  4.95  3.15  0.00
assign ( resid   14 and name    HA ) ( resid   14 and name  HG1# )  4.27  2.47  0.00
assign ( resid   14 and name    HA ) ( resid   14 and name  HG2# )  4.27  2.47  0.00
assign ( resid   14 and name    HA ) ( resid   15 and name    HN )  3.31  1.51  0.00
assign ( resid   14 and name    HA ) ( resid   35 and name  HG2# )  5.00  3.20  0.00
assign ( resid   14 and name    HB ) ( resid   15 and name    HN )  3.30  1.50  0.60
assign ( resid   14 and name    HB ) ( resid   17 and name    HN )  3.94  2.14  0.80
assign ( resid   14 and name    HN ) ( resid   14 and name    HB )  4.29  2.49  0.00
assign ( resid   14 and name    HN ) ( resid   14 and name  HG1# )  4.35  2.55  0.00
assign ( resid   14 and name    HN ) ( resid   14 and name  HG2# )  4.35  2.55  0.00
assign ( resid   14 and name    HN ) ( resid   15 and name    HN )  4.59  2.79  0.00
assign ( resid   14 and name    HN ) ( resid   17 and name   HG# )  4.39  2.59  0.00
assign ( resid   14 and name    HN ) ( resid   19 and name   HG# )  5.26  3.46  0.00
assign ( resid   14 and name    HN ) ( resid   32 and name    HB )  4.57  2.77  0.30
assign ( resid   14 and name    HN ) ( resid   32 and name  HG1# )  5.10  3.30  0.00
assign ( resid   14 and name    HN ) ( resid   32 and name  HG2# )  5.10  3.30  0.00
assign ( resid   14 and name    HN ) ( resid   35 and name    HB )  5.16  3.36  0.50
assign ( resid   14 and name    HN ) ( resid   35 and name  HG2# )  5.64  3.84  0.00
assign ( resid   14 and name   HG# ) ( resid   15 and name    HN )  3.42  1.62  0.00
assign ( resid   14 and name   HG# ) ( resid   15 and name   HB# )  5.98  4.18  0.00
assign ( resid   14 and name   HG# ) ( resid   16 and name   HA1 )  5.98  4.18  0.00
assign ( resid   14 and name   HG# ) ( resid   17 and name    HA )  4.96  3.16  0.30
assign ( resid   14 and name   HG# ) ( resid   17 and name    HN )  3.88  2.08  0.30
assign ( resid   15 and name    HA ) ( resid   16 and name    HN )  3.56  1.76  0.00
assign ( resid   15 and name    HA ) ( resid   16 and name   HA1 )  5.90  4.10  0.00
assign ( resid   15 and name    HA ) ( resid   32 and name   HG# )  4.32  2.52  0.00
assign ( resid   15 and name    HA ) ( resid   34 and name    HN )  5.20  3.40  0.00
assign ( resid   15 and name    HN ) ( resid   15 and name   HB# )  3.39  1.59  0.00
assign ( resid   15 and name    HN ) ( resid   16 and name    HN )  4.80  3.00  0.00
assign ( resid   15 and name    HN ) ( resid   35 and name    HN )  5.79  3.99  0.00
assign ( resid   15 and name    HN ) ( resid   35 and name  HG2# )  4.50  2.70  0.00
assign ( resid   15 and name   HB# ) ( resid   16 and name    HN )  4.21  2.41  0.00
assign ( resid   15 and name   HB# ) ( resid   16 and name   HA1 )  5.63  3.83  0.00
assign ( resid   15 and name   HB# ) ( resid   16 and name   HA2 )  5.73  3.93  0.00
assign ( resid   15 and name   HB# ) ( resid   32 and name   HG# )  5.98  4.18  0.00
assign ( resid   15 and name   HB# ) ( resid   35 and name    HN )  5.63  3.83  0.00
assign ( resid   16 and name    HN ) ( resid   17 and name    HN )  3.91  2.11  0.00
assign ( resid   16 and name    HN ) ( resid   31 and name   HD# )  5.37  3.57  0.00
assign ( resid   16 and name    HN ) ( resid   31 and name   HE# )  6.00  4.20  0.00
assign ( resid   16 and name    HN ) ( resid   32 and name    HA )  5.47  3.67  0.00
assign ( resid   16 and name    HN ) ( resid   32 and name    HB )  4.31  2.51  0.00
assign ( resid   16 and name    HN ) ( resid   32 and name    HN )  5.12  3.32  0.00
assign ( resid   16 and name    HN ) ( resid   32 and name  HG1# )  5.17  3.37  0.00
assign ( resid   16 and name    HN ) ( resid   32 and name  HG2# )  5.17  3.37  0.00
assign ( resid   16 and name    HN ) ( resid   33 and name    HA )  5.02  3.22  0.00
assign ( resid   16 and name    HN ) ( resid   33 and name    HN )  5.71  3.91  0.00
assign ( resid   16 and name    HN ) ( resid   33 and name   HB# )  5.23  3.43  0.30
assign ( resid   16 and name    HN ) ( resid   33 and name   HD# )  5.53  3.73  0.00
assign ( resid   16 and name    HN ) ( resid   34 and name    HA )  6.00  4.20  0.00
assign ( resid   16 and name    HN ) ( resid   34 and name    HN )  5.32  3.52  0.00
assign ( resid   16 and name   HA1 ) ( resid   31 and name   HD# )  4.95  3.15  0.50
assign ( resid   16 and name   HA1 ) ( resid   31 and name   HE# )  4.09  2.29  1.30
assign ( resid   16 and name   HA1 ) ( resid   31 and name   HG# )  5.03  3.23  0.00
assign ( resid   16 and name   HA1 ) ( resid   33 and name   HD# )  5.24  3.44  0.76
assign ( resid   16 and name   HA2 ) ( resid   31 and name   HE# )  5.49  3.69  0.00
assign ( resid   16 and name   HA2 ) ( resid   31 and name   HG# )  6.00  4.20  0.00
assign ( resid   17 and name    HA ) ( resid   18 and name    HN )  3.38  1.58  0.00
assign ( resid   17 and name    HA ) ( resid   18 and name   HB# )  5.29  3.49  0.00
assign ( resid   17 and name    HA ) ( resid   19 and name   HG# )  5.70  3.90  0.00
assign ( resid   17 and name    HA ) ( resid   32 and name    HN )  6.00  4.20  0.00
assign ( resid   17 and name    HN ) ( resid   18 and name    HN )  4.75  2.95  0.00
assign ( resid   17 and name    HN ) ( resid   31 and name   HG# )  6.00  4.20  0.00
assign ( resid   17 and name    HN ) ( resid   32 and name    HB )  3.81  2.01  0.00
assign ( resid   17 and name    HN ) ( resid   32 and name   HG# )  4.87  3.07  0.00
assign ( resid   17 and name   HG# ) ( resid   18 and name    HN )  3.75  1.95  0.00
assign ( resid   17 and name   HG# ) ( resid   19 and name    HN )  5.61  3.81  0.00
assign ( resid   17 and name   HG# ) ( resid   19 and name  HG1# )  5.09  3.29  0.00
assign ( resid   17 and name   HG# ) ( resid   19 and name  HG2# )  5.09  3.29  0.00
assign ( resid   17 and name   HG# ) ( resid   32 and name    HN )  4.84  3.04  0.30
assign ( resid   18 and name    HA ) ( resid   19 and name    HN )  3.62  1.82  0.00
assign ( resid   18 and name    HA ) ( resid   19 and name   HG# )  4.82  3.02  0.00
assign ( resid   18 and name    HA ) ( resid   31 and name    HA )  4.12  2.32  0.00
assign ( resid   18 and name    HA ) ( resid   31 and name    HN )  5.96  4.16  0.00
assign ( resid   18 and name    HA ) ( resid   31 and name   HD# )  5.19  3.39  0.00
assign ( resid   18 and name    HA ) ( resid   31 and name   HG# )  5.07  3.27  0.00
assign ( resid   18 and name    HA ) ( resid   32 and name    HN )  4.98  3.18  0.00
assign ( resid   18 and name    HA ) ( resid   67 and name   HD# )  6.00  4.20  0.00
assign ( resid   18 and name    HN ) ( resid   18 and name   HB# )  3.53  1.73  0.00
assign ( resid   18 and name    HN ) ( resid   18 and name   HD# )  5.28  3.48  0.00
assign ( resid   18 and name    HN ) ( resid   18 and name   HG# )  5.12  3.32  0.00
assign ( resid   18 and name    HN ) ( resid   19 and name    HN )  5.29  3.49  0.00
assign ( resid   18 and name    HN ) ( resid   19 and name   HG# )  5.03  3.23  0.00
assign ( resid   18 and name    HN ) ( resid   31 and name    HA )  5.47  3.67  0.00
assign ( resid   18 and name    HN ) ( resid   31 and name   HD# )  5.46  3.66  0.40
assign ( resid   18 and name    HN ) ( resid   31 and name   HG# )  4.79  2.99  0.00
assign ( resid   18 and name   HB# ) ( resid   18 and name   HD# )  4.61  2.81  0.00
assign ( resid   18 and name   HB# ) ( resid   19 and name    HA )  5.59  3.79  0.00
assign ( resid   18 and name   HB# ) ( resid   19 and name    HN )  4.43  2.63  0.00
assign ( resid   18 and name   HB# ) ( resid   19 and name   HG# )  5.05  3.25  0.00
assign ( resid   18 and name   HB# ) ( resid   32 and name    HN )  6.00  4.20  0.00
assign ( resid   18 and name   HB# ) ( resid   67 and name   HE# )  5.37  3.57  0.30
assign ( resid   18 and name   HD# ) ( resid   31 and name   HG# )  5.18  3.38  0.50
assign ( resid   18 and name   HD# ) ( resid   67 and name   HD# )  5.28  3.48  0.00
assign ( resid   18 and name   HD# ) ( resid   67 and name   HE# )  4.86  3.06  0.00
assign ( resid   18 and name   HG# ) ( resid   19 and name    HN )  4.02  2.22  0.00
assign ( resid   18 and name   HG# ) ( resid   19 and name   HG# )  5.40  3.60  0.00
assign ( resid   18 and name   HG# ) ( resid   29 and name   HG# )  4.74  2.94  0.00
assign ( resid   18 and name   HG# ) ( resid   30 and name    HN )  5.36  3.56  0.00
assign ( resid   18 and name   HG# ) ( resid   67 and name   HB1 )  5.87  4.07  0.00
assign ( resid   18 and name   HG# ) ( resid   67 and name   HD# )  4.36  2.56  0.00
assign ( resid   18 and name   HG# ) ( resid   67 and name   HE# )  4.72  2.92  0.00
assign ( resid   18 and name   HG1 ) ( resid   19 and name    HN )  4.57  2.77  0.00
assign ( resid   18 and name   HG1 ) ( resid   29 and name   HG# )  5.42  3.62  0.00
assign ( resid   18 and name   HG1 ) ( resid   67 and name   HD# )  5.27  3.47  0.00
assign ( resid   18 and name   HG2 ) ( resid   19 and name    HN )  4.57  2.77  0.00
assign ( resid   18 and name   HG2 ) ( resid   29 and name   HG# )  5.42  3.62  0.00
assign ( resid   18 and name   HG2 ) ( resid   67 and name   HD# )  5.27  3.47  0.00
assign ( resid   19 and name    HA ) ( resid   19 and name  HG1# )  4.47  2.67  0.00
assign ( resid   19 and name    HA ) ( resid   19 and name  HG2# )  4.47  2.67  0.00
assign ( resid   19 and name    HA ) ( resid   64 and name   HG# )  5.59  3.79  0.00
assign ( resid   19 and name    HA ) ( resid   67 and name    HN )  4.79  2.99  0.00
assign ( resid   19 and name    HA ) ( resid   67 and name   HB1 )  5.05  3.25  0.00
assign ( resid   19 and name    HA ) ( resid   67 and name   HB2 )  5.90  4.10  0.00
assign ( resid   19 and name    HA ) ( resid   67 and name   HD# )  4.69  2.89  0.00
assign ( resid   19 and name    HB ) ( resid   20 and name    HN )  3.77  1.97  0.00
assign ( resid   19 and name    HB ) ( resid   46 and name  HD1# )  5.03  3.23  0.00
assign ( resid   19 and name    HB ) ( resid   64 and name   HG# )  4.22  2.42  0.00
assign ( resid   19 and name    HB ) ( resid   65 and name    HN )  5.43  3.63  0.00
assign ( resid   19 and name    HB ) ( resid   67 and name    HN )  5.64  3.84  0.00
assign ( resid   19 and name    HN ) ( resid   19 and name  HG1# )  4.46  2.66  0.00
assign ( resid   19 and name    HN ) ( resid   19 and name  HG2# )  4.46  2.66  0.00
assign ( resid   19 and name    HN ) ( resid   20 and name    HN )  4.87  3.07  0.00
assign ( resid   19 and name    HN ) ( resid   29 and name   HG# )  6.00  4.20  0.00
assign ( resid   19 and name    HN ) ( resid   30 and name    HN )  4.43  2.63  0.00
assign ( resid   19 and name    HN ) ( resid   31 and name    HA )  4.49  2.69  0.00
assign ( resid   19 and name    HN ) ( resid   31 and name   HB# )  5.05  3.25  0.00
assign ( resid   19 and name    HN ) ( resid   31 and name   HG# )  5.51  3.71  0.00
assign ( resid   19 and name    HN ) ( resid   32 and name    HN )  4.90  3.10  0.00
assign ( resid   19 and name    HN ) ( resid   67 and name   HD# )  5.52  3.72  0.00
assign ( resid   19 and name   HG# ) ( resid   20 and name    HN )  3.75  1.95  0.00
assign ( resid   19 and name   HG# ) ( resid   21 and name    HA )  5.32  3.52  0.00
assign ( resid   19 and name   HG# ) ( resid   21 and name    HN )  5.29  3.49  0.00
assign ( resid   19 and name   HG# ) ( resid   21 and name   HB# )  4.55  2.75  0.00
assign ( resid   19 and name   HG# ) ( resid   30 and name    HN )  4.60  2.80  0.00
assign ( resid   19 and name   HG# ) ( resid   30 and name   HB# )  3.60  1.80  0.00
assign ( resid   19 and name   HG# ) ( resid   31 and name    HA )  4.52  2.72  0.00
assign ( resid   19 and name   HG# ) ( resid   31 and name    HN )  4.27  2.47  0.00
assign ( resid   19 and name   HG# ) ( resid   31 and name   HB# )  5.29  3.49  0.00
assign ( resid   19 and name   HG# ) ( resid   31 and name   HE# )  5.98  4.18  0.00
assign ( resid   19 and name   HG# ) ( resid   31 and name   HG# )  5.29  3.49  0.00
assign ( resid   19 and name   HG# ) ( resid   32 and name    HA )  5.69  3.89  0.00
assign ( resid   19 and name   HG# ) ( resid   32 and name    HB )  4.40  2.60  0.00
assign ( resid   19 and name   HG# ) ( resid   32 and name    HN )  4.55  2.75  0.00
assign ( resid   19 and name   HG# ) ( resid   32 and name   HG# )  3.65  1.85  0.00
assign ( resid   19 and name   HG# ) ( resid   44 and name   HB2 )  5.98  4.18  0.00
assign ( resid   19 and name   HG# ) ( resid   47 and name    HN )  5.82  4.02  0.00
assign ( resid   19 and name   HG# ) ( resid   47 and name   HD2 )  5.98  4.18  0.00
assign ( resid   19 and name   HG# ) ( resid   64 and name    HA )  5.43  3.63  0.00
assign ( resid   19 and name   HG# ) ( resid   64 and name    HB )  5.96  4.16  0.00
assign ( resid   19 and name   HG# ) ( resid   64 and name   HG# )  3.62  1.82  0.00
assign ( resid   19 and name   HG# ) ( resid   65 and name    HN )  5.21  3.41  0.00
assign ( resid   19 and name   HG# ) ( resid   67 and name    HN )  5.98  4.18  0.00
assign ( resid   19 and name   HG# ) ( resid   67 and name   HB1 )  5.36  3.56  0.00
assign ( resid   19 and name  HG1# ) ( resid   20 and name    HN )  4.39  2.59  0.00
assign ( resid   19 and name  HG1# ) ( resid   31 and name   HG# )  6.00  4.20  0.00
assign ( resid   19 and name  HG2# ) ( resid   20 and name    HN )  4.39  2.59  0.00
assign ( resid   19 and name  HG2# ) ( resid   31 and name   HG# )  6.00  4.20  0.00
assign ( resid   20 and name    HA ) ( resid   20 and name   HD# )  3.95  2.15  0.00
assign ( resid   20 and name    HA ) ( resid   21 and name    HN )  3.75  1.95  0.00
assign ( resid   20 and name    HA ) ( resid   27 and name  HG2# )  5.09  3.29  0.00
assign ( resid   20 and name    HA ) ( resid   30 and name    HN )  4.61  2.81  0.00
assign ( resid   20 and name    HG ) ( resid   29 and name   HG# )  5.62  3.82  0.00
assign ( resid   20 and name    HG ) ( resid   67 and name    HN )  5.09  3.29  0.00
assign ( resid   20 and name    HG ) ( resid   67 and name   HD# )  5.90  4.10  0.00
assign ( resid   20 and name    HG ) ( resid   67 and name   HE# )  5.41  3.61  0.00
assign ( resid   20 and name    HN ) ( resid   20 and name   HB# )  4.02  2.22  0.00
assign ( resid   20 and name    HN ) ( resid   21 and name    HN )  5.42  3.62  0.00
assign ( resid   20 and name    HN ) ( resid   27 and name  HG2# )  6.00  4.20  0.00
assign ( resid   20 and name    HN ) ( resid   64 and name   HG# )  4.57  2.77  0.00
assign ( resid   20 and name    HN ) ( resid   65 and name    HG )  5.75  3.95  0.00
assign ( resid   20 and name    HN ) ( resid   65 and name    HN )  4.72  2.92  0.00
assign ( resid   20 and name    HN ) ( resid   65 and name   HB# )  5.16  3.36  0.00
assign ( resid   20 and name   HB# ) ( resid   21 and name    HN )  4.36  2.56  0.00
assign ( resid   20 and name   HB1 ) ( resid   21 and name    HN )  5.13  3.33  0.00
assign ( resid   20 and name   HB2 ) ( resid   21 and name    HN )  5.13  3.33  0.00
assign ( resid   20 and name   HD# ) ( resid   21 and name    HN )  4.26  2.46  0.00
assign ( resid   20 and name   HD# ) ( resid   28 and name    HN )  5.58  3.78  0.00
assign ( resid   20 and name   HD# ) ( resid   29 and name    HA )  3.91  2.11  0.00
assign ( resid   20 and name   HD# ) ( resid   29 and name    HN )  4.75  2.95  0.00
assign ( resid   20 and name   HD# ) ( resid   29 and name   HG# )  4.05  2.25  0.00
assign ( resid   20 and name   HD# ) ( resid   30 and name    HN )  4.35  2.55  0.00
assign ( resid   20 and name   HD# ) ( resid   66 and name    HA )  5.98  4.18  0.00
assign ( resid   20 and name   HD# ) ( resid   67 and name    HA )  4.31  2.51  0.00
assign ( resid   20 and name   HD# ) ( resid   67 and name    HN )  4.66  2.86  0.40
assign ( resid   20 and name   HD# ) ( resid   67 and name   HD# )  3.80  2.00  0.00
assign ( resid   20 and name   HD# ) ( resid   67 and name   HE# )  3.56  1.76  0.00
assign ( resid   20 and name   HD# ) ( resid   68 and name    HN )  3.94  2.14  0.00
assign ( resid   20 and name   HD# ) ( resid   71 and name    HN )  5.75  3.95  0.00
assign ( resid   20 and name   HD# ) ( resid   71 and name   HB# )  3.76  1.96  0.00
assign ( resid   20 and name   HD# ) ( resid   72 and name    HN )  4.62  2.82  0.00
assign ( resid   20 and name   HD# ) ( resid   75 and name    HN )  4.97  3.17  0.00
assign ( resid   20 and name   HD# ) ( resid   75 and name   HD# )  3.97  2.17  0.00
assign ( resid   20 and name   HD# ) ( resid   75 and name   HG# )  5.85  4.05  0.00
assign ( resid   20 and name  HD1# ) ( resid   21 and name    HN )  5.64  3.84  0.00
assign ( resid   20 and name  HD1# ) ( resid   67 and name    HN )  5.90  4.10  0.00
assign ( resid   20 and name  HD1# ) ( resid   67 and name   HD# )  4.72  2.92  0.00
assign ( resid   20 and name  HD1# ) ( resid   72 and name    HA )  4.64  2.84  0.00
assign ( resid   20 and name  HD1# ) ( resid   75 and name    HN )  6.00  4.20  0.00
assign ( resid   20 and name  HD2# ) ( resid   21 and name    HN )  5.64  3.84  0.00
assign ( resid   20 and name  HD2# ) ( resid   67 and name   HD# )  4.72  2.92  0.00
assign ( resid   20 and name  HD2# ) ( resid   72 and name    HA )  4.64  2.84  0.00
assign ( resid   21 and name    HA ) ( resid   22 and name    HN )  3.89  2.09  0.00
assign ( resid   21 and name    HA ) ( resid   22 and name   HE# )  5.75  3.95  0.00
assign ( resid   21 and name    HA ) ( resid   46 and name  HG2# )  5.94  4.14  0.00
assign ( resid   21 and name    HA ) ( resid   64 and name    HA )  4.82  3.02  0.00
assign ( resid   21 and name    HA ) ( resid   64 and name   HG# )  4.95  3.15  0.00
assign ( resid   21 and name    HA ) ( resid   64 and name  HG1# )  6.00  4.20  0.00
assign ( resid   21 and name    HA ) ( resid   64 and name  HG2# )  6.00  4.20  0.00
assign ( resid   21 and name    HA ) ( resid   65 and name    HN )  4.72  2.92  0.00
assign ( resid   21 and name    HA ) ( resid   65 and name   HB# )  5.87  4.07  0.00
assign ( resid   21 and name    HA ) ( resid   65 and name   HD# )  5.98  4.18  0.00
assign ( resid   21 and name    HN ) ( resid   21 and name   HB1 )  4.58  2.78  0.00
assign ( resid   21 and name    HN ) ( resid   21 and name   HB2 )  4.58  2.78  0.00
assign ( resid   21 and name    HN ) ( resid   27 and name    HA )  5.90  4.10  0.00
assign ( resid   21 and name    HN ) ( resid   27 and name  HG2# )  4.26  2.46  0.00
assign ( resid   21 and name    HN ) ( resid   28 and name    HA )  5.79  3.99  0.00
assign ( resid   21 and name    HN ) ( resid   28 and name    HN )  4.15  2.35  0.00
assign ( resid   21 and name    HN ) ( resid   28 and name   HB1 )  4.76  2.96  0.60
assign ( resid   21 and name    HN ) ( resid   28 and name   HD# )  5.98  4.18  0.00
assign ( resid   21 and name    HN ) ( resid   29 and name    HA )  4.99  3.19  0.00
assign ( resid   21 and name    HN ) ( resid   29 and name    HN )  5.81  4.01  0.00
assign ( resid   21 and name    HN ) ( resid   30 and name    HN )  4.97  3.17  0.00
assign ( resid   21 and name    HN ) ( resid   30 and name   HB# )  4.68  2.88  0.00
assign ( resid   21 and name    HN ) ( resid   46 and name  HG2# )  5.62  3.82  0.00
assign ( resid   21 and name    HN ) ( resid   64 and name   HG# )  5.98  4.18  0.00
assign ( resid   21 and name   HB# ) ( resid   22 and name    HN )  4.48  2.68  0.00
assign ( resid   21 and name   HB# ) ( resid   28 and name    HN )  5.71  3.91  0.00
assign ( resid   21 and name   HB# ) ( resid   28 and name   HB2 )  5.82  4.02  0.00
assign ( resid   21 and name   HB# ) ( resid   30 and name    HN )  5.38  3.58  0.00
assign ( resid   21 and name   HB# ) ( resid   31 and name    HN )  5.87  4.07  0.00
assign ( resid   21 and name   HB# ) ( resid   46 and name  HD1# )  4.60  2.80  0.50
assign ( resid   21 and name   HB# ) ( resid   48 and name   HE# )  4.87  3.07  0.00
assign ( resid   21 and name   HB1 ) ( resid   22 and name    HN )  5.30  3.50  0.00
assign ( resid   21 and name   HB1 ) ( resid   30 and name   HB# )  4.32  2.52  0.00
assign ( resid   21 and name   HB2 ) ( resid   22 and name    HN )  5.30  3.50  0.00
assign ( resid   21 and name   HB2 ) ( resid   30 and name   HB# )  4.32  2.52  0.00
assign ( resid   22 and name    HA ) ( resid   23 and name    HN )  3.83  2.03  0.00
assign ( resid   22 and name    HA ) ( resid   27 and name    HA )  4.75  2.95  0.00
assign ( resid   22 and name    HA ) ( resid   27 and name    HN )  5.92  4.12  0.00
assign ( resid   22 and name    HA ) ( resid   27 and name  HD1# )  5.88  4.08  0.00
assign ( resid   22 and name    HA ) ( resid   27 and name  HG2# )  5.49  3.69  0.00
assign ( resid   22 and name    HA ) ( resid   28 and name    HN )  4.79  2.99  0.00
assign ( resid   22 and name    HA ) ( resid   28 and name   HE# )  5.14  3.34  0.00
assign ( resid   22 and name    HN ) ( resid   22 and name   HB1 )  4.53  2.73  0.00
assign ( resid   22 and name    HN ) ( resid   22 and name   HB2 )  4.53  2.73  0.00
assign ( resid   22 and name    HN ) ( resid   22 and name   HE# )  4.91  3.11  0.00
assign ( resid   22 and name    HN ) ( resid   28 and name    HN )  5.85  4.05  0.00
assign ( resid   22 and name    HN ) ( resid   28 and name   HD# )  5.06  3.26  0.40
assign ( resid   22 and name    HN ) ( resid   63 and name    HA )  6.00  4.20  0.00
assign ( resid   22 and name    HN ) ( resid   63 and name   HG# )  5.12  3.32  0.00
assign ( resid   22 and name    HN ) ( resid   64 and name    HA )  5.37  3.57  0.00
assign ( resid   22 and name    HN ) ( resid   64 and name   HG# )  5.98  4.18  0.00
assign ( resid   22 and name    HN ) ( resid   65 and name    HN )  5.79  3.99  0.00
assign ( resid   22 and name    HN ) ( resid   65 and name   HD# )  5.98  4.18  0.00
assign ( resid   22 and name   HB# ) ( resid   23 and name    HN )  4.33  2.53  0.00
assign ( resid   22 and name   HB# ) ( resid   27 and name  HD1# )  5.31  3.51  0.00
assign ( resid   22 and name   HB# ) ( resid   27 and name  HG2# )  5.40  3.60  0.00
assign ( resid   22 and name   HB# ) ( resid   28 and name   HD# )  4.10  2.30  0.50
assign ( resid   22 and name   HB# ) ( resid   28 and name   HE# )  4.82  3.02  0.40
assign ( resid   22 and name   HB1 ) ( resid   23 and name    HN )  5.00  3.20  0.00
assign ( resid   22 and name   HB1 ) ( resid   28 and name   HD# )  4.69  2.89  0.40
assign ( resid   22 and name   HB2 ) ( resid   23 and name    HN )  5.00  3.20  0.00
assign ( resid   22 and name   HB2 ) ( resid   28 and name   HD# )  4.69  2.89  0.30
assign ( resid   22 and name   HE# ) ( resid   27 and name  HG2# )  5.95  4.15  0.00
assign ( resid   22 and name   HE# ) ( resid   63 and name    HA )  4.77  2.97  0.00
assign ( resid   22 and name   HE# ) ( resid   63 and name   HG# )  5.71  3.91  0.00
assign ( resid   22 and name   HE# ) ( resid   65 and name   HD# )  5.39  3.59  0.00
assign ( resid   23 and name    HN ) ( resid   26 and name    HN )  5.75  3.95  0.00
assign ( resid   23 and name    HN ) ( resid   27 and name    HA )  4.88  3.08  0.00
assign ( resid   23 and name    HN ) ( resid   27 and name  HG1# )  6.00  4.20  0.00
assign ( resid   23 and name    HN ) ( resid   28 and name    HN )  5.73  3.93  0.00
assign ( resid   23 and name    HN ) ( resid   28 and name   HD# )  4.81  3.01  0.00
assign ( resid   23 and name    HN ) ( resid   28 and name   HE# )  4.88  3.08  0.00
assign ( resid   26 and name    HA ) ( resid   26 and name   HD# )  3.73  1.93  0.00
assign ( resid   26 and name    HA ) ( resid   26 and name  HD1# )  4.70  2.90  0.00
assign ( resid   26 and name    HA ) ( resid   26 and name  HD2# )  4.70  2.90  0.00
assign ( resid   26 and name    HA ) ( resid   27 and name  HD1# )  5.49  3.69  0.00
assign ( resid   26 and name    HA ) ( resid   27 and name  HG2# )  6.00  4.20  0.00
assign ( resid   26 and name    HA ) ( resid   28 and name   HE# )  5.73  3.93  0.00
assign ( resid   26 and name    HA ) ( resid   78 and name   HB1 )  6.00  4.20  0.00
assign ( resid   26 and name    HA ) ( resid   78 and name   HD# )  4.30  2.50  0.00
assign ( resid   26 and name    HA ) ( resid   78 and name  HD1# )  5.02  3.22  0.00
assign ( resid   26 and name    HA ) ( resid   78 and name  HD2# )  5.02  3.22  0.00
assign ( resid   26 and name    HA ) ( resid   79 and name   HB# )  6.00  4.20  0.00
assign ( resid   26 and name    HG ) ( resid   27 and name    HN )  5.88  4.08  0.00
assign ( resid   26 and name    HG ) ( resid   28 and name   HE# )  5.41  3.61  0.00
assign ( resid   26 and name    HG ) ( resid   78 and name   HB2 )  5.68  3.88  0.00
assign ( resid   26 and name    HN ) ( resid   26 and name   HD# )  5.23  3.43  0.00
assign ( resid   26 and name    HN ) ( resid   27 and name    HN )  6.00  4.20  0.00
assign ( resid   26 and name    HN ) ( resid   78 and name   HD# )  4.92  3.12  0.00
assign ( resid   26 and name    HN ) ( resid   78 and name  HD1# )  5.69  3.89  0.00
assign ( resid   26 and name    HN ) ( resid   78 and name  HD2# )  5.69  3.89  0.00
assign ( resid   26 and name   HB# ) ( resid   27 and name    HN )  4.17  2.37  0.00
assign ( resid   26 and name   HB# ) ( resid   27 and name  HD1# )  5.07  3.27  0.90
assign ( resid   26 and name   HB# ) ( resid   28 and name   HD# )  5.10  3.30  0.00
assign ( resid   26 and name   HB# ) ( resid   28 and name   HE# )  4.97  3.17  0.00
assign ( resid   26 and name   HB1 ) ( resid   27 and name    HN )  4.94  3.14  0.00
assign ( resid   26 and name   HB1 ) ( resid   27 and name  HD1# )  5.98  4.18  0.00
assign ( resid   26 and name   HB2 ) ( resid   27 and name    HN )  4.94  3.14  0.00
assign ( resid   26 and name   HD# ) ( resid   27 and name    HA )  5.68  3.88  0.00
assign ( resid   26 and name   HD# ) ( resid   28 and name    HN )  5.63  3.83  0.00
assign ( resid   26 and name   HD# ) ( resid   28 and name   HD# )  4.49  2.69  0.50
assign ( resid   26 and name   HD# ) ( resid   28 and name   HE# )  4.06  2.26  0.00
assign ( resid   26 and name   HD# ) ( resid   78 and name    HN )  5.47  3.67  0.00
assign ( resid   26 and name   HD# ) ( resid   78 and name   HB1 )  4.91  3.11  0.00
assign ( resid   26 and name   HD# ) ( resid   79 and name    HA )  3.82  2.02  0.00
assign ( resid   26 and name   HD# ) ( resid   79 and name    HN )  4.73  2.93  0.00
assign ( resid   26 and name   HD# ) ( resid   79 and name   HB# )  3.60  1.80  0.00
assign ( resid   26 and name   HD# ) ( resid   80 and name    HN )  5.31  3.51  0.00
assign ( resid   26 and name   HD# ) ( resid   81 and name    HN )  5.83  4.03  0.00
assign ( resid   26 and name   HD# ) ( resid   81 and name   HB# )  5.41  3.61  0.00
assign ( resid   26 and name   HD# ) ( resid   82 and name    HA )  5.21  3.41  0.00
assign ( resid   26 and name   HD# ) ( resid   82 and name    HN )  5.92  4.12  0.00
assign ( resid   26 and name   HD# ) ( resid   82 and name   HB# )  4.06  2.26  0.00
assign ( resid   26 and name  HD1# ) ( resid   27 and name    HN )  4.44  2.64  0.00
assign ( resid   26 and name  HD1# ) ( resid   28 and name   HE# )  5.38  3.58  0.00
assign ( resid   26 and name  HD1# ) ( resid   79 and name    HA )  4.82  3.02  0.00
assign ( resid   26 and name  HD1# ) ( resid   79 and name   HB# )  5.25  3.45  0.00
assign ( resid   26 and name  HD1# ) ( resid   82 and name    HA )  6.00  4.20  0.00
assign ( resid   26 and name  HD2# ) ( resid   27 and name    HN )  4.44  2.64  0.00
assign ( resid   26 and name  HD2# ) ( resid   28 and name   HE# )  5.38  3.58  0.00
assign ( resid   26 and name  HD2# ) ( resid   79 and name    HA )  4.82  3.02  0.00
assign ( resid   26 and name  HD2# ) ( resid   79 and name   HB# )  5.25  3.45  0.00
assign ( resid   26 and name  HD2# ) ( resid   82 and name    HA )  6.00  4.20  0.00
assign ( resid   27 and name    HA ) ( resid   27 and name  HD1# )  5.02  3.22  0.00
assign ( resid   27 and name    HA ) ( resid   27 and name  HG2# )  4.62  2.82  0.00
assign ( resid   27 and name    HA ) ( resid   28 and name   HD# )  4.98  3.18  0.00
assign ( resid   27 and name    HB ) ( resid   27 and name  HD1# )  3.52  1.72  0.00
assign ( resid   27 and name    HB ) ( resid   28 and name    HN )  6.00  4.20  0.00
assign ( resid   27 and name    HB ) ( resid   74 and name   HB# )  5.26  3.46  0.00
assign ( resid   27 and name    HB ) ( resid   75 and name    HA )  4.52  2.72  0.00
assign ( resid   27 and name    HB ) ( resid   75 and name    HN )  5.04  3.24  0.00
assign ( resid   27 and name    HB ) ( resid   75 and name   HB# )  5.08  3.28  0.00
assign ( resid   27 and name    HB ) ( resid   75 and name   HG# )  5.02  3.22  0.00
assign ( resid   27 and name    HN ) ( resid   27 and name  HD1# )  5.05  3.25  0.00
assign ( resid   27 and name    HN ) ( resid   27 and name  HG1# )  5.46  3.66  0.00
assign ( resid   27 and name    HN ) ( resid   27 and name  HG1# )  5.65  3.85  0.00
assign ( resid   27 and name    HN ) ( resid   28 and name    HN )  5.68  3.88  0.00
assign ( resid   27 and name    HN ) ( resid   28 and name   HE# )  5.79  3.99  0.00
assign ( resid   27 and name    HN ) ( resid   75 and name   HB# )  6.00  4.20  0.00
assign ( resid   27 and name    HN ) ( resid   78 and name   HB1 )  5.63  3.83  0.00
assign ( resid   27 and name    HN ) ( resid   78 and name   HB2 )  5.33  3.53  0.00
assign ( resid   27 and name    HN ) ( resid   78 and name   HD# )  5.00  3.20  0.00
assign ( resid   27 and name    HN ) ( resid   78 and name  HD1# )  6.00  4.20  0.00
assign ( resid   27 and name    HN ) ( resid   78 and name  HD2# )  6.00  4.20  0.00
assign ( resid   27 and name    HN ) ( resid   79 and name   HB# )  6.00  4.20  0.00
assign ( resid   27 and name  HD1# ) ( resid   28 and name    HN )  5.41  3.61  0.00
assign ( resid   27 and name  HD1# ) ( resid   65 and name   HD# )  3.75  1.95  0.00
assign ( resid   27 and name  HD1# ) ( resid   74 and name    HN )  6.00  4.20  0.00
assign ( resid   27 and name  HD1# ) ( resid   74 and name   HB# )  5.25  3.45  0.00
assign ( resid   27 and name  HD1# ) ( resid   74 and name   HD# )  5.16  3.36  0.00
assign ( resid   27 and name  HD1# ) ( resid   74 and name   HG# )  4.97  3.17  0.00
assign ( resid   27 and name  HD1# ) ( resid   75 and name    HA )  4.37  2.57  0.00
assign ( resid   27 and name  HD1# ) ( resid   75 and name    HN )  4.66  2.86  0.00
assign ( resid   27 and name  HD1# ) ( resid   75 and name   HG# )  6.00  4.20  0.00
assign ( resid   27 and name  HD1# ) ( resid   78 and name    HG )  5.70  3.90  0.00
assign ( resid   27 and name  HD1# ) ( resid   78 and name   HB1 )  4.19  2.39  1.00
assign ( resid   27 and name  HD1# ) ( resid   78 and name   HD# )  3.94  2.14  0.00
assign ( resid   27 and name  HG1# ) ( resid   28 and name    HN )  5.24  3.44  0.00
assign ( resid   27 and name  HG1# ) ( resid   28 and name    HN )  5.62  3.82  0.00
assign ( resid   27 and name  HG1# ) ( resid   65 and name   HD# )  5.08  3.28  0.00
assign ( resid   27 and name  HG1# ) ( resid   75 and name   HB# )  6.00  4.20  0.00
assign ( resid   27 and name  HG1# ) ( resid   78 and name   HD# )  4.93  3.13  0.00
assign ( resid   27 and name  HG2# ) ( resid   27 and name  HG1# )  4.65  2.85  0.00
assign ( resid   27 and name  HG2# ) ( resid   28 and name    HA )  5.30  3.50  0.00
assign ( resid   27 and name  HG2# ) ( resid   28 and name    HN )  4.28  2.48  0.00
assign ( resid   27 and name  HG2# ) ( resid   28 and name   HB2 )  6.00  4.20  0.00
assign ( resid   27 and name  HG2# ) ( resid   65 and name    HG )  6.00  4.20  0.00
assign ( resid   27 and name  HG2# ) ( resid   65 and name   HB# )  5.43  3.63  0.00
assign ( resid   27 and name  HG2# ) ( resid   65 and name   HD# )  3.65  1.85  0.00
assign ( resid   27 and name  HG2# ) ( resid   74 and name   HB# )  5.26  3.46  0.00
assign ( resid   27 and name  HG2# ) ( resid   75 and name   HB# )  4.03  2.23  0.00
assign ( resid   27 and name  HG2# ) ( resid   75 and name   HD# )  4.61  2.81  0.00
assign ( resid   27 and name  HG2# ) ( resid   75 and name   HG# )  5.30  3.50  0.00
assign ( resid   28 and name    HA ) ( resid   28 and name   HD# )  3.96  2.16  0.00
assign ( resid   28 and name    HA ) ( resid   29 and name    HN )  3.76  1.96  0.00
assign ( resid   28 and name    HN ) ( resid   28 and name   HD# )  4.83  3.03  0.00
assign ( resid   28 and name    HN ) ( resid   28 and name   HE# )  5.07  3.27  0.00
assign ( resid   28 and name    HN ) ( resid   48 and name   HE# )  6.00  4.20  0.00
assign ( resid   28 and name   HB1 ) ( resid   29 and name    HA )  5.74  3.94  0.00
assign ( resid   28 and name   HB1 ) ( resid   48 and name   HD# )  4.70  2.90  0.00
assign ( resid   28 and name   HB1 ) ( resid   48 and name   HE# )  4.12  2.32  0.00
assign ( resid   28 and name   HB2 ) ( resid   29 and name    HN )  4.30  2.50  0.00
assign ( resid   28 and name   HB2 ) ( resid   48 and name   HD# )  5.16  3.36  0.00
assign ( resid   28 and name   HB2 ) ( resid   48 and name   HE# )  5.08  3.28  0.00
assign ( resid   28 and name   HD# ) ( resid   29 and name    HN )  5.02  3.22  0.00
assign ( resid   28 and name   HD# ) ( resid   48 and name   HE# )  4.81  3.01  0.00
assign ( resid   29 and name    HA ) ( resid   29 and name   HG# )  4.68  2.88  0.00
assign ( resid   29 and name    HA ) ( resid   30 and name    HN )  3.63  1.83  0.00
assign ( resid   29 and name    HA ) ( resid   49 and name   HB# )  5.49  3.69  0.20
assign ( resid   29 and name    HA ) ( resid   67 and name   HE# )  4.87  3.07  1.13
assign ( resid   29 and name    HN ) ( resid   29 and name   HG# )  4.49  2.69  0.00
assign ( resid   29 and name    HN ) ( resid   30 and name    HN )  5.05  3.25  0.00
assign ( resid   29 and name    HN ) ( resid   30 and name   HB# )  5.88  4.08  0.00
assign ( resid   29 and name    HN ) ( resid   49 and name    HN )  5.85  4.05  0.00
assign ( resid   29 and name    HN ) ( resid   49 and name   HB# )  5.10  3.30  0.30
assign ( resid   29 and name    HN ) ( resid   75 and name   HD# )  6.00  4.20  0.00
assign ( resid   29 and name   HG# ) ( resid   30 and name    HN )  4.40  2.60  0.00
assign ( resid   29 and name   HG# ) ( resid   67 and name   HE# )  3.94  2.14  0.60
assign ( resid   30 and name    HA ) ( resid   48 and name    HA )  4.63  2.83  0.00
assign ( resid   30 and name    HA ) ( resid   49 and name    HN )  3.96  2.16  0.00
assign ( resid   30 and name    HN ) ( resid   30 and name   HB# )  4.06  2.26  0.00
assign ( resid   30 and name    HN ) ( resid   31 and name    HN )  5.41  3.61  0.00
assign ( resid   30 and name    HN ) ( resid   31 and name   HB# )  5.67  3.87  0.00
assign ( resid   30 and name    HN ) ( resid   49 and name    HN )  5.54  3.74  0.30
assign ( resid   30 and name    HN ) ( resid   49 and name   HB# )  5.79  3.99  0.00
assign ( resid   30 and name   HB# ) ( resid   31 and name    HN )  3.69  1.89  0.00
assign ( resid   30 and name   HB# ) ( resid   46 and name  HG2# )  3.71  1.91  0.00
assign ( resid   30 and name   HB# ) ( resid   48 and name    HA )  4.21  2.41  0.00
assign ( resid   30 and name   HB# ) ( resid   48 and name    HN )  5.63  3.83  0.00
assign ( resid   30 and name   HB# ) ( resid   48 and name   HD# )  4.76  2.96  0.00
assign ( resid   30 and name   HB# ) ( resid   48 and name   HE# )  5.65  3.85  0.00
assign ( resid   30 and name   HB# ) ( resid   49 and name    HN )  4.30  2.50  0.50
assign ( resid   31 and name    HA ) ( resid   31 and name   HD# )  4.60  2.80  0.00
assign ( resid   31 and name    HA ) ( resid   31 and name   HE# )  5.41  3.61  0.00
assign ( resid   31 and name    HA ) ( resid   32 and name    HA )  5.93  4.13  0.00
assign ( resid   31 and name    HA ) ( resid   32 and name    HB )  5.58  3.78  0.00
assign ( resid   31 and name    HA ) ( resid   32 and name    HN )  3.61  1.81  0.00
assign ( resid   31 and name    HA ) ( resid   32 and name   HG# )  4.50  2.70  0.00
assign ( resid   31 and name    HA ) ( resid   46 and name  HD1# )  5.54  3.74  0.00
assign ( resid   31 and name    HN ) ( resid   31 and name   HB# )  4.07  2.27  0.00
assign ( resid   31 and name    HN ) ( resid   31 and name   HD# )  5.41  3.61  0.00
assign ( resid   31 and name    HN ) ( resid   31 and name   HE# )  5.32  3.52  0.00
assign ( resid   31 and name    HN ) ( resid   32 and name    HN )  5.26  3.46  0.00
assign ( resid   31 and name    HN ) ( resid   32 and name   HG# )  5.49  3.69  0.00
assign ( resid   31 and name    HN ) ( resid   46 and name    HA )  5.16  3.36  0.00
assign ( resid   31 and name    HN ) ( resid   46 and name  HD1# )  4.90  3.10  0.00
assign ( resid   31 and name    HN ) ( resid   46 and name  HG2# )  4.62  2.82  0.00
assign ( resid   31 and name    HN ) ( resid   47 and name    HN )  4.22  2.42  0.00
assign ( resid   31 and name    HN ) ( resid   48 and name    HA )  6.00  4.20  0.00
assign ( resid   31 and name    HN ) ( resid   49 and name    HN )  5.73  3.93  0.00
assign ( resid   31 and name    HN ) ( resid   49 and name   HB# )  5.91  4.11  0.00
assign ( resid   31 and name   HB# ) ( resid   31 and name   HD# )  4.04  2.24  0.00
assign ( resid   31 and name   HB# ) ( resid   31 and name   HE# )  3.43  1.63  0.00
assign ( resid   31 and name   HB# ) ( resid   32 and name    HA )  6.00  4.20  0.00
assign ( resid   31 and name   HB# ) ( resid   32 and name    HN )  4.99  3.19  0.00
assign ( resid   31 and name   HB# ) ( resid   32 and name   HG# )  5.96  4.16  0.00
assign ( resid   31 and name   HB# ) ( resid   47 and name    HN )  4.93  3.13  0.00
assign ( resid   31 and name   HB# ) ( resid   49 and name   HB# )  4.91  3.11  0.00
assign ( resid   31 and name   HD# ) ( resid   32 and name    HB )  5.51  3.71  0.49
assign ( resid   31 and name   HD# ) ( resid   32 and name    HN )  4.18  2.38  0.40
assign ( resid   31 and name   HE# ) ( resid   32 and name    HA )  5.65  3.85  0.00
assign ( resid   31 and name   HE# ) ( resid   32 and name    HN )  5.36  3.56  0.00
assign ( resid   31 and name   HE# ) ( resid   33 and name    HA )  4.57  2.77  0.00
assign ( resid   31 and name   HE# ) ( resid   33 and name    HN )  5.79  3.99  0.00
assign ( resid   31 and name   HE# ) ( resid   33 and name   HD# )  4.03  2.23  0.00
assign ( resid   31 and name   HE# ) ( resid   33 and name  HD1# )  4.98  3.18  0.00
assign ( resid   31 and name   HE# ) ( resid   33 and name  HD2# )  4.98  3.18  0.00
assign ( resid   31 and name   HE# ) ( resid   47 and name   HD2 )  4.40  2.60  0.60
assign ( resid   31 and name   HG# ) ( resid   31 and name   HE# )  3.91  2.11  0.00
assign ( resid   31 and name   HG# ) ( resid   32 and name    HA )  6.00  4.20  0.00
assign ( resid   31 and name   HG# ) ( resid   32 and name    HN )  5.18  3.38  0.00
assign ( resid   31 and name   HG# ) ( resid   32 and name   HG# )  5.98  4.18  0.00
assign ( resid   31 and name   HG# ) ( resid   47 and name   HD2 )  4.36  2.56  0.80
assign ( resid   32 and name    HA ) ( resid   32 and name  HG1# )  4.58  2.78  0.00
assign ( resid   32 and name    HA ) ( resid   32 and name  HG2# )  4.58  2.78  0.00
assign ( resid   32 and name    HA ) ( resid   33 and name  HD1# )  6.00  4.20  0.00
assign ( resid   32 and name    HA ) ( resid   34 and name    HN )  4.49  2.69  0.00
assign ( resid   32 and name    HA ) ( resid   46 and name    HA )  5.00  3.20  0.00
assign ( resid   32 and name    HA ) ( resid   46 and name  HD1# )  4.27  2.47  0.00
assign ( resid   32 and name    HA ) ( resid   46 and name  HG2# )  5.16  3.36  0.00
assign ( resid   32 and name    HA ) ( resid   47 and name    HN )  5.85  4.05  0.00
assign ( resid   32 and name    HB ) ( resid   33 and name    HN )  5.56  3.76  0.00
assign ( resid   32 and name    HB ) ( resid   34 and name    HN )  5.26  3.46  0.00
assign ( resid   32 and name    HB ) ( resid   46 and name  HD1# )  4.48  2.68  0.40
assign ( resid   32 and name    HN ) ( resid   32 and name    HB )  3.83  2.03  0.00
assign ( resid   32 and name    HN ) ( resid   32 and name   HG# )  3.59  1.79  0.00
assign ( resid   32 and name    HN ) ( resid   32 and name  HG1# )  4.43  2.63  0.00
assign ( resid   32 and name    HN ) ( resid   32 and name  HG2# )  4.43  2.63  0.00
assign ( resid   32 and name    HN ) ( resid   33 and name    HN )  5.80  4.00  0.00
assign ( resid   32 and name    HN ) ( resid   46 and name  HD1# )  5.24  3.44  0.00
assign ( resid   32 and name    HN ) ( resid   64 and name   HG# )  5.93  4.13  0.00
assign ( resid   32 and name   HG# ) ( resid   33 and name    HA )  5.19  3.39  0.00
assign ( resid   32 and name   HG# ) ( resid   33 and name    HN )  4.20  2.40  0.00
assign ( resid   32 and name   HG# ) ( resid   34 and name    HA )  4.65  2.85  0.00
assign ( resid   32 and name   HG# ) ( resid   34 and name    HN )  3.83  2.03  0.00
assign ( resid   32 and name   HG# ) ( resid   34 and name   HB2 )  5.27  3.47  0.00
assign ( resid   32 and name   HG# ) ( resid   35 and name    HN )  5.56  3.76  0.00
assign ( resid   32 and name   HG# ) ( resid   35 and name  HG2# )  3.84  2.04  0.00
assign ( resid   32 and name   HG# ) ( resid   44 and name    HA )  5.14  3.34  0.00
assign ( resid   32 and name   HG# ) ( resid   44 and name   HB1 )  5.81  4.01  0.00
assign ( resid   32 and name   HG# ) ( resid   44 and name   HB2 )  4.03  2.23  0.40
assign ( resid   32 and name   HG# ) ( resid   44 and name   HD# )  3.99  2.19  0.00
assign ( resid   32 and name   HG# ) ( resid   44 and name   HE# )  5.05  3.25  0.00
assign ( resid   32 and name   HG# ) ( resid   45 and name    HN )  4.80  3.00  0.00
assign ( resid   32 and name   HG# ) ( resid   46 and name  HD1# )  3.30  1.50  0.00
assign ( resid   32 and name   HG# ) ( resid   46 and name  HG1# )  5.56  3.76  0.00
assign ( resid   32 and name   HG# ) ( resid   46 and name  HG2# )  4.75  2.95  0.00
assign ( resid   32 and name   HG# ) ( resid   64 and name    HB )  5.98  4.18  0.00
assign ( resid   32 and name   HG# ) ( resid   64 and name   HG# )  4.96  3.16  0.00
assign ( resid   32 and name  HG1# ) ( resid   33 and name    HN )  4.94  3.14  0.00
assign ( resid   32 and name  HG1# ) ( resid   35 and name  HG2# )  4.86  3.06  0.00
assign ( resid   32 and name  HG1# ) ( resid   44 and name   HB2 )  4.65  2.85  0.00
assign ( resid   32 and name  HG1# ) ( resid   46 and name  HD1# )  3.87  2.07  0.00
assign ( resid   32 and name  HG2# ) ( resid   33 and name    HN )  4.94  3.14  0.00
assign ( resid   32 and name  HG2# ) ( resid   35 and name  HG2# )  4.86  3.06  0.50
assign ( resid   32 and name  HG2# ) ( resid   44 and name   HB2 )  4.65  2.85  0.30
assign ( resid   32 and name  HG2# ) ( resid   46 and name  HD1# )  3.87  2.07  0.00
assign ( resid   33 and name    HA ) ( resid   33 and name   HD# )  3.98  2.18  0.00
assign ( resid   33 and name    HA ) ( resid   33 and name  HD1# )  5.60  3.80  0.00
assign ( resid   33 and name    HA ) ( resid   33 and name  HD2# )  5.60  3.80  0.00
assign ( resid   33 and name    HG ) ( resid   34 and name    HN )  5.05  3.25  0.00
assign ( resid   33 and name    HG ) ( resid   45 and name   HD# )  3.94  2.14  1.00
assign ( resid   33 and name    HN ) ( resid   33 and name    HG )  4.83  3.03  0.00
assign ( resid   33 and name    HN ) ( resid   33 and name   HD# )  4.21  2.41  0.00
assign ( resid   33 and name    HN ) ( resid   33 and name  HD1# )  5.03  3.23  0.00
assign ( resid   33 and name    HN ) ( resid   33 and name  HD2# )  5.03  3.23  0.00
assign ( resid   33 and name    HN ) ( resid   34 and name    HA )  5.93  4.13  0.00
assign ( resid   33 and name    HN ) ( resid   34 and name    HN )  3.69  1.89  0.00
assign ( resid   33 and name    HN ) ( resid   45 and name    HN )  5.47  3.67  0.00
assign ( resid   33 and name    HN ) ( resid   46 and name    HA )  4.91  3.11  0.00
assign ( resid   33 and name    HN ) ( resid   46 and name  HD1# )  5.00  3.20  0.00
assign ( resid   33 and name    HN ) ( resid   47 and name    HN )  5.41  3.61  0.00
assign ( resid   33 and name   HB# ) ( resid   33 and name   HD# )  3.12  1.32  0.00
assign ( resid   33 and name   HB# ) ( resid   34 and name    HN )  4.47  2.67  0.00
assign ( resid   33 and name   HB# ) ( resid   45 and name   HD# )  3.82  2.02  0.00
assign ( resid   33 and name   HD# ) ( resid   34 and name    HN )  4.48  2.68  0.00
assign ( resid   33 and name   HD# ) ( resid   34 and name   HB1 )  4.24  2.44  0.00
assign ( resid   33 and name   HD# ) ( resid   34 and name   HE# )  4.37  2.57  0.00
assign ( resid   33 and name   HD# ) ( resid   45 and name   HD# )  3.83  2.03  0.00
assign ( resid   33 and name   HD# ) ( resid   45 and name   HE# )  3.77  1.97  0.00
assign ( resid   33 and name   HD# ) ( resid   47 and name   HD2 )  5.80  4.00  0.00
assign ( resid   33 and name  HD1# ) ( resid   34 and name    HN )  5.21  3.41  0.00
assign ( resid   33 and name  HD1# ) ( resid   34 and name   HB1 )  5.07  3.27  0.30
assign ( resid   33 and name  HD1# ) ( resid   34 and name   HE# )  5.59  3.79  0.41
assign ( resid   33 and name  HD1# ) ( resid   45 and name   HD# )  4.66  2.86  0.50
assign ( resid   33 and name  HD1# ) ( resid   45 and name   HE# )  4.58  2.78  0.60
assign ( resid   33 and name  HD2# ) ( resid   34 and name    HN )  5.21  3.41  0.00
assign ( resid   33 and name  HD2# ) ( resid   34 and name   HB1 )  5.07  3.27  0.50
assign ( resid   33 and name  HD2# ) ( resid   34 and name   HE# )  5.59  3.79  0.00
assign ( resid   33 and name  HD2# ) ( resid   45 and name   HD# )  4.66  2.86  0.00
assign ( resid   33 and name  HD2# ) ( resid   45 and name   HE# )  4.58  2.78  0.00
assign ( resid   34 and name    HA ) ( resid   34 and name   HD# )  4.54  2.74  0.00
assign ( resid   34 and name    HA ) ( resid   34 and name   HD1 )  5.21  3.41  0.00
assign ( resid   34 and name    HA ) ( resid   34 and name   HD2 )  5.21  3.41  0.00
assign ( resid   34 and name    HA ) ( resid   35 and name    HN )  3.35  1.55  0.00
assign ( resid   34 and name    HA ) ( resid   35 and name  HG2# )  4.48  2.68  0.00
assign ( resid   34 and name    HN ) ( resid   34 and name   HB1 )  4.28  2.48  0.00
assign ( resid   34 and name    HN ) ( resid   34 and name   HB2 )  4.36  2.56  0.00
assign ( resid   34 and name    HN ) ( resid   34 and name   HE# )  6.00  4.20  0.00
assign ( resid   34 and name    HN ) ( resid   35 and name    HN )  4.88  3.08  0.00
assign ( resid   34 and name    HN ) ( resid   35 and name  HG2# )  5.24  3.44  0.00
assign ( resid   34 and name    HN ) ( resid   45 and name    HN )  4.18  2.38  0.00
assign ( resid   34 and name    HN ) ( resid   45 and name   HB# )  3.80  2.00  0.00
assign ( resid   34 and name    HN ) ( resid   45 and name   HB1 )  4.43  2.63  0.00
assign ( resid   34 and name    HN ) ( resid   45 and name   HB2 )  4.43  2.63  0.00
assign ( resid   34 and name    HN ) ( resid   45 and name   HD# )  5.20  3.40  0.00
assign ( resid   34 and name    HN ) ( resid   46 and name  HD1# )  5.56  3.76  0.00
assign ( resid   34 and name   HB1 ) ( resid   35 and name    HN )  4.88  3.08  0.00
assign ( resid   34 and name   HB1 ) ( resid   45 and name   HB# )  5.04  3.24  0.00
assign ( resid   34 and name   HB2 ) ( resid   34 and name   HE# )  3.55  1.75  1.00
assign ( resid   34 and name   HB2 ) ( resid   45 and name    HN )  4.90  3.10  1.00
assign ( resid   34 and name   HB2 ) ( resid   45 and name   HB# )  5.24  3.44  0.00
assign ( resid   34 and name   HD# ) ( resid   35 and name    HN )  4.69  2.89  0.00
assign ( resid   34 and name   HD# ) ( resid   45 and name   HD# )  5.29  3.49  0.00
assign ( resid   34 and name   HD# ) ( resid   58 and name   HZ2 )  5.31  3.51  0.00
assign ( resid   34 and name   HD1 ) ( resid   45 and name   HD# )  6.00  4.20  0.00
assign ( resid   34 and name   HD1 ) ( resid   58 and name   HZ2 )  6.00  4.20  0.00
assign ( resid   34 and name   HD2 ) ( resid   45 and name   HD# )  6.00  4.20  0.00
assign ( resid   34 and name   HD2 ) ( resid   58 and name   HZ2 )  6.00  4.20  0.00
assign ( resid   34 and name   HE# ) ( resid   35 and name    HN )  6.00  4.20  0.00
assign ( resid   34 and name   HE# ) ( resid   45 and name   HD# )  4.88  3.08  0.00
assign ( resid   34 and name   HE# ) ( resid   45 and name   HE# )  5.14  3.34  0.00
assign ( resid   34 and name   HE# ) ( resid   58 and name   HZ2 )  4.76  2.96  0.00
assign ( resid   34 and name   HG# ) ( resid   35 and name    HA )  5.27  3.47  0.00
assign ( resid   34 and name   HG# ) ( resid   35 and name    HN )  3.96  2.16  0.00
assign ( resid   34 and name   HG# ) ( resid   58 and name   HZ2 )  5.63  3.83  0.00
assign ( resid   35 and name    HA ) ( resid   35 and name  HG2# )  3.88  2.08  0.00
assign ( resid   35 and name    HA ) ( resid   36 and name    HN )  3.73  1.93  0.00
assign ( resid   35 and name    HA ) ( resid   42 and name  HG1# )  5.42  3.62  0.00
assign ( resid   35 and name    HA ) ( resid   44 and name   HD# )  4.46  2.66  0.00
assign ( resid   35 and name    HB ) ( resid   36 and name    HN )  4.55  2.75  0.00
assign ( resid   35 and name    HB ) ( resid   42 and name  HG1# )  5.54  3.74  0.40
assign ( resid   35 and name    HN ) ( resid   35 and name    HB )  3.96  2.16  0.00
assign ( resid   35 and name    HN ) ( resid   35 and name  HG2# )  4.10  2.30  0.00
assign ( resid   35 and name    HN ) ( resid   36 and name    HN )  4.94  3.14  0.00
assign ( resid   35 and name    HN ) ( resid   37 and name   HD2 )  5.70  3.90  0.00
assign ( resid   35 and name  HG2# ) ( resid   36 and name    HN )  3.93  2.13  0.00
assign ( resid   35 and name  HG2# ) ( resid   37 and name   HD2 )  5.17  3.37  0.50
assign ( resid   35 and name  HG2# ) ( resid   44 and name    HA )  5.62  3.82  0.40
assign ( resid   35 and name  HG2# ) ( resid   44 and name   HD# )  4.17  2.37  0.40
assign ( resid   35 and name  HG2# ) ( resid   44 and name   HE# )  4.82  3.02  0.00
assign ( resid   35 and name  HG2# ) ( resid   45 and name    HN )  5.52  3.72  0.40
assign ( resid   36 and name    HA ) ( resid   36 and name   HD# )  4.64  2.84  0.00
assign ( resid   36 and name    HA ) ( resid   36 and name   HG2 )  4.53  2.73  0.00
assign ( resid   36 and name    HA ) ( resid   37 and name   HD1 )  4.03  2.23  0.00
assign ( resid   36 and name    HA ) ( resid   37 and name   HD2 )  4.21  2.41  0.00
assign ( resid   36 and name    HA ) ( resid   37 and name   HG# )  4.83  3.03  0.00
assign ( resid   36 and name    HA ) ( resid   38 and name    HN )  4.63  2.83  0.00
assign ( resid   36 and name    HA ) ( resid   38 and name   HB# )  5.14  3.34  0.00
assign ( resid   36 and name    HA ) ( resid   42 and name  HG2# )  4.71  2.91  0.00
assign ( resid   36 and name    HN ) ( resid   36 and name   HB1 )  4.29  2.49  0.00
assign ( resid   36 and name    HN ) ( resid   36 and name   HB2 )  4.24  2.44  0.00
assign ( resid   36 and name    HN ) ( resid   36 and name   HD# )  5.36  3.56  0.00
assign ( resid   36 and name    HN ) ( resid   36 and name   HG2 )  5.72  3.92  0.00
assign ( resid   36 and name    HN ) ( resid   37 and name    HA )  5.57  3.77  0.00
assign ( resid   36 and name    HN ) ( resid   37 and name   HD1 )  5.03  3.23  0.00
assign ( resid   36 and name    HN ) ( resid   37 and name   HD2 )  5.18  3.38  0.00
assign ( resid   36 and name    HN ) ( resid   38 and name    HN )  5.46  3.66  0.00
assign ( resid   36 and name    HN ) ( resid   42 and name  HG1# )  4.64  2.84  0.00
assign ( resid   36 and name    HN ) ( resid   43 and name    HN )  4.72  2.92  1.28
assign ( resid   36 and name    HN ) ( resid   44 and name    HA )  4.55  2.75  0.00
assign ( resid   36 and name    HN ) ( resid   44 and name   HD# )  5.10  3.30  0.00
assign ( resid   36 and name    HN ) ( resid   44 and name   HE# )  5.53  3.73  0.00
assign ( resid   36 and name   HB1 ) ( resid   36 and name   HE# )  5.12  3.32  0.00
assign ( resid   36 and name   HB1 ) ( resid   37 and name   HD2 )  5.73  3.93  0.00
assign ( resid   36 and name   HB1 ) ( resid   43 and name   HG2 )  5.23  3.43  0.00
assign ( resid   36 and name   HB2 ) ( resid   36 and name   HD# )  3.84  2.04  0.00
assign ( resid   36 and name   HB2 ) ( resid   37 and name   HD2 )  5.73  3.93  0.00
assign ( resid   36 and name   HB2 ) ( resid   38 and name    HN )  4.86  3.06  0.40
assign ( resid   36 and name   HB2 ) ( resid   42 and name  HG1# )  4.68  2.88  0.30
assign ( resid   36 and name   HB2 ) ( resid   43 and name    HN )  4.40  2.60  1.60
assign ( resid   36 and name   HB2 ) ( resid   43 and name   HG1 )  4.90  3.10  0.00
assign ( resid   36 and name   HD# ) ( resid   38 and name    HN )  5.90  4.10  0.00
assign ( resid   36 and name   HD# ) ( resid   38 and name   HB# )  5.27  3.47  0.00
assign ( resid   36 and name   HD# ) ( resid   43 and name   HG1 )  5.12  3.32  0.00
assign ( resid   36 and name   HD# ) ( resid   43 and name   HG2 )  4.69  2.89  0.00
assign ( resid   36 and name   HE# ) ( resid   39 and name    HN )  4.65  2.85  0.50
assign ( resid   36 and name   HE# ) ( resid   42 and name  HG2# )  4.28  2.48  0.00
assign ( resid   36 and name   HG1 ) ( resid   36 and name   HE1 )  4.58  2.78  0.00
assign ( resid   36 and name   HG1 ) ( resid   36 and name   HE2 )  4.58  2.78  0.00
assign ( resid   36 and name   HG1 ) ( resid   37 and name   HG# )  5.67  3.87  0.00
assign ( resid   36 and name   HG1 ) ( resid   39 and name    HN )  5.87  4.07  0.00
assign ( resid   36 and name   HG1 ) ( resid   43 and name   HG1 )  5.02  3.22  0.98
assign ( resid   36 and name   HG2 ) ( resid   37 and name   HG# )  6.00  4.20  0.00
assign ( resid   36 and name   HG2 ) ( resid   38 and name    HN )  5.46  3.66  0.00
assign ( resid   37 and name    HA ) ( resid   39 and name    HN )  4.28  2.48  0.00
assign ( resid   37 and name    HA ) ( resid   42 and name  HG1# )  4.07  2.27  0.00
assign ( resid   37 and name    HA ) ( resid   42 and name  HG2# )  3.89  2.09  0.30
assign ( resid   37 and name   HB# ) ( resid   38 and name    HN )  4.63  2.83  0.00
assign ( resid   37 and name   HB# ) ( resid   39 and name    HN )  5.02  3.22  0.00
assign ( resid   37 and name   HB# ) ( resid   42 and name  HG1# )  4.82  3.02  0.00
assign ( resid   37 and name   HD1 ) ( resid   38 and name    HN )  4.08  2.28  1.00
assign ( resid   37 and name   HD1 ) ( resid   38 and name   HB# )  5.35  3.55  0.30
assign ( resid   37 and name   HD1 ) ( resid   42 and name  HG2# )  5.02  3.22  0.80
assign ( resid   37 and name   HD2 ) ( resid   38 and name    HN )  4.46  2.66  0.00
assign ( resid   37 and name   HG# ) ( resid   38 and name    HA )  5.33  3.53  0.00
assign ( resid   37 and name   HG# ) ( resid   38 and name    HN )  4.82  3.02  0.00
assign ( resid   37 and name   HG# ) ( resid   38 and name   HB# )  5.28  3.48  0.00
assign ( resid   38 and name    HA ) ( resid   39 and name    HN )  3.74  1.94  0.00
assign ( resid   38 and name    HA ) ( resid   39 and name   HB# )  5.20  3.40  0.00
assign ( resid   38 and name    HA ) ( resid   42 and name  HG2# )  4.63  2.83  1.00
assign ( resid   38 and name    HN ) ( resid   38 and name   HB# )  3.38  1.58  0.00
assign ( resid   38 and name    HN ) ( resid   39 and name    HA )  5.45  3.65  0.00
assign ( resid   38 and name    HN ) ( resid   39 and name    HN )  3.27  1.47  0.00
assign ( resid   38 and name    HN ) ( resid   39 and name   HB# )  5.09  3.29  0.00
assign ( resid   38 and name    HN ) ( resid   42 and name    HB )  4.61  2.81  0.90
assign ( resid   38 and name    HN ) ( resid   42 and name  HG1# )  5.18  3.38  0.00
assign ( resid   38 and name    HN ) ( resid   42 and name  HG2# )  5.06  3.26  0.00
assign ( resid   38 and name   HB# ) ( resid   39 and name    HA )  5.26  3.46  0.00
assign ( resid   38 and name   HB# ) ( resid   39 and name    HN )  4.22  2.42  0.00
assign ( resid   38 and name   HB# ) ( resid   42 and name  HG1# )  5.56  3.76  0.00
assign ( resid   38 and name   HB# ) ( resid   42 and name  HG2# )  4.50  2.70  0.00
assign ( resid   39 and name    HA ) ( resid   40 and name    HN )  3.55  1.75  0.00
assign ( resid   39 and name    HA ) ( resid   42 and name  HG2# )  4.57  2.77  0.70
assign ( resid   39 and name    HN ) ( resid   39 and name   HB# )  3.03  1.23  0.00
assign ( resid   39 and name    HN ) ( resid   40 and name    HN )  4.53  2.73  0.00
assign ( resid   39 and name    HN ) ( resid   40 and name  HG2# )  4.43  2.63  0.00
assign ( resid   39 and name    HN ) ( resid   42 and name    HB )  5.31  3.51  0.00
assign ( resid   39 and name    HN ) ( resid   42 and name  HG1# )  4.09  2.29  0.00
assign ( resid   39 and name    HN ) ( resid   42 and name  HG2# )  5.15  3.35  0.00
assign ( resid   39 and name   HB# ) ( resid   40 and name    HN )  3.40  1.60  0.00
assign ( resid   39 and name   HB# ) ( resid   42 and name    HA )  4.11  2.31  0.00
assign ( resid   39 and name   HB# ) ( resid   42 and name    HB )  4.27  2.47  0.00
assign ( resid   39 and name   HB# ) ( resid   42 and name    HN )  5.09  3.29  0.30
assign ( resid   39 and name   HB# ) ( resid   43 and name    HN )  4.27  2.47  0.80
assign ( resid   40 and name    HA ) ( resid   40 and name  HG2# )  3.67  1.87  0.00
assign ( resid   40 and name    HA ) ( resid   41 and name   HD1 )  5.62  3.82  0.00
assign ( resid   40 and name    HA ) ( resid   42 and name    HN )  4.27  2.47  0.00
assign ( resid   40 and name    HN ) ( resid   40 and name    HB )  4.49  2.69  0.00
assign ( resid   40 and name    HN ) ( resid   40 and name  HG2# )  4.07  2.27  0.00
assign ( resid   40 and name  HG2# ) ( resid   42 and name    HB )  4.47  2.67  0.50
assign ( resid   41 and name    HA ) ( resid   42 and name    HB )  4.61  2.81  0.00
assign ( resid   41 and name    HA ) ( resid   42 and name    HN )  3.69  1.89  0.00
assign ( resid   41 and name   HD1 ) ( resid   42 and name    HN )  4.35  2.55  1.50
assign ( resid   42 and name    HA ) ( resid   42 and name  HG1# )  4.10  2.30  0.00
assign ( resid   42 and name    HA ) ( resid   42 and name  HG2# )  3.74  1.94  0.00
assign ( resid   42 and name    HA ) ( resid   43 and name    HA )  5.40  3.60  0.00
assign ( resid   42 and name    HA ) ( resid   43 and name    HN )  3.65  1.85  0.00
assign ( resid   42 and name    HB ) ( resid   43 and name    HN )  5.09  3.29  0.00
assign ( resid   42 and name    HB ) ( resid   44 and name   HE# )  5.18  3.38  0.40
assign ( resid   42 and name    HN ) ( resid   42 and name    HB )  3.39  1.59  0.50
assign ( resid   42 and name    HN ) ( resid   42 and name  HG1# )  4.38  2.58  0.00
assign ( resid   42 and name    HN ) ( resid   42 and name  HG2# )  4.42  2.62  0.00
assign ( resid   42 and name    HN ) ( resid   43 and name    HA )  5.70  3.90  0.00
assign ( resid   42 and name    HN ) ( resid   43 and name    HN )  5.09  3.29  0.00
assign ( resid   42 and name    HN ) ( resid   44 and name   HD# )  5.79  3.99  0.00
assign ( resid   42 and name    HN ) ( resid   44 and name   HE# )  4.71  2.91  0.00
assign ( resid   42 and name    HN ) ( resid   61 and name    HN )  4.81  3.01  0.00
assign ( resid   42 and name  HG1# ) ( resid   43 and name    HA )  5.15  3.35  0.00
assign ( resid   42 and name  HG1# ) ( resid   43 and name    HN )  3.84  2.04  0.00
assign ( resid   42 and name  HG1# ) ( resid   43 and name   HG1 )  4.53  2.73  0.30
assign ( resid   42 and name  HG1# ) ( resid   44 and name    HN )  5.68  3.88  0.00
assign ( resid   42 and name  HG1# ) ( resid   44 and name   HE# )  4.28  2.48  0.00
assign ( resid   42 and name  HG1# ) ( resid   61 and name    HN )  5.96  4.16  0.00
assign ( resid   42 and name  HG2# ) ( resid   43 and name    HA )  5.78  3.98  0.00
assign ( resid   42 and name  HG2# ) ( resid   43 and name    HN )  4.91  3.11  0.70
assign ( resid   42 and name  HG2# ) ( resid   43 and name   HB2 )  4.64  2.84  0.00
assign ( resid   42 and name  HG2# ) ( resid   44 and name   HE# )  5.25  3.45  0.00
assign ( resid   43 and name    HA ) ( resid   44 and name    HN )  3.77  1.97  0.00
assign ( resid   43 and name    HA ) ( resid   44 and name   HB1 )  5.28  3.48  0.40
assign ( resid   43 and name    HA ) ( resid   44 and name   HD# )  4.69  2.89  0.00
assign ( resid   43 and name    HA ) ( resid   59 and name    HN )  5.19  3.39  0.00
assign ( resid   43 and name    HA ) ( resid   60 and name    HA )  4.65  2.85  0.00
assign ( resid   43 and name    HA ) ( resid   61 and name    HN )  4.92  3.12  0.00
assign ( resid   43 and name    HN ) ( resid   43 and name   HG1 )  4.77  2.97  0.00
assign ( resid   43 and name    HN ) ( resid   43 and name   HG2 )  5.31  3.51  0.00
assign ( resid   43 and name    HN ) ( resid   44 and name    HA )  6.00  4.20  0.00
assign ( resid   43 and name    HN ) ( resid   44 and name    HN )  5.41  3.61  0.00
assign ( resid   43 and name    HN ) ( resid   44 and name   HD# )  5.13  3.33  0.00
assign ( resid   43 and name    HN ) ( resid   44 and name   HE# )  5.49  3.69  0.00
assign ( resid   43 and name    HN ) ( resid   60 and name    HA )  5.51  3.71  0.00
assign ( resid   43 and name   HB1 ) ( resid   44 and name    HN )  4.77  2.97  0.00
assign ( resid   43 and name   HB1 ) ( resid   58 and name    HA )  6.00  4.20  0.00
assign ( resid   43 and name   HB2 ) ( resid   44 and name    HN )  4.51  2.71  0.00
assign ( resid   43 and name   HB2 ) ( resid   44 and name   HD# )  6.00  4.20  0.00
assign ( resid   43 and name   HG1 ) ( resid   44 and name    HN )  5.56  3.76  0.00
assign ( resid   43 and name   HG2 ) ( resid   44 and name    HN )  4.90  3.10  0.00
assign ( resid   44 and name    HA ) ( resid   44 and name   HD# )  4.38  2.58  0.00
assign ( resid   44 and name    HA ) ( resid   44 and name   HE# )  5.37  3.57  0.00
assign ( resid   44 and name    HA ) ( resid   45 and name   HB# )  5.48  3.68  0.00
assign ( resid   44 and name    HA ) ( resid   46 and name  HD1# )  5.59  3.79  0.00
assign ( resid   44 and name    HN ) ( resid   44 and name   HB1 )  4.47  2.67  0.00
assign ( resid   44 and name    HN ) ( resid   44 and name   HD# )  4.83  3.03  0.00
assign ( resid   44 and name    HN ) ( resid   44 and name   HE# )  5.39  3.59  0.00
assign ( resid   44 and name    HN ) ( resid   45 and name    HN )  5.50  3.70  0.00
assign ( resid   44 and name    HN ) ( resid   46 and name  HD1# )  5.88  4.08  0.00
assign ( resid   44 and name    HN ) ( resid   46 and name  HG1# )  5.45  3.65  0.00
assign ( resid   44 and name    HN ) ( resid   58 and name    HA )  4.95  3.15  0.00
assign ( resid   44 and name    HN ) ( resid   58 and name   HB# )  5.92  4.12  0.00
assign ( resid   44 and name    HN ) ( resid   59 and name    HA )  5.23  3.43  0.00
assign ( resid   44 and name    HN ) ( resid   59 and name    HN )  4.39  2.59  0.00
assign ( resid   44 and name    HN ) ( resid   59 and name  HG2# )  4.70  2.90  0.00
assign ( resid   44 and name    HN ) ( resid   60 and name    HA )  4.81  3.01  0.00
assign ( resid   44 and name    HN ) ( resid   61 and name    HN )  6.00  4.20  0.00
assign ( resid   44 and name    HN ) ( resid   64 and name   HG# )  5.91  4.11  0.00
assign ( resid   44 and name   HB1 ) ( resid   46 and name  HD1# )  4.31  2.51  0.00
assign ( resid   44 and name   HB1 ) ( resid   59 and name  HG2# )  5.49  3.69  0.00
assign ( resid   44 and name   HB1 ) ( resid   64 and name   HG# )  3.98  2.18  0.00
assign ( resid   44 and name   HB1 ) ( resid   64 and name  HG1# )  4.77  2.97  0.00
assign ( resid   44 and name   HB1 ) ( resid   64 and name  HG2# )  4.77  2.97  0.00
assign ( resid   44 and name   HB2 ) ( resid   45 and name    HN )  4.88  3.08  0.00
assign ( resid   44 and name   HB2 ) ( resid   46 and name  HD1# )  4.57  2.77  0.00
assign ( resid   44 and name   HB2 ) ( resid   64 and name   HG# )  4.65  2.85  0.00
assign ( resid   44 and name   HB2 ) ( resid   64 and name  HG1# )  5.78  3.98  0.00
assign ( resid   44 and name   HB2 ) ( resid   64 and name  HG2# )  5.78  3.98  0.00
assign ( resid   44 and name   HD# ) ( resid   46 and name  HD1# )  5.05  3.25  0.00
assign ( resid   44 and name   HD# ) ( resid   59 and name  HG2# )  5.33  3.53  0.00
assign ( resid   44 and name   HD# ) ( resid   60 and name   HB# )  6.00  4.20  0.00
assign ( resid   44 and name   HD# ) ( resid   61 and name    HA )  4.31  2.51  0.00
assign ( resid   44 and name   HD# ) ( resid   61 and name    HN )  5.47  3.67  0.00
assign ( resid   44 and name   HD# ) ( resid   64 and name   HG# )  4.11  2.31  0.00
assign ( resid   44 and name   HD# ) ( resid   64 and name  HG1# )  5.62  3.82  0.00
assign ( resid   44 and name   HD# ) ( resid   64 and name  HG2# )  5.62  3.82  0.00
assign ( resid   44 and name   HE# ) ( resid   61 and name    HA )  4.11  2.31  0.00
assign ( resid   44 and name   HE# ) ( resid   61 and name    HN )  5.32  3.52  0.00
assign ( resid   45 and name    HA ) ( resid   45 and name   HD# )  4.08  2.28  0.00
assign ( resid   45 and name    HA ) ( resid   45 and name   HE# )  5.00  3.20  0.00
assign ( resid   45 and name    HA ) ( resid   58 and name    HA )  5.04  3.24  0.00
assign ( resid   45 and name    HA ) ( resid   58 and name    HN )  5.87  4.07  0.00
assign ( resid   45 and name    HA ) ( resid   59 and name    HN )  5.05  3.25  0.00
assign ( resid   45 and name    HN ) ( resid   45 and name   HB1 )  4.42  2.62  0.00
assign ( resid   45 and name    HN ) ( resid   45 and name   HB2 )  4.42  2.62  0.00
assign ( resid   45 and name    HN ) ( resid   45 and name   HD# )  5.63  3.83  0.00
assign ( resid   45 and name    HN ) ( resid   46 and name    HN )  5.27  3.47  0.00
assign ( resid   45 and name    HN ) ( resid   46 and name  HG1# )  6.00  4.20  0.00
assign ( resid   45 and name    HN ) ( resid   59 and name  HG2# )  5.90  4.10  0.00
assign ( resid   45 and name   HB# ) ( resid   46 and name  HD1# )  5.53  3.73  0.00
assign ( resid   45 and name   HB# ) ( resid   58 and name   HZ2 )  5.67  3.87  0.00
assign ( resid   45 and name   HD# ) ( resid   46 and name    HN )  4.90  3.10  0.00
assign ( resid   45 and name   HD# ) ( resid   58 and name    HA )  4.32  2.52  1.10
assign ( resid   45 and name   HD# ) ( resid   58 and name    HN )  5.31  3.51  0.69
assign ( resid   45 and name   HD# ) ( resid   58 and name   HD1 )  4.93  3.13  0.00
assign ( resid   45 and name   HD# ) ( resid   58 and name   HE1 )  5.10  3.30  0.00
assign ( resid   45 and name   HE# ) ( resid   56 and name   HB# )  4.11  2.31  0.00
assign ( resid   45 and name   HE# ) ( resid   56 and name   HB1 )  4.94  3.14  0.00
assign ( resid   45 and name   HE# ) ( resid   56 and name   HB2 )  4.94  3.14  0.00
assign ( resid   45 and name   HE# ) ( resid   57 and name    HN )  5.29  3.49  0.00
assign ( resid   46 and name    HA ) ( resid   46 and name  HD1# )  4.11  2.31  0.00
assign ( resid   46 and name    HA ) ( resid   46 and name  HG2# )  4.40  2.60  0.00
assign ( resid   46 and name    HA ) ( resid   47 and name    HN )  3.84  2.04  0.00
assign ( resid   46 and name    HA ) ( resid   59 and name  HG2# )  5.91  4.11  0.00
assign ( resid   46 and name    HB ) ( resid   46 and name  HD1# )  4.36  2.56  0.00
assign ( resid   46 and name    HB ) ( resid   47 and name    HA )  6.00  4.20  0.00
assign ( resid   46 and name    HB ) ( resid   47 and name    HN )  5.19  3.39  0.00
assign ( resid   46 and name    HB ) ( resid   57 and name    HN )  5.57  3.77  0.20
assign ( resid   46 and name    HB ) ( resid   59 and name  HG1# )  4.49  2.69  0.00
assign ( resid   46 and name    HB ) ( resid   59 and name  HG2# )  4.42  2.62  0.00
assign ( resid   46 and name    HN ) ( resid   46 and name    HB )  4.18  2.38  0.00
assign ( resid   46 and name    HN ) ( resid   46 and name  HD1# )  5.02  3.22  0.00
assign ( resid   46 and name    HN ) ( resid   46 and name  HG1# )  4.64  2.84  0.00
assign ( resid   46 and name    HN ) ( resid   46 and name  HG1# )  4.93  3.13  0.00
assign ( resid   46 and name    HN ) ( resid   46 and name  HG2# )  4.82  3.02  0.00
assign ( resid   46 and name    HN ) ( resid   47 and name    HA )  6.00  4.20  0.00
assign ( resid   46 and name    HN ) ( resid   47 and name    HN )  5.80  4.00  0.00
assign ( resid   46 and name    HN ) ( resid   56 and name    HA )  6.00  4.20  0.00
assign ( resid   46 and name    HN ) ( resid   57 and name    HN )  4.31  2.51  0.70
assign ( resid   46 and name    HN ) ( resid   57 and name   HG# )  5.78  3.98  0.00
assign ( resid   46 and name    HN ) ( resid   58 and name    HA )  4.84  3.04  0.00
assign ( resid   46 and name    HN ) ( resid   59 and name    HN )  5.28  3.48  0.00
assign ( resid   46 and name    HN ) ( resid   59 and name  HG2# )  5.06  3.26  0.00
assign ( resid   46 and name  HD1# ) ( resid   47 and name    HN )  4.69  2.89  0.00
assign ( resid   46 and name  HD1# ) ( resid   59 and name    HN )  6.00  4.20  0.00
assign ( resid   46 and name  HD1# ) ( resid   59 and name  HG1# )  5.61  3.81  0.00
assign ( resid   46 and name  HD1# ) ( resid   59 and name  HG2# )  4.70  2.90  0.00
assign ( resid   46 and name  HD1# ) ( resid   64 and name    HA )  5.91  4.11  0.00
assign ( resid   46 and name  HD1# ) ( resid   64 and name    HB )  4.79  2.99  0.00
assign ( resid   46 and name  HD1# ) ( resid   64 and name    HN )  6.00  4.20  0.00
assign ( resid   46 and name  HD1# ) ( resid   64 and name   HG# )  3.98  2.18  0.00
assign ( resid   46 and name  HD1# ) ( resid   64 and name  HG1# )  4.87  3.07  0.00
assign ( resid   46 and name  HD1# ) ( resid   64 and name  HG2# )  4.87  3.07  0.00
assign ( resid   46 and name  HG1# ) ( resid   47 and name    HN )  6.00  4.20  0.00
assign ( resid   46 and name  HG1# ) ( resid   59 and name    HB )  5.20  3.40  0.00
assign ( resid   46 and name  HG1# ) ( resid   59 and name    HN )  5.83  4.03  0.00
assign ( resid   46 and name  HG1# ) ( resid   64 and name   HG# )  4.69  2.89  0.00
assign ( resid   46 and name  HG2# ) ( resid   46 and name  HD1# )  3.66  1.86  0.00
assign ( resid   46 and name  HG2# ) ( resid   46 and name  HG1# )  4.17  2.37  0.00
assign ( resid   46 and name  HG2# ) ( resid   46 and name  HG1# )  4.28  2.48  0.00
assign ( resid   46 and name  HG2# ) ( resid   47 and name    HA )  4.84  3.04  0.00
assign ( resid   46 and name  HG2# ) ( resid   47 and name    HN )  4.30  2.50  0.00
assign ( resid   46 and name  HG2# ) ( resid   48 and name    HA )  5.48  3.68  0.00
assign ( resid   46 and name  HG2# ) ( resid   48 and name   HD# )  5.23  3.43  0.00
assign ( resid   46 and name  HG2# ) ( resid   57 and name    HN )  6.00  4.20  0.00
assign ( resid   46 and name  HG2# ) ( resid   57 and name   HG# )  5.83  4.03  0.00
assign ( resid   46 and name  HG2# ) ( resid   59 and name  HG1# )  4.95  3.15  0.00
assign ( resid   46 and name  HG2# ) ( resid   59 and name  HG2# )  4.77  2.97  0.00
assign ( resid   46 and name  HG2# ) ( resid   64 and name   HG# )  5.72  3.92  0.00
assign ( resid   47 and name    HN ) ( resid   47 and name   HD2 )  5.31  3.51  0.00
assign ( resid   47 and name    HN ) ( resid   48 and name    HA )  6.00  4.20  0.00
assign ( resid   47 and name    HN ) ( resid   48 and name    HN )  5.60  3.80  0.00
assign ( resid   48 and name    HA ) ( resid   48 and name   HD# )  4.73  2.93  0.00
assign ( resid   48 and name    HA ) ( resid   49 and name    HN )  3.82  2.02  0.00
assign ( resid   48 and name    HA ) ( resid   49 and name   HB# )  4.57  2.77  0.00
assign ( resid   48 and name    HA ) ( resid   51 and name   HD1 )  5.07  3.27  0.00
assign ( resid   48 and name    HN ) ( resid   48 and name   HD# )  4.90  3.10  0.00
assign ( resid   48 and name    HN ) ( resid   49 and name    HN )  6.00  4.20  0.00
assign ( resid   48 and name    HN ) ( resid   51 and name   HB# )  5.13  3.33  0.00
assign ( resid   48 and name    HN ) ( resid   51 and name   HB1 )  6.00  4.20  0.00
assign ( resid   48 and name    HN ) ( resid   51 and name   HB2 )  6.00  4.20  0.00
assign ( resid   48 and name    HN ) ( resid   51 and name   HD1 )  6.00  4.20  0.00
assign ( resid   48 and name   HD# ) ( resid   49 and name    HN )  5.57  3.77  0.00
assign ( resid   48 and name   HE# ) ( resid   57 and name   HG1 )  6.00  4.20  0.00
assign ( resid   48 and name   HE# ) ( resid   57 and name   HG2 )  6.00  4.20  0.00
assign ( resid   49 and name    HA ) ( resid   51 and name    HN )  4.81  3.01  0.00
assign ( resid   49 and name    HN ) ( resid   49 and name   HB# )  3.60  1.80  0.00
assign ( resid   49 and name    HN ) ( resid   51 and name   HB# )  5.76  3.96  0.00
assign ( resid   49 and name   HB# ) ( resid   51 and name    HN )  5.43  3.63  0.00
assign ( resid   49 and name   HB# ) ( resid   51 and name   HD1 )  5.24  3.44  0.00
assign ( resid   50 and name   HA# ) ( resid   51 and name   HD1 )  5.87  4.07  0.00
assign ( resid   51 and name    HA ) ( resid   51 and name   HD1 )  4.71  2.91  0.00
assign ( resid   51 and name    HN ) ( resid   51 and name   HB# )  3.97  2.17  0.00
assign ( resid   51 and name    HN ) ( resid   51 and name   HD1 )  4.83  3.03  0.00
assign ( resid   51 and name    HN ) ( resid   51 and name   HE1 )  6.00  4.20  0.00
assign ( resid   53 and name    HA ) ( resid   53 and name   HD# )  4.73  2.93  0.00
assign ( resid   53 and name    HA ) ( resid   55 and name    HN )  5.04  3.24  0.00
assign ( resid   53 and name    HA ) ( resid   56 and name    HN )  4.65  2.85  0.00
assign ( resid   53 and name   HB# ) ( resid   53 and name   HD# )  3.88  2.08  0.00
assign ( resid   53 and name   HB# ) ( resid   53 and name   HE# )  5.16  3.36  0.00
assign ( resid   53 and name   HB# ) ( resid   54 and name    HN )  5.16  3.36  0.00
assign ( resid   53 and name   HB# ) ( resid   56 and name    HN )  5.35  3.55  0.00
assign ( resid   53 and name   HG# ) ( resid   53 and name   HE# )  3.48  1.68  0.00
assign ( resid   53 and name   HG# ) ( resid   54 and name    HN )  5.74  3.94  0.00
assign ( resid   53 and name   HG# ) ( resid   56 and name    HN )  6.00  4.20  0.00
assign ( resid   54 and name    HA ) ( resid   56 and name    HN )  5.38  3.58  0.00
assign ( resid   54 and name    HN ) ( resid   55 and name    HN )  4.83  3.03  0.00
assign ( resid   54 and name    HN ) ( resid   56 and name    HN )  5.29  3.49  0.00
assign ( resid   54 and name   HB1 ) ( resid   56 and name    HN )  6.00  4.20  0.00
assign ( resid   54 and name   HB2 ) ( resid   56 and name    HN )  6.00  4.20  0.00
assign ( resid   55 and name    HA ) ( resid   55 and name   HD1 )  4.74  2.94  0.00
assign ( resid   55 and name    HA ) ( resid   55 and name   HE1 )  5.31  3.51  0.00
assign ( resid   55 and name    HN ) ( resid   56 and name    HA )  5.60  3.80  0.00
assign ( resid   55 and name    HN ) ( resid   56 and name   HB# )  5.87  4.07  0.00
assign ( resid   55 and name   HB# ) ( resid   56 and name    HN )  4.76  2.96  0.00
assign ( resid   55 and name   HB1 ) ( resid   56 and name    HN )  5.51  3.71  0.00
assign ( resid   55 and name   HB2 ) ( resid   56 and name    HN )  5.51  3.71  0.00
assign ( resid   56 and name    HA ) ( resid   57 and name    HN )  3.53  1.73  0.00
assign ( resid   56 and name    HN ) ( resid   56 and name   HB# )  3.87  2.07  0.00
assign ( resid   56 and name    HN ) ( resid   56 and name   HB1 )  4.62  2.82  0.00
assign ( resid   56 and name    HN ) ( resid   56 and name   HB2 )  4.62  2.82  0.00
assign ( resid   56 and name    HN ) ( resid   57 and name   HB# )  5.60  3.80  0.00
assign ( resid   56 and name   HB# ) ( resid   57 and name    HN )  4.02  2.22  0.00
assign ( resid   57 and name    HA ) ( resid   57 and name   HG# )  3.85  2.05  0.00
assign ( resid   57 and name    HA ) ( resid   58 and name    HA )  5.50  3.70  0.00
assign ( resid   57 and name    HA ) ( resid   58 and name    HN )  3.65  1.85  0.00
assign ( resid   57 and name    HN ) ( resid   57 and name   HB# )  4.40  2.60  0.00
assign ( resid   57 and name    HN ) ( resid   57 and name   HG# )  5.05  3.25  0.00
assign ( resid   57 and name    HN ) ( resid   58 and name    HA )  5.85  4.05  0.00
assign ( resid   57 and name    HN ) ( resid   58 and name    HN )  5.24  3.44  0.00
assign ( resid   57 and name   HB# ) ( resid   58 and name    HN )  4.02  2.22  0.00
assign ( resid   57 and name   HB# ) ( resid   59 and name  HG1# )  4.53  2.73  0.00
assign ( resid   57 and name   HG# ) ( resid   58 and name    HA )  5.70  3.90  0.00
assign ( resid   57 and name   HG# ) ( resid   58 and name    HN )  3.93  2.13  0.50
assign ( resid   57 and name   HG# ) ( resid   59 and name  HG1# )  4.52  2.72  0.00
assign ( resid   57 and name   HG# ) ( resid   59 and name  HG2# )  4.57  2.77  0.00
assign ( resid   58 and name    HA ) ( resid   58 and name   HD1 )  5.64  3.84  0.00
assign ( resid   58 and name    HA ) ( resid   59 and name  HG1# )  5.14  3.34  0.00
assign ( resid   58 and name    HA ) ( resid   59 and name  HG2# )  4.85  3.05  0.00
assign ( resid   58 and name    HN ) ( resid   58 and name   HB# )  3.81  2.01  0.00
assign ( resid   58 and name    HN ) ( resid   58 and name   HD1 )  5.35  3.55  0.00
assign ( resid   58 and name    HN ) ( resid   59 and name    HN )  5.31  3.51  0.00
assign ( resid   58 and name    HN ) ( resid   59 and name  HG1# )  5.83  4.03  0.00
assign ( resid   58 and name    HN ) ( resid   59 and name  HG2# )  6.00  4.20  0.00
assign ( resid   58 and name   HB# ) ( resid   58 and name   HD1 )  4.16  2.36  0.00
assign ( resid   58 and name   HB# ) ( resid   59 and name    HN )  5.30  3.50  0.00
assign ( resid   58 and name   HB# ) ( resid   59 and name  HG1# )  5.21  3.41  0.00
assign ( resid   58 and name   HB# ) ( resid   59 and name  HG2# )  5.32  3.52  0.00
assign ( resid   59 and name    HA ) ( resid   59 and name  HG1# )  4.19  2.39  0.00
assign ( resid   59 and name    HA ) ( resid   59 and name  HG2# )  4.49  2.69  0.00
assign ( resid   59 and name    HA ) ( resid   64 and name   HG# )  5.98  4.18  0.00
assign ( resid   59 and name    HB ) ( resid   63 and name    HN )  5.38  3.58  0.00
assign ( resid   59 and name    HB ) ( resid   64 and name   HG# )  4.42  2.62  0.00
assign ( resid   59 and name    HN ) ( resid   59 and name  HG1# )  5.26  3.46  0.00
assign ( resid   59 and name    HN ) ( resid   59 and name  HG2# )  4.38  2.58  0.00
assign ( resid   59 and name    HN ) ( resid   64 and name   HG# )  5.98  4.18  0.00
assign ( resid   59 and name  HG1# ) ( resid   63 and name    HN )  6.00  4.20  0.00
assign ( resid   59 and name  HG1# ) ( resid   63 and name   HB# )  4.40  2.60  0.00
assign ( resid   59 and name  HG1# ) ( resid   63 and name   HD# )  5.63  3.83  0.00
assign ( resid   59 and name  HG1# ) ( resid   63 and name   HG# )  4.27  2.47  0.00
assign ( resid   59 and name  HG1# ) ( resid   64 and name   HG# )  5.13  3.33  0.00
assign ( resid   59 and name  HG2# ) ( resid   63 and name    HA )  6.00  4.20  0.00
assign ( resid   59 and name  HG2# ) ( resid   64 and name    HN )  4.91  3.11  0.00
assign ( resid   59 and name  HG2# ) ( resid   64 and name   HG# )  3.62  1.82  0.00
assign ( resid   60 and name   HB# ) ( resid   61 and name    HN )  4.14  2.34  0.00
assign ( resid   60 and name   HB# ) ( resid   64 and name   HG# )  5.39  3.59  0.00
assign ( resid   61 and name    HN ) ( resid   62 and name    HN )  5.46  3.66  0.00
assign ( resid   61 and name    HN ) ( resid   62 and name   HB# )  5.57  3.77  0.00
assign ( resid   61 and name    HN ) ( resid   64 and name   HG# )  5.98  4.18  0.00
assign ( resid   62 and name    HA ) ( resid   64 and name    HN )  4.83  3.03  0.00
assign ( resid   62 and name    HA ) ( resid   64 and name   HG# )  5.98  4.18  0.00
assign ( resid   62 and name   HB# ) ( resid   63 and name    HA )  5.87  4.07  0.00
assign ( resid   62 and name   HB# ) ( resid   63 and name    HN )  4.85  3.05  0.00
assign ( resid   62 and name   HB# ) ( resid   64 and name    HN )  5.74  3.94  0.00
assign ( resid   63 and name    HA ) ( resid   63 and name   HD# )  5.38  3.58  0.00
assign ( resid   63 and name    HA ) ( resid   63 and name   HG# )  4.37  2.57  0.00
assign ( resid   63 and name    HA ) ( resid   64 and name   HG# )  5.40  3.60  0.00
assign ( resid   63 and name    HN ) ( resid   63 and name   HB# )  4.50  2.70  0.00
assign ( resid   63 and name    HN ) ( resid   63 and name   HD# )  5.53  3.73  0.00
assign ( resid   63 and name    HN ) ( resid   63 and name   HG# )  4.30  2.50  0.00
assign ( resid   63 and name    HN ) ( resid   64 and name    HA )  6.00  4.20  0.00
assign ( resid   63 and name    HN ) ( resid   64 and name    HN )  3.60  1.80  0.00
assign ( resid   63 and name    HN ) ( resid   64 and name   HG# )  4.81  3.01  0.00
assign ( resid   63 and name   HB# ) ( resid   64 and name    HN )  4.69  2.89  0.00
assign ( resid   63 and name   HB# ) ( resid   64 and name   HG# )  4.36  2.56  0.00
assign ( resid   63 and name   HG# ) ( resid   64 and name    HN )  4.39  2.59  0.30
assign ( resid   63 and name   HG# ) ( resid   64 and name   HG# )  4.50  2.70  0.00
assign ( resid   64 and name    HA ) ( resid   64 and name  HG1# )  4.26  2.46  0.00
assign ( resid   64 and name    HA ) ( resid   64 and name  HG2# )  4.26  2.46  0.00
assign ( resid   64 and name    HA ) ( resid   65 and name    HN )  3.81  2.01  0.00
assign ( resid   64 and name    HN ) ( resid   64 and name    HB )  3.85  2.05  0.00
assign ( resid   64 and name    HN ) ( resid   64 and name   HG# )  3.34  1.54  0.00
assign ( resid   64 and name    HN ) ( resid   64 and name  HG1# )  4.24  2.44  0.00
assign ( resid   64 and name    HN ) ( resid   64 and name  HG2# )  4.24  2.44  0.00
assign ( resid   64 and name    HN ) ( resid   65 and name    HN )  5.10  3.30  0.00
assign ( resid   64 and name   HG# ) ( resid   65 and name    HA )  5.83  4.03  0.00
assign ( resid   64 and name   HG# ) ( resid   65 and name    HN )  3.83  2.03  0.00
assign ( resid   64 and name  HG1# ) ( resid   65 and name    HN )  5.12  3.32  0.00
assign ( resid   64 and name  HG2# ) ( resid   65 and name    HN )  5.12  3.32  0.00
assign ( resid   65 and name    HA ) ( resid   65 and name   HD# )  3.65  1.85  0.00
assign ( resid   65 and name    HA ) ( resid   65 and name  HD1# )  4.84  3.04  0.00
assign ( resid   65 and name    HA ) ( resid   65 and name  HD2# )  4.84  3.04  0.00
assign ( resid   65 and name    HA ) ( resid   66 and name    HN )  3.87  2.07  0.00
assign ( resid   65 and name    HG ) ( resid   67 and name    HN )  5.27  3.47  0.30
assign ( resid   65 and name    HN ) ( resid   65 and name    HG )  4.90  3.10  0.00
assign ( resid   65 and name    HN ) ( resid   65 and name   HB# )  3.88  2.08  0.00
assign ( resid   65 and name    HN ) ( resid   65 and name   HB1 )  4.46  2.66  0.00
assign ( resid   65 and name    HN ) ( resid   65 and name   HB2 )  4.46  2.66  0.00
assign ( resid   65 and name    HN ) ( resid   65 and name   HD# )  4.39  2.59  0.00
assign ( resid   65 and name    HN ) ( resid   65 and name  HD1# )  5.65  3.85  0.00
assign ( resid   65 and name    HN ) ( resid   65 and name  HD2# )  5.65  3.85  0.00
assign ( resid   65 and name    HN ) ( resid   66 and name    HN )  5.21  3.41  0.00
assign ( resid   65 and name   HD# ) ( resid   66 and name    HN )  4.33  2.53  0.00
assign ( resid   65 and name   HD# ) ( resid   67 and name    HN )  5.98  4.18  0.00
assign ( resid   65 and name   HD# ) ( resid   71 and name   HB# )  3.84  2.04  0.00
assign ( resid   65 and name   HD# ) ( resid   74 and name   HB# )  5.39  3.59  0.00
assign ( resid   65 and name  HD1# ) ( resid   66 and name    HN )  5.40  3.60  0.00
assign ( resid   65 and name  HD1# ) ( resid   71 and name   HB1 )  5.88  4.08  0.00
assign ( resid   65 and name  HD1# ) ( resid   71 and name   HB2 )  5.88  4.08  0.00
assign ( resid   65 and name  HD1# ) ( resid   74 and name   HD# )  5.14  3.34  0.00
assign ( resid   65 and name  HD2# ) ( resid   66 and name    HN )  5.40  3.60  0.00
assign ( resid   65 and name  HD2# ) ( resid   71 and name   HB1 )  5.88  4.08  0.00
assign ( resid   65 and name  HD2# ) ( resid   71 and name   HB2 )  5.88  4.08  0.00
assign ( resid   65 and name  HD2# ) ( resid   74 and name   HD# )  5.14  3.34  0.00
assign ( resid   66 and name    HN ) ( resid   67 and name    HN )  5.36  3.56  0.00
assign ( resid   66 and name    HN ) ( resid   71 and name   HB# )  5.32  3.52  0.30
assign ( resid   67 and name    HA ) ( resid   67 and name   HD# )  4.42  2.62  0.00
assign ( resid   67 and name    HA ) ( resid   67 and name   HE# )  5.06  3.26  0.00
assign ( resid   67 and name    HA ) ( resid   68 and name    HN )  3.41  1.61  0.00
assign ( resid   67 and name    HA ) ( resid   71 and name    HN )  6.00  4.20  0.00
assign ( resid   67 and name    HA ) ( resid   71 and name   HB# )  4.88  3.08  0.00
assign ( resid   67 and name    HA ) ( resid   72 and name    HN )  4.97  3.17  0.30
assign ( resid   67 and name    HN ) ( resid   67 and name   HB1 )  4.19  2.39  0.00
assign ( resid   67 and name    HN ) ( resid   67 and name   HB2 )  4.22  2.42  0.00
assign ( resid   67 and name    HN ) ( resid   67 and name   HD# )  5.32  3.52  0.00
assign ( resid   67 and name    HN ) ( resid   68 and name    HN )  5.09  3.29  0.00
assign ( resid   67 and name   HB1 ) ( resid   68 and name    HA )  6.00  4.20  0.00
assign ( resid   67 and name   HB1 ) ( resid   68 and name    HN )  5.52  3.72  0.00
assign ( resid   67 and name   HB2 ) ( resid   72 and name   HG# )  5.70  3.90  0.30
assign ( resid   67 and name   HD# ) ( resid   68 and name    HA )  6.00  4.20  0.00
assign ( resid   67 and name   HD# ) ( resid   72 and name    HN )  5.90  4.10  0.00
assign ( resid   67 and name   HE# ) ( resid   72 and name    HA )  4.92  3.12  0.30
assign ( resid   68 and name    HA ) ( resid   69 and name   HB# )  4.98  3.18  0.00
assign ( resid   68 and name    HA ) ( resid   72 and name    HN )  5.93  4.13  0.00
assign ( resid   68 and name    HN ) ( resid   71 and name    HN )  4.37  2.57  0.00
assign ( resid   68 and name    HN ) ( resid   71 and name   HB# )  4.15  2.35  0.00
assign ( resid   68 and name    HN ) ( resid   72 and name    HA )  5.79  3.99  0.00
assign ( resid   68 and name    HN ) ( resid   72 and name    HB )  4.60  2.80  0.70
assign ( resid   68 and name    HN ) ( resid   72 and name    HN )  4.71  2.91  0.00
assign ( resid   68 and name    HN ) ( resid   72 and name   HG# )  4.61  2.81  0.00
assign ( resid   68 and name    HN ) ( resid   72 and name  HG1# )  6.00  4.20  0.00
assign ( resid   68 and name    HN ) ( resid   72 and name  HG2# )  6.00  4.20  0.00
assign ( resid   68 and name   HB# ) ( resid   69 and name    HA )  5.17  3.37  0.00
assign ( resid   68 and name   HB# ) ( resid   69 and name    HN )  4.38  2.58  0.00
assign ( resid   68 and name   HB# ) ( resid   69 and name   HB# )  4.99  3.19  0.00
assign ( resid   68 and name   HB# ) ( resid   70 and name    HN )  4.40  2.60  0.00
assign ( resid   68 and name   HB# ) ( resid   71 and name    HN )  5.06  3.26  0.00
assign ( resid   68 and name   HB1 ) ( resid   69 and name    HN )  5.02  3.22  0.00
assign ( resid   68 and name   HB2 ) ( resid   69 and name    HN )  5.02  3.22  0.00
assign ( resid   69 and name    HA ) ( resid   71 and name    HN )  5.12  3.32  0.00
assign ( resid   69 and name    HA ) ( resid   72 and name    HB )  4.55  2.75  0.00
assign ( resid   69 and name    HA ) ( resid   72 and name    HN )  4.68  2.88  0.00
assign ( resid   69 and name    HA ) ( resid   72 and name   HG# )  4.14  2.34  0.00
assign ( resid   69 and name    HA ) ( resid   72 and name  HG1# )  5.21  3.41  0.00
assign ( resid   69 and name    HA ) ( resid   72 and name  HG2# )  5.21  3.41  0.00
assign ( resid   69 and name    HA ) ( resid   73 and name    HN )  5.67  3.87  0.00
assign ( resid   69 and name    HN ) ( resid   69 and name   HB# )  4.51  2.71  0.00
assign ( resid   69 and name    HN ) ( resid   70 and name    HN )  5.07  3.27  0.00
assign ( resid   69 and name    HN ) ( resid   72 and name   HG# )  4.75  2.95  0.00
assign ( resid   69 and name   HB# ) ( resid   70 and name    HN )  4.82  3.02  0.00
assign ( resid   69 and name   HB# ) ( resid   71 and name    HN )  5.43  3.63  0.00
assign ( resid   69 and name   HB# ) ( resid   72 and name   HG# )  4.53  2.73  0.00
assign ( resid   70 and name    HA ) ( resid   73 and name    HN )  4.38  2.58  0.00
assign ( resid   70 and name    HA ) ( resid   73 and name   HB# )  4.40  2.60  0.00
assign ( resid   70 and name    HA ) ( resid   73 and name   HD# )  5.42  3.62  0.00
assign ( resid   70 and name    HA ) ( resid   73 and name   HE# )  5.35  3.55  0.60
assign ( resid   70 and name    HA ) ( resid   74 and name    HN )  5.72  3.92  0.00
assign ( resid   70 and name    HN ) ( resid   70 and name   HB# )  3.12  1.32  0.00
assign ( resid   70 and name    HN ) ( resid   71 and name    HA )  5.47  3.67  0.00
assign ( resid   70 and name    HN ) ( resid   71 and name    HN )  3.51  1.71  0.00
assign ( resid   70 and name   HB# ) ( resid   71 and name    HA )  5.30  3.50  0.00
assign ( resid   70 and name   HB# ) ( resid   71 and name    HN )  3.62  1.82  0.00
assign ( resid   70 and name   HB# ) ( resid   73 and name    HN )  6.00  4.20  0.00
assign ( resid   70 and name   HB# ) ( resid   74 and name    HN )  6.00  4.20  0.00
assign ( resid   71 and name    HA ) ( resid   73 and name    HN )  5.18  3.38  0.00
assign ( resid   71 and name    HA ) ( resid   74 and name    HN )  4.11  2.31  0.00
assign ( resid   71 and name    HA ) ( resid   74 and name   HB# )  4.07  2.27  0.00
assign ( resid   71 and name    HA ) ( resid   74 and name   HD# )  4.98  3.18  0.00
assign ( resid   71 and name    HA ) ( resid   75 and name    HN )  5.80  4.00  0.00
assign ( resid   71 and name    HN ) ( resid   71 and name   HB# )  3.58  1.78  0.00
assign ( resid   71 and name    HN ) ( resid   71 and name   HB1 )  4.16  2.36  0.00
assign ( resid   71 and name    HN ) ( resid   71 and name   HB2 )  4.16  2.36  0.00
assign ( resid   71 and name    HN ) ( resid   72 and name    HA )  5.80  4.00  0.00
assign ( resid   71 and name    HN ) ( resid   72 and name    HB )  5.51  3.71  0.00
assign ( resid   71 and name    HN ) ( resid   72 and name    HN )  3.67  1.87  0.00
assign ( resid   71 and name    HN ) ( resid   72 and name   HG# )  4.58  2.78  0.00
assign ( resid   71 and name    HN ) ( resid   73 and name    HN )  4.77  2.97  0.00
assign ( resid   71 and name    HN ) ( resid   74 and name    HN )  5.59  3.79  0.00
assign ( resid   71 and name    HN ) ( resid   74 and name   HG# )  5.59  3.79  0.00
assign ( resid   71 and name   HB# ) ( resid   72 and name    HA )  5.48  3.68  0.00
assign ( resid   71 and name   HB# ) ( resid   72 and name    HB )  5.37  3.57  0.00
assign ( resid   71 and name   HB# ) ( resid   72 and name    HN )  4.91  3.11  0.00
assign ( resid   71 and name   HB# ) ( resid   73 and name    HN )  5.87  4.07  0.00
assign ( resid   71 and name   HB# ) ( resid   74 and name    HN )  5.65  3.85  0.00
assign ( resid   71 and name   HB# ) ( resid   74 and name   HB# )  4.54  2.74  0.00
assign ( resid   72 and name    HA ) ( resid   72 and name  HG1# )  4.24  2.44  0.00
assign ( resid   72 and name    HA ) ( resid   72 and name  HG2# )  4.24  2.44  0.00
assign ( resid   72 and name    HA ) ( resid   73 and name    HA )  5.82  4.02  0.00
assign ( resid   72 and name    HA ) ( resid   74 and name    HN )  5.62  3.82  0.00
assign ( resid   72 and name    HA ) ( resid   75 and name    HN )  4.69  2.89  0.00
assign ( resid   72 and name    HA ) ( resid   75 and name   HB# )  5.36  3.56  0.00
assign ( resid   72 and name    HA ) ( resid   75 and name   HD# )  5.53  3.73  0.00
assign ( resid   72 and name    HA ) ( resid   76 and name    HN )  6.00  4.20  0.00
assign ( resid   72 and name    HB ) ( resid   73 and name    HN )  4.50  2.70  0.00
assign ( resid   72 and name    HN ) ( resid   72 and name    HB )  3.71  1.91  0.00
assign ( resid   72 and name    HN ) ( resid   72 and name   HG# )  3.52  1.72  0.00
assign ( resid   72 and name    HN ) ( resid   72 and name  HG1# )  4.30  2.50  0.00
assign ( resid   72 and name    HN ) ( resid   72 and name  HG2# )  4.30  2.50  0.00
assign ( resid   72 and name    HN ) ( resid   73 and name    HN )  3.65  1.85  0.00
assign ( resid   72 and name    HN ) ( resid   73 and name   HB# )  5.36  3.56  0.00
assign ( resid   72 and name    HN ) ( resid   74 and name    HN )  4.72  2.92  0.00
assign ( resid   72 and name    HN ) ( resid   74 and name   HB# )  5.96  4.16  0.00
assign ( resid   72 and name    HN ) ( resid   74 and name   HG# )  6.00  4.20  0.00
assign ( resid   72 and name   HG# ) ( resid   73 and name    HA )  4.30  2.50  0.00
assign ( resid   72 and name   HG# ) ( resid   73 and name    HN )  4.41  2.61  0.00
assign ( resid   72 and name   HG# ) ( resid   74 and name    HN )  5.06  3.26  0.00
assign ( resid   72 and name   HG# ) ( resid   75 and name    HN )  5.98  4.18  0.00
assign ( resid   72 and name   HG# ) ( resid   75 and name   HD# )  5.00  3.20  0.00
assign ( resid   72 and name   HG# ) ( resid   75 and name   HG# )  5.98  4.18  0.00
assign ( resid   72 and name   HG# ) ( resid   76 and name    HN )  5.98  4.18  0.00
assign ( resid   72 and name   HG# ) ( resid   76 and name   HG# )  4.68  2.88  0.00
assign ( resid   72 and name  HG1# ) ( resid   73 and name    HA )  5.23  3.43  0.00
assign ( resid   72 and name  HG2# ) ( resid   73 and name    HA )  5.23  3.43  0.40
assign ( resid   73 and name    HA ) ( resid   73 and name   HD# )  4.70  2.90  0.00
assign ( resid   73 and name    HA ) ( resid   75 and name    HN )  4.92  3.12  0.00
assign ( resid   73 and name    HA ) ( resid   76 and name    HN )  4.17  2.37  0.00
assign ( resid   73 and name    HA ) ( resid   76 and name   HG# )  4.10  2.30  0.00
assign ( resid   73 and name    HA ) ( resid   76 and name   HG1 )  4.76  2.96  0.00
assign ( resid   73 and name    HA ) ( resid   76 and name   HG2 )  4.76  2.96  0.00
assign ( resid   73 and name    HA ) ( resid   77 and name    HN )  5.19  3.39  0.00
assign ( resid   73 and name    HN ) ( resid   73 and name   HB# )  3.17  1.37  0.00
assign ( resid   73 and name    HN ) ( resid   73 and name   HD# )  4.76  2.96  0.00
assign ( resid   73 and name    HN ) ( resid   76 and name   HG# )  5.87  4.07  0.00
assign ( resid   73 and name   HB# ) ( resid   73 and name   HE# )  4.32  2.52  0.00
assign ( resid   73 and name   HB# ) ( resid   74 and name    HN )  4.03  2.23  0.00
assign ( resid   73 and name   HB# ) ( resid   76 and name    HN )  5.50  3.70  0.00
assign ( resid   73 and name   HB# ) ( resid   77 and name    HN )  5.93  4.13  0.00
assign ( resid   73 and name   HD# ) ( resid   74 and name    HA )  4.60  2.80  1.00
assign ( resid   73 and name   HD# ) ( resid   74 and name    HN )  4.90  3.10  0.00
assign ( resid   73 and name   HE# ) ( resid   74 and name   HG# )  5.42  3.62  0.50
assign ( resid   73 and name   HG# ) ( resid   73 and name   HE# )  3.82  2.02  0.00
assign ( resid   73 and name   HG# ) ( resid   74 and name    HN )  5.79  3.99  0.00
assign ( resid   73 and name   HG# ) ( resid   76 and name   HB# )  4.72  2.92  0.00
assign ( resid   73 and name   HG# ) ( resid   77 and name    HN )  5.21  3.41  0.00
assign ( resid   73 and name   HG# ) ( resid   77 and name   HB# )  4.88  3.08  0.00
assign ( resid   74 and name    HA ) ( resid   74 and name   HD# )  5.08  3.28  0.00
assign ( resid   74 and name    HA ) ( resid   74 and name   HG# )  4.49  2.69  0.00
assign ( resid   74 and name    HA ) ( resid   76 and name    HN )  5.07  3.27  0.00
assign ( resid   74 and name    HA ) ( resid   77 and name    HN )  4.41  2.61  0.00
assign ( resid   74 and name    HA ) ( resid   77 and name   HB# )  4.08  2.28  0.00
assign ( resid   74 and name    HA ) ( resid   78 and name   HD# )  4.90  3.10  0.00
assign ( resid   74 and name    HN ) ( resid   74 and name   HB# )  3.12  1.32  0.00
assign ( resid   74 and name    HN ) ( resid   74 and name   HD# )  5.25  3.45  0.00
assign ( resid   74 and name    HN ) ( resid   74 and name   HG# )  4.27  2.47  0.00
assign ( resid   74 and name    HN ) ( resid   75 and name    HA )  6.00  4.20  0.00
assign ( resid   74 and name    HN ) ( resid   75 and name    HN )  3.85  2.05  0.00
assign ( resid   74 and name    HN ) ( resid   75 and name   HB# )  6.00  4.20  0.00
assign ( resid   74 and name    HN ) ( resid   76 and name   HB# )  6.00  4.20  0.00
assign ( resid   74 and name    HN ) ( resid   76 and name   HG# )  5.87  4.07  0.00
assign ( resid   74 and name    HN ) ( resid   77 and name    HN )  5.56  3.76  0.00
assign ( resid   74 and name    HN ) ( resid   77 and name   HB# )  5.61  3.81  0.00
assign ( resid   74 and name   HB# ) ( resid   75 and name    HN )  3.86  2.06  0.00
assign ( resid   74 and name   HB# ) ( resid   75 and name   HB# )  4.81  3.01  0.00
assign ( resid   74 and name   HB# ) ( resid   77 and name    HN )  6.00  4.20  0.00
assign ( resid   74 and name   HB# ) ( resid   78 and name    HN )  5.86  4.06  0.00
assign ( resid   74 and name   HB# ) ( resid   78 and name   HD# )  3.99  2.19  0.00
assign ( resid   74 and name   HD# ) ( resid   78 and name   HD# )  5.33  3.53  0.00
assign ( resid   74 and name   HG# ) ( resid   77 and name   HB# )  5.26  3.46  0.00
assign ( resid   74 and name   HG# ) ( resid   78 and name   HD# )  4.74  2.94  0.00
assign ( resid   75 and name    HA ) ( resid   75 and name   HD# )  5.32  3.52  0.00
assign ( resid   75 and name    HA ) ( resid   75 and name   HG# )  4.61  2.81  0.00
assign ( resid   75 and name    HA ) ( resid   78 and name   HD# )  4.83  3.03  0.00
assign ( resid   75 and name    HA ) ( resid   79 and name    HN )  5.59  3.79  0.00
assign ( resid   75 and name    HN ) ( resid   75 and name   HB# )  3.88  2.08  0.00
assign ( resid   75 and name    HN ) ( resid   75 and name   HD# )  4.86  3.06  0.00
assign ( resid   75 and name    HN ) ( resid   76 and name   HB# )  5.57  3.77  0.00
assign ( resid   75 and name    HN ) ( resid   76 and name   HG# )  5.27  3.47  0.00
assign ( resid   75 and name    HN ) ( resid   77 and name    HN )  4.72  2.92  0.00
assign ( resid   75 and name   HB# ) ( resid   75 and name   HD# )  4.11  2.31  0.00
assign ( resid   75 and name   HB# ) ( resid   76 and name    HN )  4.32  2.52  0.00
assign ( resid   75 and name   HD# ) ( resid   76 and name    HA )  6.00  4.20  0.00
assign ( resid   75 and name   HD# ) ( resid   76 and name    HN )  5.31  3.51  0.00
assign ( resid   75 and name   HG# ) ( resid   77 and name    HN )  6.00  4.20  0.00
assign ( resid   76 and name    HA ) ( resid   76 and name   HG# )  3.72  1.92  0.00
assign ( resid   76 and name    HA ) ( resid   76 and name   HG1 )  4.47  2.67  0.00
assign ( resid   76 and name    HA ) ( resid   76 and name   HG2 )  4.47  2.67  0.00
assign ( resid   76 and name    HA ) ( resid   78 and name    HN )  5.26  3.46  0.00
assign ( resid   76 and name    HA ) ( resid   79 and name    HN )  4.87  3.07  0.00
assign ( resid   76 and name    HA ) ( resid   79 and name   HB# )  3.77  1.97  0.00
assign ( resid   76 and name    HN ) ( resid   76 and name   HB# )  3.83  2.03  0.00
assign ( resid   76 and name    HN ) ( resid   76 and name   HG# )  4.15  2.35  0.00
assign ( resid   76 and name    HN ) ( resid   77 and name    HN )  3.88  2.08  0.00
assign ( resid   76 and name    HN ) ( resid   77 and name   HB# )  4.86  3.06  0.00
assign ( resid   76 and name   HB# ) ( resid   77 and name    HN )  3.40  1.60  0.00
assign ( resid   76 and name   HB# ) ( resid   79 and name    HN )  5.95  4.15  0.00
assign ( resid   76 and name   HB# ) ( resid   79 and name   HB# )  4.60  2.80  0.00
assign ( resid   76 and name   HG# ) ( resid   77 and name    HN )  5.32  3.52  0.00
assign ( resid   76 and name   HG# ) ( resid   79 and name   HB# )  5.87  4.07  0.00
assign ( resid   76 and name   HG1 ) ( resid   77 and name    HN )  6.00  4.20  0.00
assign ( resid   76 and name   HG2 ) ( resid   77 and name    HN )  6.00  4.20  0.00
assign ( resid   77 and name    HN ) ( resid   77 and name   HB# )  3.47  1.67  0.00
assign ( resid   77 and name    HN ) ( resid   78 and name    HG )  5.36  3.56  0.00
assign ( resid   77 and name    HN ) ( resid   78 and name   HD# )  5.63  3.83  0.00
assign ( resid   77 and name    HN ) ( resid   79 and name    HN )  4.65  2.85  0.00
assign ( resid   77 and name    HN ) ( resid   79 and name   HB# )  4.86  3.06  0.00
assign ( resid   77 and name   HB# ) ( resid   78 and name    HA )  5.20  3.40  0.00
assign ( resid   77 and name   HB# ) ( resid   78 and name    HN )  4.41  2.61  0.00
assign ( resid   77 and name   HB# ) ( resid   78 and name   HB1 )  5.79  3.99  0.00
assign ( resid   77 and name   HB# ) ( resid   78 and name   HD# )  4.43  2.63  0.00
assign ( resid   77 and name   HB# ) ( resid   78 and name  HD1# )  5.05  3.25  0.00
assign ( resid   77 and name   HB# ) ( resid   78 and name  HD2# )  5.05  3.25  0.00
assign ( resid   77 and name   HB# ) ( resid   79 and name    HN )  5.40  3.60  0.00
assign ( resid   77 and name   HB# ) ( resid   81 and name   HG# )  5.83  4.03  0.00
assign ( resid   78 and name    HA ) ( resid   78 and name    HG )  4.16  2.36  0.00
assign ( resid   78 and name    HA ) ( resid   78 and name   HD# )  3.39  1.59  0.00
assign ( resid   78 and name    HA ) ( resid   78 and name  HD1# )  4.44  2.64  0.00
assign ( resid   78 and name    HA ) ( resid   78 and name  HD2# )  4.44  2.64  0.00
assign ( resid   78 and name    HA ) ( resid   79 and name    HN )  3.92  2.12  0.00
assign ( resid   78 and name    HA ) ( resid   81 and name    HN )  3.98  2.18  0.00
assign ( resid   78 and name    HA ) ( resid   81 and name   HB# )  4.16  2.36  0.00
assign ( resid   78 and name    HA ) ( resid   81 and name   HG# )  4.99  3.19  0.00
assign ( resid   78 and name    HG ) ( resid   79 and name    HN )  5.39  3.59  0.00
assign ( resid   78 and name    HG ) ( resid   81 and name   HB# )  5.78  3.98  0.00
assign ( resid   78 and name    HN ) ( resid   78 and name    HG )  3.69  1.89  0.00
assign ( resid   78 and name    HN ) ( resid   78 and name   HB1 )  4.38  2.58  0.00
assign ( resid   78 and name    HN ) ( resid   78 and name   HD# )  4.05  2.25  0.00
assign ( resid   78 and name    HN ) ( resid   78 and name  HD1# )  4.64  2.84  0.00
assign ( resid   78 and name    HN ) ( resid   78 and name  HD2# )  4.64  2.84  0.00
assign ( resid   78 and name    HN ) ( resid   79 and name    HN )  3.84  2.04  0.00
assign ( resid   78 and name    HN ) ( resid   79 and name   HB# )  4.71  2.91  0.00
assign ( resid   78 and name    HN ) ( resid   80 and name    HN )  4.70  2.90  0.00
assign ( resid   78 and name    HN ) ( resid   81 and name   HB# )  5.49  3.69  0.50
assign ( resid   78 and name   HB1 ) ( resid   78 and name  HD1# )  3.76  1.96  0.00
assign ( resid   78 and name   HB1 ) ( resid   78 and name  HD2# )  3.76  1.96  0.00
assign ( resid   78 and name   HB1 ) ( resid   79 and name    HA )  4.87  3.07  0.30
assign ( resid   78 and name   HB1 ) ( resid   80 and name    HN )  6.00  4.20  0.00
assign ( resid   78 and name   HB1 ) ( resid   81 and name   HB# )  5.45  3.65  0.00
assign ( resid   78 and name   HB2 ) ( resid   79 and name    HA )  5.72  3.92  0.00
assign ( resid   78 and name   HB2 ) ( resid   79 and name    HN )  4.50  2.70  0.00
assign ( resid   78 and name   HB2 ) ( resid   81 and name    HN )  5.31  3.51  0.30
assign ( resid   78 and name   HB2 ) ( resid   81 and name   HB# )  5.26  3.46  0.00
assign ( resid   78 and name   HD# ) ( resid   81 and name    HN )  5.82  4.02  0.00
assign ( resid   78 and name   HD# ) ( resid   81 and name   HB# )  4.09  2.29  0.00
assign ( resid   78 and name   HD# ) ( resid   81 and name   HG# )  4.32  2.52  0.50
assign ( resid   78 and name   HD# ) ( resid   82 and name    HN )  5.98  4.18  0.00
assign ( resid   78 and name   HD# ) ( resid   82 and name   HB# )  5.81  4.01  0.00
assign ( resid   78 and name  HD1# ) ( resid   79 and name    HN )  5.70  3.90  0.00
assign ( resid   78 and name  HD2# ) ( resid   79 and name    HN )  5.70  3.90  0.00
assign ( resid   79 and name    HA ) ( resid   80 and name   HB# )  6.00  4.20  0.00
assign ( resid   79 and name    HA ) ( resid   81 and name    HN )  5.72  3.92  0.00
assign ( resid   79 and name    HA ) ( resid   81 and name   HB# )  5.94  4.14  0.00
assign ( resid   79 and name    HA ) ( resid   82 and name    HN )  5.46  3.66  0.00
assign ( resid   79 and name    HA ) ( resid   82 and name   HB# )  4.87  3.07  0.00
assign ( resid   79 and name    HA ) ( resid   82 and name   HB1 )  5.56  3.76  0.00
assign ( resid   79 and name    HA ) ( resid   82 and name   HB2 )  5.56  3.76  0.00
assign ( resid   79 and name    HA ) ( resid   83 and name    HN )  5.49  3.69  0.00
assign ( resid   79 and name    HN ) ( resid   79 and name   HB# )  3.38  1.58  0.00
assign ( resid   79 and name    HN ) ( resid   80 and name   HD# )  6.00  4.20  0.00
assign ( resid   79 and name    HN ) ( resid   80 and name   HG# )  5.47  3.67  0.50
assign ( resid   79 and name    HN ) ( resid   81 and name   HB# )  5.60  3.80  0.00
assign ( resid   79 and name   HB# ) ( resid   80 and name    HN )  3.63  1.83  0.00
assign ( resid   79 and name   HB# ) ( resid   80 and name   HB# )  4.92  3.12  0.00
assign ( resid   79 and name   HB# ) ( resid   80 and name   HD# )  5.26  3.46  0.00
assign ( resid   79 and name   HB# ) ( resid   82 and name    HN )  5.48  3.68  0.00
assign ( resid   79 and name   HB# ) ( resid   82 and name   HB1 )  6.00  4.20  0.00
assign ( resid   79 and name   HB# ) ( resid   82 and name   HB2 )  6.00  4.20  0.00
assign ( resid   80 and name    HA ) ( resid   83 and name    HN )  5.57  3.77  0.00
assign ( resid   80 and name    HN ) ( resid   80 and name   HB# )  3.19  1.39  0.00
assign ( resid   80 and name    HN ) ( resid   80 and name   HD# )  4.73  2.93  0.00
assign ( resid   80 and name    HN ) ( resid   80 and name   HG# )  4.19  2.39  0.00
assign ( resid   80 and name    HN ) ( resid   81 and name    HN )  3.67  1.87  0.00
assign ( resid   80 and name    HN ) ( resid   81 and name   HB# )  5.74  3.94  0.00
assign ( resid   80 and name   HB# ) ( resid   80 and name   HD# )  4.24  2.44  0.00
assign ( resid   80 and name   HB# ) ( resid   81 and name    HN )  4.20  2.40  0.00
assign ( resid   81 and name    HN ) ( resid   81 and name   HB# )  3.30  1.50  0.00
assign ( resid   81 and name    HN ) ( resid   81 and name   HG# )  4.40  2.60  0.00
assign ( resid   81 and name   HB# ) ( resid   82 and name    HN )  5.19  3.39  0.00
assign ( resid   81 and name   HB# ) ( resid   82 and name   HB# )  5.26  3.46  0.00
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0  -97.1   66.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  158.8   25.8 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0  -76.6   26.2 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  -29.6   28.0 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0 -133.2   36.7 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name C    ) (resid   14 and name N    )    1.0  153.9   44.0 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0 -123.6   33.5 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name C    ) (resid   15 and name N    )    1.0  161.8   20.0 2
assign (resid   14 and name C    ) (resid   15 and name N    )
       (resid   15 and name CA   ) (resid   15 and name C    )    1.0  -54.9   20.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name C    ) (resid   16 and name N    )    1.0  133.2   20.0 2
assign (resid   15 and name C    ) (resid   16 and name N    )
       (resid   16 and name CA   ) (resid   16 and name C    )    1.0   97.4   24.5 2
assign (resid   16 and name N    ) (resid   16 and name CA   )
       (resid   16 and name C    ) (resid   17 and name N    )    1.0  -14.8   20.0 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -68.9   25.4 2
assign (resid   17 and name N    ) (resid   17 and name CA   )
       (resid   17 and name C    ) (resid   18 and name N    )    1.0  134.2   23.7 2
assign (resid   17 and name C    ) (resid   18 and name N    )
       (resid   18 and name CA   ) (resid   18 and name C    )    1.0  -90.2   25.1 2
assign (resid   18 and name N    ) (resid   18 and name CA   )
       (resid   18 and name C    ) (resid   19 and name N    )    1.0  126.2   28.9 2
assign (resid   18 and name C    ) (resid   19 and name N    )
       (resid   19 and name CA   ) (resid   19 and name C    )    1.0 -122.6   33.1 2
assign (resid   19 and name N    ) (resid   19 and name CA   )
       (resid   19 and name C    ) (resid   20 and name N    )    1.0  163.2   20.0 2
assign (resid   19 and name C    ) (resid   20 and name N    )
       (resid   20 and name CA   ) (resid   20 and name C    )    1.0 -140.8   35.8 2
assign (resid   20 and name N    ) (resid   20 and name CA   )
       (resid   20 and name C    ) (resid   21 and name N    )    1.0  154.9   20.0 2
assign (resid   20 and name C    ) (resid   21 and name N    )
       (resid   21 and name CA   ) (resid   21 and name C    )    1.0 -113.7   23.4 2
assign (resid   21 and name N    ) (resid   21 and name CA   )
       (resid   21 and name C    ) (resid   22 and name N    )    1.0  134.2   20.9 2
assign (resid   26 and name C    ) (resid   27 and name N    )
       (resid   27 and name CA   ) (resid   27 and name C    )    1.0 -119.3   46.5 2
assign (resid   27 and name N    ) (resid   27 and name CA   )
       (resid   27 and name C    ) (resid   28 and name N    )    1.0  147.1   20.0 2
assign (resid   27 and name C    ) (resid   28 and name N    )
       (resid   28 and name CA   ) (resid   28 and name C    )    1.0 -115.5   30.1 2
assign (resid   28 and name N    ) (resid   28 and name CA   )
       (resid   28 and name C    ) (resid   29 and name N    )    1.0  142.3   20.7 2
assign (resid   28 and name C    ) (resid   29 and name N    )
       (resid   29 and name CA   ) (resid   29 and name C    )    1.0  -78.5   29.4 2
assign (resid   29 and name N    ) (resid   29 and name CA   )
       (resid   29 and name C    ) (resid   30 and name N    )    1.0  131.7   34.2 2
assign (resid   29 and name C    ) (resid   30 and name N    )
       (resid   30 and name CA   ) (resid   30 and name C    )    1.0 -123.0   30.0 2
assign (resid   30 and name N    ) (resid   30 and name CA   )
       (resid   30 and name C    ) (resid   31 and name N    )    1.0  142.7   29.5 2
assign (resid   30 and name C    ) (resid   31 and name N    )
       (resid   31 and name CA   ) (resid   31 and name C    )    1.0 -135.1   20.2 2
assign (resid   31 and name N    ) (resid   31 and name CA   )
       (resid   31 and name C    ) (resid   32 and name N    )    1.0  138.2   23.7 2
assign (resid   31 and name C    ) (resid   32 and name N    )
       (resid   32 and name CA   ) (resid   32 and name C    )    1.0  -80.6   22.6 2
assign (resid   32 and name N    ) (resid   32 and name CA   )
       (resid   32 and name C    ) (resid   33 and name N    )    1.0  121.9   30.3 2
assign (resid   32 and name C    ) (resid   33 and name N    )
       (resid   33 and name CA   ) (resid   33 and name C    )    1.0  -89.3   29.7 2
assign (resid   33 and name N    ) (resid   33 and name CA   )
       (resid   33 and name C    ) (resid   34 and name N    )    1.0  -36.2   20.0 2
assign (resid   33 and name C    ) (resid   34 and name N    )
       (resid   34 and name CA   ) (resid   34 and name C    )    1.0 -156.5   22.9 2
assign (resid   34 and name N    ) (resid   34 and name CA   )
       (resid   34 and name C    ) (resid   35 and name N    )    1.0  150.8   22.8 2
assign (resid   34 and name C    ) (resid   35 and name N    )
       (resid   35 and name CA   ) (resid   35 and name C    )    1.0 -119.9   27.5 2
assign (resid   35 and name N    ) (resid   35 and name CA   )
       (resid   35 and name C    ) (resid   36 and name N    )    1.0  125.4   30.2 2
assign (resid   35 and name C    ) (resid   36 and name N    )
       (resid   36 and name CA   ) (resid   36 and name C    )    1.0  -85.1   45.8 2
assign (resid   36 and name N    ) (resid   36 and name CA   )
       (resid   36 and name C    ) (resid   37 and name N    )    1.0  129.1   55.8 2
assign (resid   37 and name C    ) (resid   38 and name N    )
       (resid   38 and name CA   ) (resid   38 and name C    )    1.0  -90.2   20.0 2
assign (resid   38 and name N    ) (resid   38 and name CA   )
       (resid   38 and name C    ) (resid   39 and name N    )    1.0    2.5   20.2 2
assign (resid   39 and name C    ) (resid   40 and name N    )
       (resid   40 and name CA   ) (resid   40 and name C    )    1.0 -119.7   23.9 2
assign (resid   40 and name N    ) (resid   40 and name CA   )
       (resid   40 and name C    ) (resid   41 and name N    )    1.0  135.1   38.0 2
assign (resid   42 and name C    ) (resid   43 and name N    )
       (resid   43 and name CA   ) (resid   43 and name C    )    1.0 -134.8   60.0 2
assign (resid   43 and name N    ) (resid   43 and name CA   )
       (resid   43 and name C    ) (resid   44 and name N    )    1.0  153.3   36.8 2
assign (resid   43 and name C    ) (resid   44 and name N    )
       (resid   44 and name CA   ) (resid   44 and name C    )    1.0 -140.7   50.3 2
assign (resid   44 and name N    ) (resid   44 and name CA   )
       (resid   44 and name C    ) (resid   45 and name N    )    1.0  135.6   20.0 2
assign (resid   44 and name C    ) (resid   45 and name N    )
       (resid   45 and name CA   ) (resid   45 and name C    )    1.0 -101.7   35.8 2
assign (resid   45 and name N    ) (resid   45 and name CA   )
       (resid   45 and name C    ) (resid   46 and name N    )    1.0  124.5   31.8 2
assign (resid   45 and name C    ) (resid   46 and name N    )
       (resid   46 and name CA   ) (resid   46 and name C    )    1.0 -104.5   42.1 2
assign (resid   46 and name N    ) (resid   46 and name CA   )
       (resid   46 and name C    ) (resid   47 and name N    )    1.0  139.4   58.5 2
assign (resid   46 and name C    ) (resid   47 and name N    )
       (resid   47 and name CA   ) (resid   47 and name C    )    1.0 -110.0   30.6 2
assign (resid   47 and name N    ) (resid   47 and name CA   )
       (resid   47 and name C    ) (resid   48 and name N    )    1.0  124.0   21.2 2
assign (resid   49 and name C    ) (resid   50 and name N    )
       (resid   50 and name CA   ) (resid   50 and name C    )    1.0   84.2   25.8 2
assign (resid   50 and name N    ) (resid   50 and name CA   )
       (resid   50 and name C    ) (resid   51 and name N    )    1.0   -5.0   30.2 2
assign (resid   50 and name C    ) (resid   51 and name N    )
       (resid   51 and name CA   ) (resid   51 and name C    )    1.0  -97.0   45.3 2
assign (resid   51 and name N    ) (resid   51 and name CA   )
       (resid   51 and name C    ) (resid   52 and name N    )    1.0  143.9   44.4 2
assign (resid   51 and name C    ) (resid   52 and name N    )
       (resid   52 and name CA   ) (resid   52 and name C    )    1.0  -89.1   39.8 2
assign (resid   52 and name N    ) (resid   52 and name CA   )
       (resid   52 and name C    ) (resid   53 and name N    )    1.0  137.8   62.2 2
assign (resid   52 and name C    ) (resid   53 and name N    )
       (resid   53 and name CA   ) (resid   53 and name C    )    1.0  -62.4   20.0 2
assign (resid   53 and name N    ) (resid   53 and name CA   )
       (resid   53 and name C    ) (resid   54 and name N    )    1.0  -32.5   20.0 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )    1.0  -68.2   20.0 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )    1.0  -32.8   29.4 2
assign (resid   54 and name C    ) (resid   55 and name N    )
       (resid   55 and name CA   ) (resid   55 and name C    )    1.0  -98.6   29.6 2
assign (resid   55 and name N    ) (resid   55 and name CA   )
       (resid   55 and name C    ) (resid   56 and name N    )    1.0    1.6   35.0 2
assign (resid   55 and name C    ) (resid   56 and name N    )
       (resid   56 and name CA   ) (resid   56 and name C    )    1.0   63.2   27.4 2
assign (resid   56 and name N    ) (resid   56 and name CA   )
       (resid   56 and name C    ) (resid   57 and name N    )    1.0   36.5   36.4 2
assign (resid   57 and name C    ) (resid   58 and name N    )
       (resid   58 and name CA   ) (resid   58 and name C    )    1.0  -82.2   21.7 2
assign (resid   58 and name N    ) (resid   58 and name CA   )
       (resid   58 and name C    ) (resid   59 and name N    )    1.0  139.1   20.4 2
assign (resid   58 and name C    ) (resid   59 and name N    )
       (resid   59 and name CA   ) (resid   59 and name C    )    1.0 -108.6   42.7 2
assign (resid   59 and name N    ) (resid   59 and name CA   )
       (resid   59 and name C    ) (resid   60 and name N    )    1.0  122.8   40.8 2
assign (resid   60 and name C    ) (resid   61 and name N    )
       (resid   61 and name CA   ) (resid   61 and name C    )    1.0  -52.9   27.5 2
assign (resid   61 and name N    ) (resid   61 and name CA   )
       (resid   61 and name C    ) (resid   62 and name N    )    1.0  -40.9   27.2 2
assign (resid   61 and name C    ) (resid   62 and name N    )
       (resid   62 and name CA   ) (resid   62 and name C    )    1.0  -70.0   20.0 2
assign (resid   62 and name N    ) (resid   62 and name CA   )
       (resid   62 and name C    ) (resid   63 and name N    )    1.0  -25.9   25.0 2
assign (resid   62 and name C    ) (resid   63 and name N    )
       (resid   63 and name CA   ) (resid   63 and name C    )    1.0  -95.2   26.3 2
assign (resid   63 and name N    ) (resid   63 and name CA   )
       (resid   63 and name C    ) (resid   64 and name N    )    1.0   -3.9   37.8 2
assign (resid   64 and name C    ) (resid   65 and name N    )
       (resid   65 and name CA   ) (resid   65 and name C    )    1.0 -127.6   35.8 2
assign (resid   65 and name N    ) (resid   65 and name CA   )
       (resid   65 and name C    ) (resid   66 and name N    )    1.0  156.4   20.0 2
assign (resid   65 and name C    ) (resid   66 and name N    )
       (resid   66 and name CA   ) (resid   66 and name C    )    1.0  -90.4   43.6 2
assign (resid   66 and name N    ) (resid   66 and name CA   )
       (resid   66 and name C    ) (resid   67 and name N    )    1.0  139.3   50.1 2
assign (resid   67 and name C    ) (resid   68 and name N    )
       (resid   68 and name CA   ) (resid   68 and name C    )    1.0  -97.2   55.0 2
assign (resid   68 and name N    ) (resid   68 and name CA   )
       (resid   68 and name C    ) (resid   69 and name N    )    1.0  166.7   33.8 2
assign (resid   68 and name C    ) (resid   69 and name N    )
       (resid   69 and name CA   ) (resid   69 and name C    )    1.0  -60.2   20.0 2
assign (resid   69 and name N    ) (resid   69 and name CA   )
       (resid   69 and name C    ) (resid   70 and name N    )    1.0  -37.6   20.0 2
assign (resid   69 and name C    ) (resid   70 and name N    )
       (resid   70 and name CA   ) (resid   70 and name C    )    1.0  -67.8   20.0 2
assign (resid   70 and name N    ) (resid   70 and name CA   )
       (resid   70 and name C    ) (resid   71 and name N    )    1.0  -37.6   20.0 2
assign (resid   70 and name C    ) (resid   71 and name N    )
       (resid   71 and name CA   ) (resid   71 and name C    )    1.0  -67.1   20.0 2
assign (resid   71 and name N    ) (resid   71 and name CA   )
       (resid   71 and name C    ) (resid   72 and name N    )    1.0  -40.0   20.0 2
assign (resid   71 and name C    ) (resid   72 and name N    )
       (resid   72 and name CA   ) (resid   72 and name C    )    1.0  -64.7   20.0 2
assign (resid   72 and name N    ) (resid   72 and name CA   )
       (resid   72 and name C    ) (resid   73 and name N    )    1.0  -44.1   30.0 2
assign (resid   72 and name C    ) (resid   73 and name N    )
       (resid   73 and name CA   ) (resid   73 and name C    )    1.0  -63.3   20.0 2
assign (resid   73 and name N    ) (resid   73 and name CA   )
       (resid   73 and name C    ) (resid   74 and name N    )    1.0  -42.8   20.0 2
assign (resid   73 and name C    ) (resid   74 and name N    )
       (resid   74 and name CA   ) (resid   74 and name C    )    1.0  -65.0   20.0 2
assign (resid   74 and name N    ) (resid   74 and name CA   )
       (resid   74 and name C    ) (resid   75 and name N    )    1.0  -42.6   20.0 2
assign (resid   74 and name C    ) (resid   75 and name N    )
       (resid   75 and name CA   ) (resid   75 and name C    )    1.0  -63.1   20.0 2
assign (resid   75 and name N    ) (resid   75 and name CA   )
       (resid   75 and name C    ) (resid   76 and name N    )    1.0  -41.1   20.0 2
assign (resid   75 and name C    ) (resid   76 and name N    )
       (resid   76 and name CA   ) (resid   76 and name C    )    1.0  -64.8   20.0 2
assign (resid   76 and name N    ) (resid   76 and name CA   )
       (resid   76 and name C    ) (resid   77 and name N    )    1.0  -39.2   20.0 2
assign (resid   76 and name C    ) (resid   77 and name N    )
       (resid   77 and name CA   ) (resid   77 and name C    )    1.0  -68.0   20.0 2
assign (resid   77 and name N    ) (resid   77 and name CA   )
       (resid   77 and name C    ) (resid   78 and name N    )    1.0  -41.8   20.0 2
assign (resid   77 and name C    ) (resid   78 and name N    )
       (resid   78 and name CA   ) (resid   78 and name C    )    1.0  -63.2   20.0 2
assign (resid   78 and name N    ) (resid   78 and name CA   )
       (resid   78 and name C    ) (resid   79 and name N    )    1.0  -43.7   20.0 2
assign (resid   78 and name C    ) (resid   79 and name N    )
       (resid   79 and name CA   ) (resid   79 and name C    )    1.0  -63.2   20.0 2
assign (resid   79 and name N    ) (resid   79 and name CA   )
       (resid   79 and name C    ) (resid   80 and name N    )    1.0  -41.1   20.0 2
assign (resid   79 and name C    ) (resid   80 and name N    )
       (resid   80 and name CA   ) (resid   80 and name C    )    1.0  -63.4   20.0 2
assign (resid   80 and name N    ) (resid   80 and name CA   )
       (resid   80 and name C    ) (resid   81 and name N    )    1.0  -41.6   20.0 2
assign (resid   80 and name C    ) (resid   81 and name N    )
       (resid   81 and name CA   ) (resid   81 and name C    )    1.0  -65.8   20.0 2
assign (resid   81 and name N    ) (resid   81 and name CA   )
       (resid   81 and name C    ) (resid   82 and name N    )    1.0  -33.6   23.0 2
assign (resid   81 and name C    ) (resid   82 and name N    )
       (resid   82 and name CA   ) (resid   82 and name C    )    1.0  -89.2   35.1 2
assign (resid   82 and name N    ) (resid   82 and name CA   )
       (resid   82 and name C    ) (resid   83 and name N    )    1.0  -18.1   45.0 2
###################################################################
#       Chemical Shift Ambiguity Index Value Definitions          #
#                                                                 #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains.                              #
#                                                                 #
#   Index Value            Definition                             #
#                                                                 #
#      1             Unique (including isolated methyl protons,   #
#                         geminal atoms, and geminal methyl       #
#                         groups with identical chemical shifts)  #
#                         (e.g. ILE HD11, HD12, HD13 protons)     #
#      2             Ambiguity of geminal atoms or geminal methyl #
#                         proton groups (e.g. ASP HB2 and HB3     #
#                         protons, LEU CD1 and CD2 carbons, or    #
#                         LEU HD11, HD12, HD13 and HD21, HD22,    #
#                         HD23 methyl protons)                    #
#      3             Aromatic atoms on opposite sides of          #
#                         symmetrical rings (e.g. TYR HE1 and HE2 #
#                         protons)                                #
#      4             Intraresidue ambiguities (e.g. LYS HG and    #
#                         HD protons or TRP HZ2 and HZ3 protons)  #
#      5             Interresidue ambiguities (LYS 12 vs. LYS 27) #
#      6             Intermolecular ambiguities (e.g. ASP 31 CA   #
#                         in monomer 1 and ASP 31 CA in monomer 2 #
#                         of an asymmetrical homodimer, duplex    #
#                         DNA assignments, or other assignments   #
#                         that may apply to atoms in one or more  #
#                         molecule in the molecular assembly)     #
#      9             Ambiguous, specific ambiguity not defined    #
#                                                                 #
###################################################################
loop_
    _RDC.ID
    _RDC.RDC_code
    _RDC.Entity_assembly_ID_1
    _RDC.Comp_index_ID_1
    _RDC.Comp_ID_1
    _RDC.Atom_ID_1
    _RDC.Atom_type_1
    _RDC.Atom_isotope_number_1
    _RDC.Ambiguity_code_1
    _RDC.Entity_assembly_ID_2
    _RDC.Comp_index_ID_2
    _RDC.Comp_ID_2
    _RDC.Atom_ID_2
    _RDC.Atom_type_2
    _RDC.Atom_isotope_number_2
    _RDC.Ambiguity_code_2
    _RDC.Val
    _RDC.Val_min
    _RDC.Val_max
    _RDC.Val_err

    1   ?  ?  13  F  N  ?  ?  ?  ?  13  F  H  ?  ?  ?  8.3567    ?  ?  1.5  
    2   ?  ?  14  V  N  ?  ?  ?  ?  14  V  H  ?  ?  ?  19.3588   ?  ?  1.5  
    3   ?  ?  15  D  N  ?  ?  ?  ?  15  D  H  ?  ?  ?  13.5331   ?  ?  1.5  
    4   ?  ?  16  G  N  ?  ?  ?  ?  16  G  H  ?  ?  ?  -11.3856  ?  ?  1.5  
    5   ?  ?  17  E  N  ?  ?  ?  ?  17  E  H  ?  ?  ?  12.0833   ?  ?  1.5  
    6   ?  ?  18  R  N  ?  ?  ?  ?  18  R  H  ?  ?  ?  -9.0613   ?  ?  1.5  
    7   ?  ?  19  V  N  ?  ?  ?  ?  19  V  H  ?  ?  ?  -9.5501   ?  ?  1.5  
    8   ?  ?  20  L  N  ?  ?  ?  ?  20  L  H  ?  ?  ?  -5.0115   ?  ?  1.5  
    9   ?  ?  21  C  N  ?  ?  ?  ?  21  C  H  ?  ?  ?  2.7243    ?  ?  1.5  
    10  ?  ?  23  H  N  ?  ?  ?  ?  23  H  H  ?  ?  ?  16.7296   ?  ?  1.5  
    11  ?  ?  26  L  N  ?  ?  ?  ?  26  L  H  ?  ?  ?  7.4527    ?  ?  1.5  
    12  ?  ?  27  I  N  ?  ?  ?  ?  27  I  H  ?  ?  ?  18.3676   ?  ?  1.5  
    13  ?  ?  29  E  N  ?  ?  ?  ?  29  E  H  ?  ?  ?  4.6623    ?  ?  1.5  
    14  ?  ?  30  A  N  ?  ?  ?  ?  30  A  H  ?  ?  ?  -9.4354   ?  ?  1.5  
    15  ?  ?  31  K  N  ?  ?  ?  ?  31  K  H  ?  ?  ?  -6.881    ?  ?  1.5  
    16  ?  ?  32  V  N  ?  ?  ?  ?  32  V  H  ?  ?  ?  -3.787    ?  ?  1.5  
    17  ?  ?  33  L  N  ?  ?  ?  ?  33  L  H  ?  ?  ?  -11.4056  ?  ?  1.5  
    18  ?  ?  34  K  N  ?  ?  ?  ?  34  K  H  ?  ?  ?  -1.1476   ?  ?  1.5  
    19  ?  ?  35  T  N  ?  ?  ?  ?  35  T  H  ?  ?  ?  -0.0888   ?  ?  1.5  
    20  ?  ?  43  E  N  ?  ?  ?  ?  43  E  H  ?  ?  ?  9.7357    ?  ?  1.5  
    21  ?  ?  44  Y  N  ?  ?  ?  ?  44  Y  H  ?  ?  ?  -1.8942   ?  ?  1.5  
    22  ?  ?  45  Y  N  ?  ?  ?  ?  45  Y  H  ?  ?  ?  -7.186    ?  ?  1.5  
    23  ?  ?  46  I  N  ?  ?  ?  ?  46  I  H  ?  ?  ?  -11.0597  ?  ?  1.5  
    24  ?  ?  47  H  N  ?  ?  ?  ?  47  H  H  ?  ?  ?  -10.008   ?  ?  1.5  
    25  ?  ?  48  Y  N  ?  ?  ?  ?  48  Y  H  ?  ?  ?  -3.8172   ?  ?  1.5  
    26  ?  ?  49  A  N  ?  ?  ?  ?  49  A  H  ?  ?  ?  -7.3511   ?  ?  1.5  
    27  ?  ?  51  W  N  ?  ?  ?  ?  51  W  H  ?  ?  ?  -0.5901   ?  ?  1.5  
    28  ?  ?  53  K  N  ?  ?  ?  ?  53  K  H  ?  ?  ?  -5.0533   ?  ?  1.5  
    29  ?  ?  54  N  N  ?  ?  ?  ?  54  N  H  ?  ?  ?  9.9081    ?  ?  1.5  
    30  ?  ?  55  W  N  ?  ?  ?  ?  55  W  H  ?  ?  ?  0.7433    ?  ?  1.5  
    31  ?  ?  56  D  N  ?  ?  ?  ?  56  D  H  ?  ?  ?  -7.2579   ?  ?  1.5  
    32  ?  ?  57  E  N  ?  ?  ?  ?  57  E  H  ?  ?  ?  -2.1728   ?  ?  1.5  
    33  ?  ?  58  W  N  ?  ?  ?  ?  58  W  H  ?  ?  ?  -1.728    ?  ?  1.5  
    34  ?  ?  59  V  N  ?  ?  ?  ?  59  V  H  ?  ?  ?  -12.4656  ?  ?  1.5  
    35  ?  ?  61  E  N  ?  ?  ?  ?  61  E  H  ?  ?  ?  19.8864   ?  ?  1.5  
    36  ?  ?  63  R  N  ?  ?  ?  ?  63  R  H  ?  ?  ?  16.8894   ?  ?  1.5  
    37  ?  ?  65  L  N  ?  ?  ?  ?  65  L  H  ?  ?  ?  -7.6953   ?  ?  1.5  
    38  ?  ?  66  K  N  ?  ?  ?  ?  66  K  H  ?  ?  ?  -9.9134   ?  ?  1.5  
    39  ?  ?  67  Y  N  ?  ?  ?  ?  67  Y  H  ?  ?  ?  9.6706    ?  ?  1.5  
    40  ?  ?  69  D  N  ?  ?  ?  ?  69  D  H  ?  ?  ?  -2.1784   ?  ?  1.5  
    41  ?  ?  70  D  N  ?  ?  ?  ?  70  D  H  ?  ?  ?  14.2888   ?  ?  1.5  
    42  ?  ?  71  N  N  ?  ?  ?  ?  71  N  H  ?  ?  ?  10.1991   ?  ?  1.5  
    43  ?  ?  72  V  N  ?  ?  ?  ?  72  V  H  ?  ?  ?  -3.0781   ?  ?  1.5  
    44  ?  ?  73  K  N  ?  ?  ?  ?  73  K  H  ?  ?  ?  1.9769    ?  ?  1.5  
    45  ?  ?  74  R  N  ?  ?  ?  ?  74  R  H  ?  ?  ?  14.3848   ?  ?  1.5  
    46  ?  ?  75  R  N  ?  ?  ?  ?  75  R  H  ?  ?  ?  4.8643    ?  ?  1.5  
    47  ?  ?  76  Q  N  ?  ?  ?  ?  76  Q  H  ?  ?  ?  5.1496    ?  ?  1.5  
    48  ?  ?  77  E  N  ?  ?  ?  ?  77  E  H  ?  ?  ?  12.4568   ?  ?  1.5  
    49  ?  ?  78  L  N  ?  ?  ?  ?  78  L  H  ?  ?  ?  13.972    ?  ?  1.5  
    50  ?  ?  79  A  N  ?  ?  ?  ?  79  A  H  ?  ?  ?  0.7955    ?  ?  1.5  
    51  ?  ?  80  R  N  ?  ?  ?  ?  80  R  H  ?  ?  ?  1.5622    ?  ?  1.5  
    52  ?  ?  81  Q  N  ?  ?  ?  ?  81  Q  H  ?  ?  ?  9.5784    ?  ?  1.5  

stop_
###################################################################
#       Chemical Shift Ambiguity Index Value Definitions          #
#                                                                 #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains.                              #
#                                                                 #
#   Index Value            Definition                             #
#                                                                 #
#      1             Unique (including isolated methyl protons,   #
#                         geminal atoms, and geminal methyl       #
#                         groups with identical chemical shifts)  #
#                         (e.g. ILE HD11, HD12, HD13 protons)     #
#      2             Ambiguity of geminal atoms or geminal methyl #
#                         proton groups (e.g. ASP HB2 and HB3     #
#                         protons, LEU CD1 and CD2 carbons, or    #
#                         LEU HD11, HD12, HD13 and HD21, HD22,    #
#                         HD23 methyl protons)                    #
#      3             Aromatic atoms on opposite sides of          #
#                         symmetrical rings (e.g. TYR HE1 and HE2 #
#                         protons)                                #
#      4             Intraresidue ambiguities (e.g. LYS HG and    #
#                         HD protons or TRP HZ2 and HZ3 protons)  #
#      5             Interresidue ambiguities (LYS 12 vs. LYS 27) #
#      6             Intermolecular ambiguities (e.g. ASP 31 CA   #
#                         in monomer 1 and ASP 31 CA in monomer 2 #
#                         of an asymmetrical homodimer, duplex    #
#                         DNA assignments, or other assignments   #
#                         that may apply to atoms in one or more  #
#                         molecule in the molecular assembly)     #
#      9             Ambiguous, specific ambiguity not defined    #
#                                                                 #
###################################################################
loop_
    _RDC.ID
    _RDC.RDC_code
    _RDC.Entity_assembly_ID_1
    _RDC.Comp_index_ID_1
    _RDC.Comp_ID_1
    _RDC.Atom_ID_1
    _RDC.Atom_type_1
    _RDC.Atom_isotope_number_1
    _RDC.Ambiguity_code_1
    _RDC.Entity_assembly_ID_2
    _RDC.Comp_index_ID_2
    _RDC.Comp_ID_2
    _RDC.Atom_ID_2
    _RDC.Atom_type_2
    _RDC.Atom_isotope_number_2
    _RDC.Ambiguity_code_2
    _RDC.Val
    _RDC.Val_min
    _RDC.Val_max
    _RDC.Val_err

    1   ?  ?  13  F  N  ?  ?  ?  ?  13  F  H  ?  ?  ?  0.7764    ?  ?  1.5  
    2   ?  ?  14  V  N  ?  ?  ?  ?  14  V  H  ?  ?  ?  4.8647    ?  ?  1.5  
    3   ?  ?  15  D  N  ?  ?  ?  ?  15  D  H  ?  ?  ?  11.6252   ?  ?  1.5  
    4   ?  ?  16  G  N  ?  ?  ?  ?  16  G  H  ?  ?  ?  13.046    ?  ?  1.5  
    5   ?  ?  17  E  N  ?  ?  ?  ?  17  E  H  ?  ?  ?  -3.5281   ?  ?  1.5  
    6   ?  ?  18  R  N  ?  ?  ?  ?  18  R  H  ?  ?  ?  12.3442   ?  ?  1.5  
    7   ?  ?  19  V  N  ?  ?  ?  ?  19  V  H  ?  ?  ?  -2.515    ?  ?  1.5  
    8   ?  ?  20  L  N  ?  ?  ?  ?  20  L  H  ?  ?  ?  -12.2812  ?  ?  1.5  
    9   ?  ?  21  C  N  ?  ?  ?  ?  21  C  H  ?  ?  ?  -9.0834   ?  ?  1.5  
    10  ?  ?  22  F  N  ?  ?  ?  ?  22  F  H  ?  ?  ?  3.1524    ?  ?  1.5  
    11  ?  ?  23  H  N  ?  ?  ?  ?  23  H  H  ?  ?  ?  10.2308   ?  ?  1.5  
    12  ?  ?  27  I  N  ?  ?  ?  ?  27  I  H  ?  ?  ?  8.9478    ?  ?  1.5  
    13  ?  ?  28  Y  N  ?  ?  ?  ?  28  Y  H  ?  ?  ?  1.2506    ?  ?  1.5  
    14  ?  ?  29  E  N  ?  ?  ?  ?  29  E  H  ?  ?  ?  6.3875    ?  ?  1.5  
    15  ?  ?  30  A  N  ?  ?  ?  ?  30  A  H  ?  ?  ?  2.083     ?  ?  1.5  
    16  ?  ?  31  K  N  ?  ?  ?  ?  31  K  H  ?  ?  ?  12.9065   ?  ?  1.5  
    17  ?  ?  32  V  N  ?  ?  ?  ?  32  V  H  ?  ?  ?  8.2605    ?  ?  1.5  
    18  ?  ?  33  L  N  ?  ?  ?  ?  33  L  H  ?  ?  ?  3.2512    ?  ?  1.5  
    19  ?  ?  34  K  N  ?  ?  ?  ?  34  K  H  ?  ?  ?  5.4761    ?  ?  1.5  
    20  ?  ?  35  T  N  ?  ?  ?  ?  35  T  H  ?  ?  ?  8.2437    ?  ?  1.5  
    21  ?  ?  36  K  N  ?  ?  ?  ?  36  K  H  ?  ?  ?  9.8901    ?  ?  1.5  
    22  ?  ?  44  Y  N  ?  ?  ?  ?  44  Y  H  ?  ?  ?  14.4802   ?  ?  1.5  
    23  ?  ?  45  Y  N  ?  ?  ?  ?  45  Y  H  ?  ?  ?  19.385    ?  ?  1.5  
    24  ?  ?  46  I  N  ?  ?  ?  ?  46  I  H  ?  ?  ?  2.375     ?  ?  1.5  
    25  ?  ?  47  H  N  ?  ?  ?  ?  47  H  H  ?  ?  ?  13.595    ?  ?  1.5  
    26  ?  ?  48  Y  N  ?  ?  ?  ?  48  Y  H  ?  ?  ?  9.7368    ?  ?  1.5  
    27  ?  ?  49  A  N  ?  ?  ?  ?  49  A  H  ?  ?  ?  -16.2621  ?  ?  1.5  
    28  ?  ?  51  W  N  ?  ?  ?  ?  51  W  H  ?  ?  ?  11.8612   ?  ?  1.5  
    29  ?  ?  54  N  N  ?  ?  ?  ?  54  N  H  ?  ?  ?  -8.4349   ?  ?  1.5  
    30  ?  ?  59  V  N  ?  ?  ?  ?  59  V  H  ?  ?  ?  9.6753    ?  ?  1.5  
    31  ?  ?  61  E  N  ?  ?  ?  ?  61  E  H  ?  ?  ?  12.3705   ?  ?  1.5  
    32  ?  ?  63  R  N  ?  ?  ?  ?  63  R  H  ?  ?  ?  8.9377    ?  ?  1.5  
    33  ?  ?  65  L  N  ?  ?  ?  ?  65  L  H  ?  ?  ?  -17.0113  ?  ?  1.5  
    34  ?  ?  66  K  N  ?  ?  ?  ?  66  K  H  ?  ?  ?  -26.8654  ?  ?  1.5  
    35  ?  ?  67  Y  N  ?  ?  ?  ?  67  Y  H  ?  ?  ?  13.166    ?  ?  1.5  
    36  ?  ?  70  D  N  ?  ?  ?  ?  70  D  H  ?  ?  ?  19.9376   ?  ?  1.5  
    37  ?  ?  71  N  N  ?  ?  ?  ?  71  N  H  ?  ?  ?  17.0746   ?  ?  1.5  
    38  ?  ?  72  V  N  ?  ?  ?  ?  72  V  H  ?  ?  ?  18.3394   ?  ?  1.5  
    39  ?  ?  73  K  N  ?  ?  ?  ?  73  K  H  ?  ?  ?  18.958    ?  ?  1.5  
    40  ?  ?  74  R  N  ?  ?  ?  ?  74  R  H  ?  ?  ?  22.6443   ?  ?  1.5  
    41  ?  ?  75  R  N  ?  ?  ?  ?  75  R  H  ?  ?  ?  17.342    ?  ?  1.5  
    42  ?  ?  77  E  N  ?  ?  ?  ?  77  E  H  ?  ?  ?  19.865    ?  ?  1.5  
    43  ?  ?  78  L  N  ?  ?  ?  ?  78  L  H  ?  ?  ?  18.6673   ?  ?  1.5  
    44  ?  ?  79  A  N  ?  ?  ?  ?  79  A  H  ?  ?  ?  16.2432   ?  ?  1.5  
    45  ?  ?  80  R  N  ?  ?  ?  ?  80  R  H  ?  ?  ?  12.8719   ?  ?  1.5  

stop_

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1 -23.624 -13.005  -3.109
    2    H2   MET   1           2H       MET   1 -22.722 -14.056  -2.128
    3    H3   MET   1           3H       MET   1 -22.687 -14.226  -3.817
    4    HA   MET   1           HA       MET   1 -21.300 -12.477  -4.138
    5    HB2  MET   1           1HB      MET   1 -22.865 -10.894  -3.024
    6    HB3  MET   1           2HB      MET   1 -22.250 -11.392  -1.454
    7    HG2  MET   1           1HG      MET   1 -20.004 -10.550  -2.044
    8    HG3  MET   1           2HG      MET   1 -20.572 -10.116  -3.655
    9    HE1  MET   1           3HE      MET   1 -22.585  -6.971  -3.269
   10    HE2  MET   1           1HE      MET   1 -22.792  -8.592  -3.947
   11    HE3  MET   1           2HE      MET   1 -21.281  -7.722  -4.181
   12    H    ASN   2           H        ASN   2 -19.723 -14.091  -3.998
   13    HA   ASN   2           HA       ASN   2 -17.901 -13.911  -1.754
   14    HB2  ASN   2           1HB      ASN   2 -19.591 -15.520  -0.879
   15    HB3  ASN   2           2HB      ASN   2 -19.308 -16.565  -2.264
   16   HD21  ASN   2          2HD2      ASN   2 -17.528 -15.029   0.470
   17   HD22  ASN   2          1HD2      ASN   2 -16.410 -16.293   0.645
   18    H    TYR   3           H        TYR   3 -15.888 -14.185  -2.523
   19    HA   TYR   3           HA       TYR   3 -15.377 -14.747  -5.283
   20    HB2  TYR   3           1HB      TYR   3 -13.469 -14.610  -2.911
   21    HB3  TYR   3           2HB      TYR   3 -12.984 -14.597  -4.609
   22    HD1  TYR   3           HD2      TYR   3 -13.481 -12.626  -6.066
   23    HD2  TYR   3           HD1      TYR   3 -14.573 -12.623  -1.892
   24    HE1  TYR   3           HE2      TYR   3 -13.865 -10.178  -6.159
   25    HE2  TYR   3           HE1      TYR   3 -14.955 -10.175  -2.006
   26    HH   TYR   3           HH       TYR   3 -15.167  -8.475  -4.931
   27    H    SER   4           H        SER   4 -14.737 -16.604  -6.264
   28    HA   SER   4           HA       SER   4 -15.246 -19.140  -5.089
   29    HB2  SER   4           1HB      SER   4 -15.400 -18.724  -7.519
   30    HB3  SER   4           2HB      SER   4 -13.657 -18.472  -7.592
   31    HG   SER   4           HG       SER   4 -14.748 -20.700  -7.956
   32    H    THR   5           H        THR   5 -12.496 -17.097  -5.029
   33    HA   THR   5           HA       THR   5 -10.388 -18.970  -4.782
   34    HB   THR   5           HB       THR   5  -9.126 -17.107  -3.778
   35    HG1  THR   5           HG1      THR   5 -11.663 -16.335  -3.138
   36   HG21  THR   5          3HG2      THR   5  -9.510 -17.055  -6.232
   37   HG22  THR   5          1HG2      THR   5  -9.449 -15.425  -5.559
   38   HG23  THR   5          2HG2      THR   5 -11.002 -16.147  -5.976
   39    H    GLY   6           H        GLY   6 -12.442 -17.414  -2.334
   40    HA2  GLY   6           1HA      GLY   6 -12.488 -19.603  -0.557
   41    HA3  GLY   6           2HA      GLY   6 -11.212 -18.507  -0.031
   42    H    THR   7           H        THR   7 -12.719 -18.488   1.878
   43    HA   THR   7           HA       THR   7 -15.249 -17.231   1.829
   44    HB   THR   7           HB       THR   7 -13.243 -17.294   4.121
   45    HG1  THR   7           HG1      THR   7 -13.564 -19.352   3.501
   46   HG21  THR   7          3HG2      THR   7 -15.297 -17.251   5.532
   47   HG22  THR   7          1HG2      THR   7 -16.280 -17.045   4.084
   48   HG23  THR   7          2HG2      THR   7 -15.148 -15.782   4.570
   49    H    ASP   8           H        ASP   8 -15.861 -15.123   1.834
   50    HA   ASP   8           HA       ASP   8 -14.054 -13.072   1.046
   51    HB2  ASP   8           1HB      ASP   8 -16.014 -11.568   1.318
   52    HB3  ASP   8           2HB      ASP   8 -16.428 -13.029   0.423
   53    H    ALA   9           H        ALA   9 -12.519 -12.291   2.372
   54    HA   ALA   9           HA       ALA   9 -12.604 -12.303   5.217
   55    HB1  ALA   9           3HB      ALA   9 -10.512 -12.290   3.897
   56    HB2  ALA   9           1HB      ALA   9 -10.552 -10.936   5.029
   57    HB3  ALA   9           2HB      ALA   9 -10.883 -10.669   3.315
   58    H    ASN  10           H        ASN  10 -12.937 -10.607   6.674
   59    HA   ASN  10           HA       ASN  10 -14.979  -8.726   6.079
   60    HB2  ASN  10           1HB      ASN  10 -13.024  -8.782   8.411
   61    HB3  ASN  10           2HB      ASN  10 -14.529  -7.863   8.357
   62   HD21  ASN  10          2HD2      ASN  10 -13.564 -10.320  10.030
   63   HD22  ASN  10          1HD2      ASN  10 -14.856 -11.412   9.887
   64    H    THR  11           H        THR  11 -11.456  -8.412   6.361
   65    HA   THR  11           HA       THR  11 -11.328  -5.581   6.089
   66    HB   THR  11           HB       THR  11  -8.933  -5.983   5.532
   67    HG1  THR  11           HG1      THR  11  -8.419  -7.812   4.687
   68   HG21  THR  11          3HG2      THR  11  -8.326  -7.176   7.619
   69   HG22  THR  11          1HG2      THR  11  -9.989  -7.739   7.782
   70   HG23  THR  11          2HG2      THR  11  -9.626  -6.016   7.906
   71    H    LEU  12           H        LEU  12 -10.838  -4.325   4.283
   72    HA   LEU  12           HA       LEU  12 -12.032  -5.209   1.771
   73    HB2  LEU  12           1HB      LEU  12 -10.604  -2.580   2.360
   74    HB3  LEU  12           2HB      LEU  12 -11.753  -2.899   1.063
   75    HG   LEU  12           HG       LEU  12 -12.387  -2.913   4.049
   76   HD11  LEU  12          1HD1      LEU  12 -13.697  -0.874   3.549
   77   HD12  LEU  12          2HD1      LEU  12 -13.171  -0.946   1.868
   78   HD13  LEU  12          3HD1      LEU  12 -11.994  -0.646   3.149
   79   HD21  LEU  12          3HD2      LEU  12 -13.910  -4.484   3.052
   80   HD22  LEU  12          1HD2      LEU  12 -14.137  -3.485   1.612
   81   HD23  LEU  12          2HD2      LEU  12 -14.825  -2.990   3.164
   82    H    PHE  13           H        PHE  13  -8.998  -5.541   3.111
   83    HA   PHE  13           HA       PHE  13  -7.616  -5.659   0.454
   84    HB2  PHE  13           1HB      PHE  13  -6.481  -5.165   3.232
   85    HB3  PHE  13           2HB      PHE  13  -5.532  -5.279   1.750
   86    HD1  PHE  13           HD1      PHE  13  -5.752  -3.539  -0.049
   87    HD2  PHE  13           HD2      PHE  13  -7.836  -3.139   3.708
   88    HE1  PHE  13           HE1      PHE  13  -6.215  -1.156  -0.548
   89    HE2  PHE  13           HE2      PHE  13  -8.284  -0.754   3.199
   90    HZ   PHE  13           HZ       PHE  13  -7.478   0.236   1.072
   91    H    VAL  14           H        VAL  14  -6.378  -7.433  -0.019
   92    HA   VAL  14           HA       VAL  14  -6.439  -9.795   1.824
   93    HB   VAL  14           HB       VAL  14  -6.867 -11.244  -0.133
   94   HG11  VAL  14          1HG1      VAL  14  -9.259 -10.647  -0.448
   95   HG12  VAL  14          2HG1      VAL  14  -8.945  -9.037   0.199
   96   HG13  VAL  14          3HG1      VAL  14  -8.781 -10.451   1.238
   97   HG21  VAL  14          3HG2      VAL  14  -7.104  -8.599  -1.650
   98   HG22  VAL  14          1HG2      VAL  14  -7.690 -10.140  -2.283
   99   HG23  VAL  14          2HG2      VAL  14  -5.976  -9.919  -1.972
  100    H    ASP  15           H        ASP  15  -4.806 -11.362   1.411
  101    HA   ASP  15           HA       ASP  15  -2.223 -10.267   1.072
  102    HB2  ASP  15           1HB      ASP  15  -1.474 -12.619   1.273
  103    HB3  ASP  15           2HB      ASP  15  -2.716 -12.250   2.467
  104    H    GLY  16           H        GLY  16  -0.799 -10.312  -0.609
  105    HA2  GLY  16           1HA      GLY  16   0.112 -10.847  -2.694
  106    HA3  GLY  16           2HA      GLY  16  -1.332 -11.752  -3.113
  107    H    GLU  17           H        GLU  17  -2.592  -9.051  -1.936
  108    HA   GLU  17           HA       GLU  17  -3.217  -7.920  -4.513
  109    HB2  GLU  17           1HB      GLU  17  -4.785  -7.912  -2.579
  110    HB3  GLU  17           2HB      GLU  17  -3.747  -6.776  -1.737
  111    HG2  GLU  17           1HG      GLU  17  -4.089  -5.113  -3.554
  112    HG3  GLU  17           2HG      GLU  17  -5.081  -6.269  -4.433
  113    H    ARG  18           H        ARG  18  -2.582  -5.974  -5.385
  114    HA   ARG  18           HA       ARG  18  -0.031  -4.801  -4.413
  115    HB2  ARG  18           1HB      ARG  18  -0.184  -5.585  -6.773
  116    HB3  ARG  18           2HB      ARG  18  -1.481  -4.428  -7.069
  117    HG2  ARG  18           1HG      ARG  18   0.031  -2.540  -6.568
  118    HG3  ARG  18           2HG      ARG  18   1.324  -3.657  -6.138
  119    HD2  ARG  18           1HD      ARG  18   0.054  -3.480  -8.893
  120    HD3  ARG  18           2HD      ARG  18   1.595  -2.746  -8.444
  121    HE   ARG  18           HE       ARG  18   1.719  -5.469  -7.767
  122   HH11  ARG  18          1HH2      ARG  18   1.477  -3.460 -10.597
  123   HH12  ARG  18          2HH2      ARG  18   2.290  -4.593 -11.624
  124   HH21  ARG  18          1HH1      ARG  18   2.781  -6.934  -9.118
  125   HH22  ARG  18          2HH1      ARG  18   3.027  -6.552 -10.791
  126    H    VAL  19           H        VAL  19  -0.033  -2.855  -3.449
  127    HA   VAL  19           HA       VAL  19  -2.282  -0.932  -3.854
  128    HB   VAL  19           HB       VAL  19  -2.397  -0.480  -1.455
  129   HG11  VAL  19          1HG1      VAL  19  -3.416  -2.598  -0.696
  130   HG12  VAL  19          2HG1      VAL  19  -2.619  -3.470  -2.000
  131   HG13  VAL  19          3HG1      VAL  19  -3.858  -2.271  -2.372
  132   HG21  VAL  19          3HG2      VAL  19  -0.174  -2.574  -1.253
  133   HG22  VAL  19          1HG2      VAL  19  -1.159  -2.111   0.135
  134   HG23  VAL  19          2HG2      VAL  19  -0.146  -0.916  -0.664
  135    H    LEU  20           H        LEU  20  -1.719   1.197  -2.812
  136    HA   LEU  20           HA       LEU  20   1.088   1.938  -3.514
  137    HB2  LEU  20           1HB      LEU  20  -1.413   3.671  -3.345
  138    HB3  LEU  20           2HB      LEU  20   0.174   4.158  -3.949
  139    HG   LEU  20           HG       LEU  20  -1.607   2.018  -5.199
  140   HD11  LEU  20          1HD1      LEU  20  -1.919   3.640  -7.029
  141   HD12  LEU  20          2HD1      LEU  20  -0.947   4.823  -6.150
  142   HD13  LEU  20          3HD1      LEU  20  -2.494   4.288  -5.495
  143   HD21  LEU  20          3HD2      LEU  20   0.109   2.339  -7.165
  144   HD22  LEU  20          1HD2      LEU  20   0.610   1.367  -5.787
  145   HD23  LEU  20          2HD2      LEU  20   1.171   3.034  -5.938
  146    H    CYS  21           H        CYS  21   2.338   3.023  -2.109
  147    HA   CYS  21           HA       CYS  21   1.313   3.545   0.663
  148    HB2  CYS  21           1HB      CYS  21   2.849   1.594   0.496
  149    HB3  CYS  21           2HB      CYS  21   4.093   2.642  -0.189
  150    HG   CYS  21           HG       CYS  21   4.281   3.879   2.065
  151    H    PHE  22           H        PHE  22   1.163   5.694   0.908
  152    HA   PHE  22           HA       PHE  22   3.157   7.518  -0.352
  153    HB2  PHE  22           1HB      PHE  22   1.510   9.284   0.062
  154    HB3  PHE  22           2HB      PHE  22   0.784   7.973  -0.860
  155    HD1  PHE  22           HD2      PHE  22  -0.900   6.447   0.189
  156    HD2  PHE  22           HD1      PHE  22   0.841   9.699   2.425
  157    HE1  PHE  22           HE2      PHE  22  -2.669   6.218   1.913
  158    HE2  PHE  22           HE1      PHE  22  -0.934   9.461   4.140
  159    HZ   PHE  22           HZ       PHE  22  -2.687   7.729   3.882
  160    H    HIS  23           H        HIS  23   4.101   9.173   0.910
  161    HA   HIS  23           HA       HIS  23   3.817   9.294   3.776
  162    HB2  HIS  23           1HB      HIS  23   5.135   7.162   3.494
  163    HB3  HIS  23           2HB      HIS  23   6.412   8.083   2.705
  164    HD1  HIS  23           HD1      HIS  23   4.549   7.982   6.036
  165    HD2  HIS  23           HD2      HIS  23   8.218   9.227   4.496
  166    HE1  HIS  23           HE1      HIS  23   5.957   8.684   8.020
  167    HE2  HIS  23           HE2      HIS  23   8.198   9.446   7.098
  168    H    GLY  24           H        GLY  24   3.908  10.967   1.318
  169    HA2  GLY  24           1HA      GLY  24   5.146  13.268   2.369
  170    HA3  GLY  24           2HA      GLY  24   6.263  12.515   1.239
  171    HA   PRO  25           HA       PRO  25   3.360  15.166  -1.254
  172    HB2  PRO  25           1HB      PRO  25   5.119  16.528  -2.793
  173    HB3  PRO  25           2HB      PRO  25   4.924  16.928  -1.066
  174    HG2  PRO  25           1HG      PRO  25   7.040  15.199  -2.359
  175    HG3  PRO  25           2HG      PRO  25   7.253  16.531  -1.196
  176    HD2  PRO  25           1HD      PRO  25   7.197  13.880  -0.414
  177    HD3  PRO  25           2HD      PRO  25   6.621  15.181   0.656
  178    H    LEU  26           H        LEU  26   5.086  12.447  -1.848
  179    HA   LEU  26           HA       LEU  26   3.939  12.113  -4.583
  180    HB2  LEU  26           1HB      LEU  26   6.775  11.565  -3.674
  181    HB3  LEU  26           2HB      LEU  26   6.105  10.666  -5.032
  182    HG   LEU  26           HG       LEU  26   6.018  13.732  -5.045
  183   HD11  LEU  26          1HD1      LEU  26   8.315  11.995  -6.021
  184   HD12  LEU  26          2HD1      LEU  26   8.377  13.126  -4.670
  185   HD13  LEU  26          3HD1      LEU  26   8.153  13.730  -6.307
  186   HD21  LEU  26          3HD2      LEU  26   4.688  12.462  -6.781
  187   HD22  LEU  26          1HD2      LEU  26   6.165  11.662  -7.303
  188   HD23  LEU  26          2HD2      LEU  26   5.977  13.405  -7.506
  189    H    ILE  27           H        ILE  27   3.412  10.056  -5.179
  190    HA   ILE  27           HA       ILE  27   2.843   8.164  -2.949
  191    HB   ILE  27           HB       ILE  27   1.643   8.353  -5.746
  192   HG12  ILE  27          1HG1      ILE  27   0.401   9.108  -3.056
  193   HG13  ILE  27          2HG1      ILE  27   1.089  10.289  -4.165
  194   HG21  ILE  27          1HG2      ILE  27   1.538   6.039  -4.869
  195   HG22  ILE  27          2HG2      ILE  27  -0.064   6.749  -4.815
  196   HG23  ILE  27          3HG2      ILE  27   0.895   6.634  -3.340
  197   HD11  ILE  27          3HD1      ILE  27  -1.323  10.189  -4.483
  198   HD12  ILE  27          1HD1      ILE  27  -1.252   8.448  -4.754
  199   HD13  ILE  27          2HD1      ILE  27  -0.522   9.554  -5.919
  200    H    TYR  28           H        TYR  28   3.822   6.253  -2.883
  201    HA   TYR  28           HA       TYR  28   5.548   5.320  -5.152
  202    HB2  TYR  28           1HB      TYR  28   5.817   4.864  -2.151
  203    HB3  TYR  28           2HB      TYR  28   6.918   4.253  -3.391
  204    HD1  TYR  28           HD1      TYR  28   8.367   5.823  -4.700
  205    HD2  TYR  28           HD2      TYR  28   5.798   7.276  -1.552
  206    HE1  TYR  28           HE1      TYR  28   9.567   7.990  -4.708
  207    HE2  TYR  28           HE2      TYR  28   7.012   9.435  -1.570
  208    HH   TYR  28           HH       TYR  28   8.777  10.543  -2.365
  209    H    GLU  29           H        GLU  29   5.652   3.095  -5.539
  210    HA   GLU  29           HA       GLU  29   3.128   1.679  -5.132
  211    HB2  GLU  29           1HB      GLU  29   4.322   1.714  -7.325
  212    HB3  GLU  29           2HB      GLU  29   5.644   0.793  -6.613
  213    HG2  GLU  29           1HG      GLU  29   4.090  -1.081  -6.116
  214    HG3  GLU  29           2HG      GLU  29   2.744  -0.148  -6.764
  215    H    ALA  30           H        ALA  30   2.850  -0.218  -4.029
  216    HA   ALA  30           HA       ALA  30   5.071  -1.549  -2.634
  217    HB1  ALA  30           3HB      ALA  30   2.734  -0.313  -1.123
  218    HB2  ALA  30           1HB      ALA  30   4.379   0.321  -1.139
  219    HB3  ALA  30           2HB      ALA  30   4.054  -1.255  -0.434
  220    H    LYS  31           H        LYS  31   4.077  -3.444  -1.299
  221    HA   LYS  31           HA       LYS  31   1.642  -4.575  -2.582
  222    HB2  LYS  31           1HB      LYS  31   3.727  -5.344  -3.807
  223    HB3  LYS  31           2HB      LYS  31   4.260  -6.114  -2.320
  224    HG2  LYS  31           1HG      LYS  31   2.218  -7.544  -2.314
  225    HG3  LYS  31           2HG      LYS  31   1.631  -6.721  -3.755
  226    HD2  LYS  31           1HD      LYS  31   2.585  -8.746  -4.601
  227    HD3  LYS  31           2HD      LYS  31   3.814  -7.533  -4.931
  228    HE2  LYS  31           1HE      LYS  31   5.099  -8.279  -2.953
  229    HE3  LYS  31           2HE      LYS  31   3.813  -9.408  -2.525
  230    HZ1  LYS  31           3HZ      LYS  31   5.570 -10.528  -3.707
  231    HZ2  LYS  31           1HZ      LYS  31   5.435  -9.452  -5.010
  232    HZ3  LYS  31           2HZ      LYS  31   4.160 -10.516  -4.656
  233    H    VAL  32           H        VAL  32   0.459  -5.883  -1.302
  234    HA   VAL  32           HA       VAL  32   1.086  -5.957   1.570
  235    HB   VAL  32           HB       VAL  32  -1.395  -7.030   0.125
  236   HG11  VAL  32          1HG1      VAL  32  -2.444  -6.770   2.366
  237   HG12  VAL  32          2HG1      VAL  32  -0.903  -6.232   3.028
  238   HG13  VAL  32          3HG1      VAL  32  -1.080  -7.884   2.441
  239   HG21  VAL  32          3HG2      VAL  32  -2.463  -4.879   0.738
  240   HG22  VAL  32          1HG2      VAL  32  -1.103  -4.620  -0.350
  241   HG23  VAL  32          2HG2      VAL  32  -0.927  -4.295   1.374
  242    H    LEU  33           H        LEU  33   2.421  -7.604   2.182
  243    HA   LEU  33           HA       LEU  33   2.564 -10.110   0.736
  244    HB2  LEU  33           1HB      LEU  33   4.470  -8.920   2.104
  245    HB3  LEU  33           2HB      LEU  33   3.735  -9.686   3.501
  246    HG   LEU  33           HG       LEU  33   3.942 -11.937   2.083
  247   HD11  LEU  33          1HD1      LEU  33   4.632 -10.915  -0.077
  248   HD12  LEU  33          2HD1      LEU  33   5.906 -11.955   0.535
  249   HD13  LEU  33          3HD1      LEU  33   6.045 -10.206   0.703
  250   HD21  LEU  33          3HD2      LEU  33   5.237 -11.512   4.147
  251   HD22  LEU  33          1HD2      LEU  33   6.414 -10.574   3.227
  252   HD23  LEU  33          2HD2      LEU  33   6.247 -12.310   2.947
  253    H    LYS  34           H        LYS  34   1.044  -9.009   3.702
  254    HA   LYS  34           HA       LYS  34  -0.856 -11.165   3.643
  255    HB2  LYS  34           1HB      LYS  34  -0.249 -12.254   5.799
  256    HB3  LYS  34           2HB      LYS  34   1.002 -12.488   4.580
  257    HG2  LYS  34           1HG      LYS  34   2.310 -10.635   5.546
  258    HG3  LYS  34           2HG      LYS  34   1.063 -10.389   6.775
  259    HD2  LYS  34           1HD      LYS  34   1.470 -12.672   7.640
  260    HD3  LYS  34           2HD      LYS  34   2.726 -12.902   6.429
  261    HE2  LYS  34           1HE      LYS  34   4.008 -11.005   7.374
  262    HE3  LYS  34           2HE      LYS  34   2.754 -10.769   8.596
  263    HZ1  LYS  34           3HZ      LYS  34   4.697 -12.099   9.337
  264    HZ2  LYS  34           1HZ      LYS  34   4.245 -13.304   8.233
  265    HZ3  LYS  34           2HZ      LYS  34   3.204 -12.892   9.511
  266    H    THR  35           H        THR  35  -2.353 -11.075   5.480
  267    HA   THR  35           HA       THR  35  -2.450  -8.460   6.901
  268    HB   THR  35           HB       THR  35  -3.714  -8.048   4.869
  269    HG1  THR  35           HG1      THR  35  -5.836  -7.866   5.817
  270   HG21  THR  35          3HG2      THR  35  -5.626  -9.494   4.211
  271   HG22  THR  35          1HG2      THR  35  -5.190 -10.643   5.471
  272   HG23  THR  35          2HG2      THR  35  -4.095 -10.361   4.119
  273    H    LYS  36           H        LYS  36  -3.773  -8.430   8.714
  274    HA   LYS  36           HA       LYS  36  -4.485 -11.148   9.800
  275    HB2  LYS  36           1HB      LYS  36  -2.679  -9.954  10.996
  276    HB3  LYS  36           2HB      LYS  36  -3.792  -8.653  11.351
  277    HG2  LYS  36           1HG      LYS  36  -5.252 -10.200  12.622
  278    HG3  LYS  36           2HG      LYS  36  -4.193 -11.543  12.205
  279    HD2  LYS  36           1HD      LYS  36  -2.328 -10.447  13.432
  280    HD3  LYS  36           2HD      LYS  36  -3.405  -9.123  13.873
  281    HE2  LYS  36           1HE      LYS  36  -4.873 -10.719  15.083
  282    HE3  LYS  36           2HE      LYS  36  -3.794 -12.044  14.642
  283    HZ1  LYS  36           3HZ      LYS  36  -3.178  -9.711  16.361
  284    HZ2  LYS  36           1HZ      LYS  36  -1.994 -10.774  15.776
  285    HZ3  LYS  36           2HZ      LYS  36  -3.214 -11.350  16.809
  286    HA   PRO  37           HA       PRO  37  -8.534  -8.830   9.524
  287    HB2  PRO  37           1HB      PRO  37 -10.088 -10.658   8.322
  288    HB3  PRO  37           2HB      PRO  37  -8.788  -9.873   7.387
  289    HG2  PRO  37           1HG      PRO  37  -8.708 -12.553   8.790
  290    HG3  PRO  37           2HG      PRO  37  -8.317 -12.186   7.094
  291    HD2  PRO  37           1HD      PRO  37  -6.370 -12.320   9.036
  292    HD3  PRO  37           2HD      PRO  37  -6.224 -11.211   7.652
  293    H    ASP  38           H        ASP  38  -7.320 -11.124  11.482
  294    HA   ASP  38           HA       ASP  38  -9.641 -12.304  12.681
  295    HB2  ASP  38           1HB      ASP  38  -7.345 -13.266  12.801
  296    HB3  ASP  38           2HB      ASP  38  -6.847 -11.927  13.830
  297    H    ALA  39           H        ALA  39  -9.001  -9.162  12.534
  298    HA   ALA  39           HA       ALA  39 -10.546  -8.510  14.907
  299    HB1  ALA  39           3HB      ALA  39  -8.816  -7.091  15.965
  300    HB2  ALA  39           1HB      ALA  39  -7.648  -7.596  14.742
  301    HB3  ALA  39           2HB      ALA  39  -8.285  -8.768  15.886
  302    H    THR  40           H        THR  40 -11.149  -6.292  15.001
  303    HA   THR  40           HA       THR  40 -10.609  -4.614  12.620
  304    HB   THR  40           HB       THR  40 -13.005  -4.188  12.295
  305    HG1  THR  40           HG1      THR  40 -13.083  -5.662  14.633
  306   HG21  THR  40          3HG2      THR  40 -11.886  -6.157  11.120
  307   HG22  THR  40          1HG2      THR  40 -13.627  -6.339  11.345
  308   HG23  THR  40          2HG2      THR  40 -12.515  -7.189  12.406
  309    HA   PRO  41           HA       PRO  41  -9.859  -2.517  12.308
  310    HB2  PRO  41           1HB      PRO  41  -8.036  -0.739  13.271
  311    HB3  PRO  41           2HB      PRO  41  -9.729  -0.254  13.001
  312    HG2  PRO  41           1HG      PRO  41  -8.470  -1.221  15.583
  313    HG3  PRO  41           2HG      PRO  41  -9.366   0.292  15.295
  314    HD2  PRO  41           1HD      PRO  41 -10.677  -1.823  16.320
  315    HD3  PRO  41           2HD      PRO  41 -11.461  -0.853  15.046
  316    H    VAL  42           H        VAL  42  -7.324  -2.559  12.006
  317    HA   VAL  42           HA       VAL  42  -5.779  -4.123  13.875
  318    HB   VAL  42           HB       VAL  42  -7.360  -5.862  13.008
  319   HG11  VAL  42          1HG1      VAL  42  -6.035  -5.460  10.298
  320   HG12  VAL  42          2HG1      VAL  42  -7.624  -4.811  10.714
  321   HG13  VAL  42          3HG1      VAL  42  -7.366  -6.547  10.684
  322   HG21  VAL  42          3HG2      VAL  42  -4.812  -6.316  13.628
  323   HG22  VAL  42          1HG2      VAL  42  -4.626  -6.556  11.895
  324   HG23  VAL  42          2HG2      VAL  42  -5.720  -7.577  12.822
  325    H    GLU  43           H        GLU  43  -3.744  -5.060  12.629
  326    HA   GLU  43           HA       GLU  43  -2.607  -2.857  11.025
  327    HB2  GLU  43           1HB      GLU  43  -0.420  -3.920  11.617
  328    HB3  GLU  43           2HB      GLU  43  -1.339  -3.425  13.027
  329    HG2  GLU  43           1HG      GLU  43  -0.514  -5.620  13.577
  330    HG3  GLU  43           2HG      GLU  43  -2.196  -5.872  13.176
  331    H    TYR  44           H        TYR  44  -1.147  -3.457   9.291
  332    HA   TYR  44           HA       TYR  44  -1.802  -5.978   7.847
  333    HB2  TYR  44           1HB      TYR  44  -1.785  -3.154   6.696
  334    HB3  TYR  44           2HB      TYR  44  -2.019  -4.638   5.773
  335    HD1  TYR  44           HD2      TYR  44  -3.514  -2.458   8.429
  336    HD2  TYR  44           HD1      TYR  44  -4.175  -5.842   5.842
  337    HE1  TYR  44           HE2      TYR  44  -5.925  -2.458   9.012
  338    HE2  TYR  44           HE1      TYR  44  -6.575  -5.832   6.454
  339    HH   TYR  44           HH       TYR  44  -8.241  -4.316   7.311
  340    H    TYR  45           H        TYR  45  -0.205  -6.800   6.618
  341    HA   TYR  45           HA       TYR  45   2.538  -5.752   7.153
  342    HB2  TYR  45           1HB      TYR  45   1.863  -8.206   7.497
  343    HB3  TYR  45           2HB      TYR  45   1.859  -8.342   5.744
  344    HD1  TYR  45           HD2      TYR  45   4.056  -7.550   4.464
  345    HD2  TYR  45           HD1      TYR  45   3.978  -8.456   8.678
  346    HE1  TYR  45           HE2      TYR  45   6.502  -7.840   4.451
  347    HE2  TYR  45           HE1      TYR  45   6.441  -8.732   8.643
  348    HH   TYR  45           HH       TYR  45   8.301  -8.304   5.635
  349    H    ILE  46           H        ILE  46   3.433  -4.477   5.696
  350    HA   ILE  46           HA       ILE  46   3.125  -5.050   2.804
  351    HB   ILE  46           HB       ILE  46   2.874  -2.207   3.912
  352   HG12  ILE  46          1HG1      ILE  46   0.653  -4.240   3.329
  353   HG13  ILE  46          2HG1      ILE  46   0.960  -3.403   4.850
  354   HG21  ILE  46          1HG2      ILE  46   2.128  -1.644   1.666
  355   HG22  ILE  46          2HG2      ILE  46   1.968  -3.341   1.221
  356   HG23  ILE  46          3HG2      ILE  46   3.562  -2.644   1.465
  357   HD11  ILE  46          3HD1      ILE  46   0.417  -1.260   3.693
  358   HD12  ILE  46          1HD1      ILE  46  -0.925  -2.397   3.783
  359   HD13  ILE  46          2HD1      ILE  46  -0.042  -2.198   2.281
  360    H    HIS  47           H        HIS  47   4.837  -4.380   1.554
  361    HA   HIS  47           HA       HIS  47   7.211  -3.141   2.812
  362    HB2  HIS  47           1HB      HIS  47   8.658  -4.936   1.878
  363    HB3  HIS  47           2HB      HIS  47   7.543  -5.563   3.090
  364    HD1  HIS  47           HD1      HIS  47   8.785  -6.408  -0.112
  365    HD2  HIS  47           HD2      HIS  47   4.978  -6.511   1.589
  366    HE1  HIS  47           HE1      HIS  47   7.417  -8.013  -1.512
  367    HE2  HIS  47           HE2      HIS  47   5.095  -8.088  -0.489
  368    H    TYR  48           H        TYR  48   8.498  -2.045   1.369
  369    HA   TYR  48           HA       TYR  48   7.249  -1.124  -1.060
  370    HB2  TYR  48           1HB      TYR  48  10.074  -0.696   0.003
  371    HB3  TYR  48           2HB      TYR  48   9.350   0.186  -1.343
  372    HD1  TYR  48           HD1      TYR  48   7.506   1.821  -0.968
  373    HD2  TYR  48           HD2      TYR  48   9.280  -0.300   2.343
  374    HE1  TYR  48           HE1      TYR  48   6.409   3.372   0.626
  375    HE2  TYR  48           HE2      TYR  48   8.180   1.264   3.921
  376    HH   TYR  48           HH       TYR  48   5.806   2.866   3.567
  377    H    ALA  49           H        ALA  49   7.489  -1.825  -3.084
  378    HA   ALA  49           HA       ALA  49   8.738  -4.328  -3.680
  379    HB1  ALA  49           3HB      ALA  49   8.034  -3.855  -6.001
  380    HB2  ALA  49           1HB      ALA  49   7.678  -2.182  -5.559
  381    HB3  ALA  49           2HB      ALA  49   6.733  -3.495  -4.865
  382    H    GLY  50           H        GLY  50  10.635  -4.789  -4.744
  383    HA2  GLY  50           1HA      GLY  50  12.662  -4.473  -5.832
  384    HA3  GLY  50           2HA      GLY  50  12.338  -2.747  -5.944
  385    H    TRP  51           H        TRP  51  11.939  -4.111  -2.825
  386    HA   TRP  51           HA       TRP  51  14.707  -3.426  -1.945
  387    HB2  TRP  51           1HB      TRP  51  12.137  -2.350  -0.706
  388    HB3  TRP  51           2HB      TRP  51  13.760  -2.120  -0.055
  389    HD1  TRP  51           HD1      TRP  51  11.370  -0.631  -2.513
  390    HE1  TRP  51           HE1      TRP  51  12.508   1.274  -3.818
  391    HE3  TRP  51           HE3      TRP  51  16.224  -1.404  -1.136
  392    HZ2  TRP  51           HZ2      TRP  51  15.129   2.332  -4.229
  393    HZ3  TRP  51           HZ3      TRP  51  18.025   0.069  -2.000
  394    HH2  TRP  51           HH2      TRP  51  17.484   1.936  -3.545
  395    H    SER  52           H        SER  52  15.094  -4.095   0.290
  396    HA   SER  52           HA       SER  52  14.582  -6.849   0.638
  397    HB2  SER  52           1HB      SER  52  15.679  -6.583   2.816
  398    HB3  SER  52           2HB      SER  52  16.527  -5.622   1.601
  399    HG   SER  52           HG       SER  52  15.577  -4.768   3.848
  400    H    LYS  53           H        LYS  53  12.969  -7.932   1.641
  401    HA   LYS  53           HA       LYS  53  10.630  -6.508   2.648
  402    HB2  LYS  53           1HB      LYS  53   9.609  -8.756   2.762
  403    HB3  LYS  53           2HB      LYS  53  10.321  -8.447   1.180
  404    HG2  LYS  53           1HG      LYS  53  12.342  -9.744   1.843
  405    HG3  LYS  53           2HG      LYS  53  11.608 -10.086   3.409
  406    HD2  LYS  53           1HD      LYS  53   9.727 -11.250   2.284
  407    HD3  LYS  53           2HD      LYS  53  10.450 -10.907   0.713
  408    HE2  LYS  53           1HE      LYS  53  12.442 -12.242   1.332
  409    HE3  LYS  53           2HE      LYS  53  11.729 -12.577   2.911
  410    HZ1  LYS  53           3HZ      LYS  53   9.779 -13.241   1.117
  411    HZ2  LYS  53           1HZ      LYS  53  10.780 -14.321   1.955
  412    HZ3  LYS  53           2HZ      LYS  53  11.207 -13.808   0.393
  413    H    ASN  54           H        ASN  54  13.493  -7.583   4.038
  414    HA   ASN  54           HA       ASN  54  12.567  -8.582   6.555
  415    HB2  ASN  54           1HB      ASN  54  15.228  -7.289   5.839
  416    HB3  ASN  54           2HB      ASN  54  14.904  -8.270   7.270
  417   HD21  ASN  54          2HD2      ASN  54  13.239 -10.263   5.882
  418   HD22  ASN  54          1HD2      ASN  54  14.282 -11.157   4.885
  419    H    TRP  55           H        TRP  55  12.471  -5.508   5.199
  420    HA   TRP  55           HA       TRP  55  12.983  -3.861   7.477
  421    HB2  TRP  55           1HB      TRP  55  12.954  -3.101   5.063
  422    HB3  TRP  55           2HB      TRP  55  11.201  -3.235   5.077
  423    HD1  TRP  55           HD1      TRP  55   9.955  -1.681   7.049
  424    HE1  TRP  55           HE1      TRP  55  10.558   0.703   7.811
  425    HE3  TRP  55           HE3      TRP  55  14.767  -1.420   5.372
  426    HZ2  TRP  55           HZ2      TRP  55  12.787   2.488   7.722
  427    HZ3  TRP  55           HZ3      TRP  55  16.112   0.636   5.723
  428    HH2  TRP  55           HH2      TRP  55  15.128   2.589   6.897
  429    H    ASP  56           H        ASP  56  10.244  -5.647   6.327
  430    HA   ASP  56           HA       ASP  56   8.065  -5.904   7.053
  431    HB2  ASP  56           1HB      ASP  56   9.499  -5.724   9.721
  432    HB3  ASP  56           2HB      ASP  56   7.918  -6.458   9.457
  433    H    GLU  57           H        GLU  57   7.507  -3.666   6.235
  434    HA   GLU  57           HA       GLU  57   7.156  -1.589   8.288
  435    HB2  GLU  57           1HB      GLU  57   7.882  -1.165   5.843
  436    HB3  GLU  57           2HB      GLU  57   6.223  -1.481   5.389
  437    HG2  GLU  57           1HG      GLU  57   6.412   0.921   5.637
  438    HG3  GLU  57           2HG      GLU  57   5.523   0.348   7.033
  439    H    TRP  58           H        TRP  58   5.590  -2.374   9.681
  440    HA   TRP  58           HA       TRP  58   2.998  -3.361   8.758
  441    HB2  TRP  58           1HB      TRP  58   4.254  -2.841  11.484
  442    HB3  TRP  58           2HB      TRP  58   2.566  -3.305  11.331
  443    HD1  TRP  58           HD1      TRP  58   5.610  -4.768   9.386
  444    HE1  TRP  58           HE1      TRP  58   5.655  -7.300   9.772
  445    HE3  TRP  58           HE3      TRP  58   1.775  -5.226  12.730
  446    HZ2  TRP  58           HZ2      TRP  58   4.262  -9.280  11.269
  447    HZ3  TRP  58           HZ3      TRP  58   1.162  -7.459  13.631
  448    HH2  TRP  58           HH2      TRP  58   2.406  -9.483  12.909
  449    H    VAL  59           H        VAL  59   1.243  -2.073   8.406
  450    HA   VAL  59           HA       VAL  59   1.082   0.605   9.671
  451    HB   VAL  59           HB       VAL  59   0.377   1.550   7.380
  452   HG11  VAL  59          1HG1      VAL  59   3.238   0.628   7.705
  453   HG12  VAL  59          2HG1      VAL  59   2.562   2.106   8.368
  454   HG13  VAL  59          3HG1      VAL  59   2.710   1.909   6.621
  455   HG21  VAL  59          3HG2      VAL  59   1.745  -0.984   6.398
  456   HG22  VAL  59          1HG2      VAL  59   1.169   0.344   5.392
  457   HG23  VAL  59          2HG2      VAL  59   0.017  -0.651   6.278
  458    HA   PRO  60           HA       PRO  60  -3.258  -0.489   9.956
  459    HB2  PRO  60           1HB      PRO  60  -4.399   1.892  10.573
  460    HB3  PRO  60           2HB      PRO  60  -3.197   1.170  11.674
  461    HG2  PRO  60           1HG      PRO  60  -2.717   3.231   9.501
  462    HG3  PRO  60           2HG      PRO  60  -2.307   3.347  11.230
  463    HD2  PRO  60           1HD      PRO  60  -0.441   2.527   9.444
  464    HD3  PRO  60           2HD      PRO  60  -0.537   1.765  11.049
  465    H    GLU  61           H        GLU  61  -5.260  -0.306   8.835
  466    HA   GLU  61           HA       GLU  61  -5.203  -0.099   6.062
  467    HB2  GLU  61           1HB      GLU  61  -7.727   0.061   6.194
  468    HB3  GLU  61           2HB      GLU  61  -7.050  -1.232   7.174
  469    HG2  GLU  61           1HG      GLU  61  -7.182   0.219   9.192
  470    HG3  GLU  61           2HG      GLU  61  -7.870   1.511   8.214
  471    H    ASN  62           H        ASN  62  -5.371   2.467   8.346
  472    HA   ASN  62           HA       ASN  62  -6.631   4.482   6.791
  473    HB2  ASN  62           1HB      ASN  62  -6.287   4.647   9.238
  474    HB3  ASN  62           2HB      ASN  62  -4.551   4.780   8.988
  475   HD21  ASN  62          2HD2      ASN  62  -7.638   6.448   8.216
  476   HD22  ASN  62          1HD2      ASN  62  -6.947   7.994   8.096
  477    H    ARG  63           H        ARG  63  -3.198   3.533   7.044
  478    HA   ARG  63           HA       ARG  63  -2.357   5.645   5.175
  479    HB2  ARG  63           1HB      ARG  63  -1.033   4.699   7.257
  480    HB3  ARG  63           2HB      ARG  63  -0.568   3.410   6.166
  481    HG2  ARG  63           1HG      ARG  63   1.229   4.894   5.758
  482    HG3  ARG  63           2HG      ARG  63   0.110   5.483   4.534
  483    HD2  ARG  63           1HD      ARG  63   0.967   7.412   5.748
  484    HD3  ARG  63           2HD      ARG  63  -0.709   7.184   6.249
  485    HE   ARG  63           HE       ARG  63   0.049   6.673   8.380
  486   HH11  ARG  63          1HH2      ARG  63   2.684   6.458   6.122
  487   HH12  ARG  63          2HH2      ARG  63   3.870   6.119   7.338
  488   HH21  ARG  63          1HH1      ARG  63   1.605   6.218   9.961
  489   HH22  ARG  63          2HH1      ARG  63   3.261   5.981   9.504
  490    H    VAL  64           H        VAL  64  -3.888   2.790   4.700
  491    HA   VAL  64           HA       VAL  64  -2.328   1.936   2.313
  492    HB   VAL  64           HB       VAL  64  -4.700   0.591   3.662
  493   HG11  VAL  64          1HG1      VAL  64  -2.748  -0.410   1.542
  494   HG12  VAL  64          2HG1      VAL  64  -4.451  -0.051   1.271
  495   HG13  VAL  64          3HG1      VAL  64  -3.994  -1.390   2.315
  496   HG21  VAL  64          3HG2      VAL  64  -2.998  -0.976   4.571
  497   HG22  VAL  64          1HG2      VAL  64  -2.695   0.666   5.129
  498   HG23  VAL  64          2HG2      VAL  64  -1.717  -0.010   3.835
  499    H    LEU  65           H        LEU  65  -2.999   2.347   0.313
  500    HA   LEU  65           HA       LEU  65  -5.732   3.465  -0.141
  501    HB2  LEU  65           1HB      LEU  65  -3.920   5.153  -0.375
  502    HB3  LEU  65           2HB      LEU  65  -3.162   4.146  -1.610
  503    HG   LEU  65           HG       LEU  65  -5.199   4.408  -3.049
  504   HD11  LEU  65          1HD1      LEU  65  -6.234   6.025  -0.688
  505   HD12  LEU  65          2HD1      LEU  65  -7.059   4.767  -1.615
  506   HD13  LEU  65          3HD1      LEU  65  -6.817   6.352  -2.324
  507   HD21  LEU  65          3HD2      LEU  65  -4.033   7.045  -2.077
  508   HD22  LEU  65          1HD2      LEU  65  -4.841   6.792  -3.625
  509   HD23  LEU  65          2HD2      LEU  65  -3.307   5.988  -3.290
  510    H    LYS  66           H        LYS  66  -6.949   2.518  -1.651
  511    HA   LYS  66           HA       LYS  66  -6.244  -0.005  -2.759
  512    HB2  LYS  66           1HB      LYS  66  -8.424   0.203  -3.968
  513    HB3  LYS  66           2HB      LYS  66  -8.572   0.561  -2.252
  514    HG2  LYS  66           1HG      LYS  66  -8.451   3.002  -2.760
  515    HG3  LYS  66           2HG      LYS  66  -8.361   2.632  -4.480
  516    HD2  LYS  66           1HD      LYS  66 -10.579   1.524  -4.360
  517    HD3  LYS  66           2HD      LYS  66 -10.670   1.888  -2.637
  518    HE2  LYS  66           1HE      LYS  66 -10.598   4.312  -3.139
  519    HE3  LYS  66           2HE      LYS  66 -10.482   3.958  -4.864
  520    HZ1  LYS  66           3HZ      LYS  66 -12.635   2.521  -4.100
  521    HZ2  LYS  66           1HZ      LYS  66 -12.693   4.056  -4.818
  522    HZ3  LYS  66           2HZ      LYS  66 -12.773   3.907  -3.127
  523    H    TYR  67           H        TYR  67  -5.753  -0.605  -4.862
  524    HA   TYR  67           HA       TYR  67  -4.354   1.409  -6.472
  525    HB2  TYR  67           1HB      TYR  67  -3.414  -0.874  -6.094
  526    HB3  TYR  67           2HB      TYR  67  -4.773  -1.578  -6.960
  527    HD1  TYR  67           HD2      TYR  67  -1.693   0.493  -7.300
  528    HD2  TYR  67           HD1      TYR  67  -4.965  -1.332  -9.436
  529    HE1  TYR  67           HE2      TYR  67  -0.532   0.909  -9.451
  530    HE2  TYR  67           HE1      TYR  67  -3.790  -0.907 -11.578
  531    HH   TYR  67           HH       TYR  67  -1.984  -0.088 -12.551
  532    H    ASN  68           H        ASN  68  -5.399   2.563  -7.956
  533    HA   ASN  68           HA       ASN  68  -7.359   1.334  -9.755
  534    HB2  ASN  68           1HB      ASN  68  -8.697   2.063  -7.777
  535    HB3  ASN  68           2HB      ASN  68  -8.123   3.710  -8.004
  536   HD21  ASN  68          2HD2      ASN  68 -10.161   4.639  -8.595
  537   HD22  ASN  68          1HD2      ASN  68 -10.999   4.203 -10.006
  538    H    ASP  69           H        ASP  69  -7.602   2.434 -11.664
  539    HA   ASP  69           HA       ASP  69  -5.486   3.840 -12.708
  540    HB2  ASP  69           1HB      ASP  69  -8.387   4.146 -13.564
  541    HB3  ASP  69           2HB      ASP  69  -6.964   4.455 -14.560
  542    H    ASP  70           H        ASP  70  -8.114   5.128 -10.782
  543    HA   ASP  70           HA       ASP  70  -7.725   7.898 -11.436
  544    HB2  ASP  70           1HB      ASP  70  -9.850   7.009 -10.493
  545    HB3  ASP  70           2HB      ASP  70  -9.020   6.642  -8.981
  546    H    ASN  71           H        ASN  71  -6.630   5.803  -8.753
  547    HA   ASN  71           HA       ASN  71  -5.205   7.848  -7.343
  548    HB2  ASN  71           1HB      ASN  71  -4.808   4.829  -7.334
  549    HB3  ASN  71           2HB      ASN  71  -4.110   5.956  -6.172
  550   HD21  ASN  71          2HD2      ASN  71  -6.499   3.771  -6.265
  551   HD22  ASN  71          1HD2      ASN  71  -7.660   4.533  -5.290
  552    H    VAL  72           H        VAL  72  -4.390   5.606  -9.926
  553    HA   VAL  72           HA       VAL  72  -1.566   6.139 -10.015
  554    HB   VAL  72           HB       VAL  72  -3.466   5.171 -12.194
  555   HG11  VAL  72          1HG1      VAL  72  -0.416   5.171 -12.095
  556   HG12  VAL  72          2HG1      VAL  72  -1.413   6.064 -13.244
  557   HG13  VAL  72          3HG1      VAL  72  -1.366   4.306 -13.300
  558   HG21  VAL  72          3HG2      VAL  72  -1.577   3.644 -10.353
  559   HG22  VAL  72          1HG2      VAL  72  -2.574   2.926 -11.619
  560   HG23  VAL  72          2HG2      VAL  72  -3.334   3.670 -10.214
  561    H    LYS  73           H        LYS  73  -4.396   7.496 -11.667
  562    HA   LYS  73           HA       LYS  73  -3.172   9.314 -13.377
  563    HB2  LYS  73           1HB      LYS  73  -5.591   8.734 -13.375
  564    HB3  LYS  73           2HB      LYS  73  -5.800   9.678 -11.912
  565    HG2  LYS  73           1HG      LYS  73  -5.077  11.727 -13.103
  566    HG3  LYS  73           2HG      LYS  73  -4.826  10.780 -14.570
  567    HD2  LYS  73           1HD      LYS  73  -7.245  10.172 -14.583
  568    HD3  LYS  73           2HD      LYS  73  -7.489  11.142 -13.132
  569    HE2  LYS  73           1HE      LYS  73  -6.527  12.198 -15.818
  570    HE3  LYS  73           2HE      LYS  73  -8.144  12.414 -15.148
  571    HZ1  LYS  73           3HZ      LYS  73  -7.041  13.496 -13.202
  572    HZ2  LYS  73           1HZ      LYS  73  -6.924  14.357 -14.659
  573    HZ3  LYS  73           2HZ      LYS  73  -5.590  13.476 -14.086
  574    H    ARG  74           H        ARG  74  -4.085   9.648  -9.972
  575    HA   ARG  74           HA       ARG  74  -3.357  12.388  -9.631
  576    HB2  ARG  74           1HB      ARG  74  -3.595  10.081  -7.665
  577    HB3  ARG  74           2HB      ARG  74  -3.237  11.727  -7.143
  578    HG2  ARG  74           1HG      ARG  74  -5.354  12.520  -8.149
  579    HG3  ARG  74           2HG      ARG  74  -5.712  10.893  -8.718
  580    HD2  ARG  74           1HD      ARG  74  -6.946  11.341  -6.632
  581    HD3  ARG  74           2HD      ARG  74  -5.736  10.088  -6.364
  582    HE   ARG  74           HE       ARG  74  -4.657  11.515  -4.890
  583   HH11  ARG  74          1HH2      ARG  74  -6.803  13.362  -6.909
  584   HH12  ARG  74          2HH2      ARG  74  -6.529  14.848  -6.060
  585   HH21  ARG  74          1HH1      ARG  74  -4.313  13.458  -3.788
  586   HH22  ARG  74          2HH1      ARG  74  -5.124  14.902  -4.301
  587    H    ARG  75           H        ARG  75  -1.534   9.364  -9.246
  588    HA   ARG  75           HA       ARG  75   0.868  10.569  -8.234
  589    HB2  ARG  75           1HB      ARG  75   0.344   8.147  -7.975
  590    HB3  ARG  75           2HB      ARG  75   0.534   7.919  -9.711
  591    HG2  ARG  75           1HG      ARG  75   2.906   8.603  -9.576
  592    HG3  ARG  75           2HG      ARG  75   2.731   8.962  -7.862
  593    HD2  ARG  75           1HD      ARG  75   3.791   6.764  -8.150
  594    HD3  ARG  75           2HD      ARG  75   2.185   6.553  -7.448
  595    HE   ARG  75           HE       ARG  75   2.011   6.411 -10.275
  596   HH11  ARG  75          1HH2      ARG  75   3.243   4.614  -7.557
  597   HH12  ARG  75          2HH2      ARG  75   3.045   3.074  -8.329
  598   HH21  ARG  75          1HH1      ARG  75   1.764   4.400 -11.261
  599   HH22  ARG  75          2HH1      ARG  75   2.211   2.954 -10.416
  600    H    GLN  76           H        GLN  76  -0.416   9.799 -11.378
  601    HA   GLN  76           HA       GLN  76   1.918  10.438 -12.910
  602    HB2  GLN  76           1HB      GLN  76   0.472   9.147 -14.194
  603    HB3  GLN  76           2HB      GLN  76  -0.951   9.823 -13.440
  604    HG2  GLN  76           1HG      GLN  76  -0.916  11.778 -14.832
  605    HG3  GLN  76           2HG      GLN  76   0.707  11.420 -15.406
  606   HE21  GLN  76          2HE2      GLN  76  -1.229  11.837 -17.356
  607   HE22  GLN  76          1HE2      GLN  76  -1.654  10.366 -18.090
  608    H    GLU  77           H        GLU  77  -0.886  12.290 -11.769
  609    HA   GLU  77           HA       GLU  77  -0.242  14.755 -13.103
  610    HB2  GLU  77           1HB      GLU  77  -1.867  14.114 -10.613
  611    HB3  GLU  77           2HB      GLU  77  -1.643  15.780 -11.141
  612    HG2  GLU  77           1HG      GLU  77  -2.708  15.284 -13.298
  613    HG3  GLU  77           2HG      GLU  77  -2.862  13.589 -12.874
  614    H    LEU  78           H        LEU  78   0.399  13.597  -9.793
  615    HA   LEU  78           HA       LEU  78   1.973  15.752  -8.922
  616    HB2  LEU  78           1HB      LEU  78   1.931  12.836  -8.115
  617    HB3  LEU  78           2HB      LEU  78   2.845  14.047  -7.227
  618    HG   LEU  78           HG       LEU  78  -0.175  14.353  -7.688
  619   HD11  LEU  78          1HD1      LEU  78  -0.529  13.412  -5.418
  620   HD12  LEU  78          2HD1      LEU  78   1.190  13.026  -5.313
  621   HD13  LEU  78          3HD1      LEU  78   0.177  12.215  -6.504
  622   HD21  LEU  78          3HD2      LEU  78   0.955  16.428  -6.932
  623   HD22  LEU  78          1HD2      LEU  78   1.751  15.552  -5.628
  624   HD23  LEU  78          2HD2      LEU  78   0.003  15.790  -5.606
  625    H    ALA  79           H        ALA  79   2.810  12.782 -10.634
  626    HA   ALA  79           HA       ALA  79   5.639  13.055 -10.529
  627    HB1  ALA  79           3HB      ALA  79   4.512  10.956 -11.196
  628    HB2  ALA  79           1HB      ALA  79   5.682  11.471 -12.411
  629    HB3  ALA  79           2HB      ALA  79   3.963  11.731 -12.684
  630    H    ARG  80           H        ARG  80   3.274  14.154 -12.975
  631    HA   ARG  80           HA       ARG  80   5.179  15.410 -14.701
  632    HB2  ARG  80           1HB      ARG  80   2.181  15.788 -14.315
  633    HB3  ARG  80           2HB      ARG  80   3.089  16.646 -15.562
  634    HG2  ARG  80           1HG      ARG  80   3.767  14.516 -16.590
  635    HG3  ARG  80           2HG      ARG  80   2.975  13.605 -15.314
  636    HD2  ARG  80           1HD      ARG  80   1.547  13.691 -17.327
  637    HD3  ARG  80           2HD      ARG  80   0.783  14.559 -15.993
  638    HE   ARG  80           HE       ARG  80   2.354  16.353 -17.542
  639   HH11  ARG  80          1HH2      ARG  80  -0.591  14.501 -17.689
  640   HH12  ARG  80          2HH2      ARG  80  -1.383  15.612 -18.758
  641   HH21  ARG  80          1HH1      ARG  80   1.309  17.790 -18.930
  642   HH22  ARG  80          2HH1      ARG  80  -0.311  17.469 -19.457
  643    H    GLN  81           H        GLN  81   3.208  16.545 -11.991
  644    HA   GLN  81           HA       GLN  81   3.888  19.289 -12.141
  645    HB2  GLN  81           1HB      GLN  81   1.991  18.289 -10.814
  646    HB3  GLN  81           2HB      GLN  81   3.175  17.694  -9.657
  647    HG2  GLN  81           1HG      GLN  81   3.923  20.023  -9.212
  648    HG3  GLN  81           2HG      GLN  81   2.738  20.616 -10.373
  649   HE21  GLN  81          2HE2      GLN  81   0.831  21.307  -9.385
  650   HE22  GLN  81          1HE2      GLN  81   0.211  20.697  -7.928
  651    H    CYS  82           H        CYS  82   5.436  16.524 -10.573
  652    HA   CYS  82           HA       CYS  82   7.339  17.898  -9.014
  653    HB2  CYS  82           1HB      CYS  82   6.795  15.486  -8.770
  654    HB3  CYS  82           2HB      CYS  82   7.607  15.158 -10.298
  655    HG   CYS  82           HG       CYS  82   9.003  15.463  -7.672
  656    H    GLY  83           H        GLY  83   7.452  16.731 -12.361
  657    HA2  GLY  83           1HA      GLY  83  10.156  17.362 -12.902
  658    HA3  GLY  83           2HA      GLY  83   8.879  17.171 -14.102
  659    H    GLU  84           H        GLU  84  11.110  19.182 -13.738
  660    HA   GLU  84           HA       GLU  84   9.685  21.492 -14.675
  661    HB2  GLU  84           1HB      GLU  84  10.332  23.020 -12.786
  662    HB3  GLU  84           2HB      GLU  84   9.150  21.803 -12.308
  663    HG2  GLU  84           1HG      GLU  84  10.983  20.405 -11.354
  664    HG3  GLU  84           2HG      GLU  84  12.151  21.645 -11.799
  665    H    ARG  85           H        ARG  85  11.173  23.348 -14.973
  666    HA   ARG  85           HA       ARG  85  14.015  23.034 -14.895
  667    HB2  ARG  85           1HB      ARG  85  14.379  22.854 -17.367
  668    HB3  ARG  85           2HB      ARG  85  13.628  21.411 -16.694
  669    HG2  ARG  85           1HG      ARG  85  11.396  22.214 -17.438
  670    HG3  ARG  85           2HG      ARG  85  12.141  23.657 -18.123
  671    HD2  ARG  85           1HD      ARG  85  11.768  21.992 -19.893
  672    HD3  ARG  85           2HD      ARG  85  13.501  22.221 -19.640
  673    HE   ARG  85           HE       ARG  85  12.557  20.092 -18.004
  674   HH11  ARG  85          1HH2      ARG  85  13.212  20.887 -21.329
  675   HH12  ARG  85          2HH2      ARG  85  13.547  19.250 -21.787
  676   HH21  ARG  85          1HH1      ARG  85  12.997  17.960 -18.617
  677   HH22  ARG  85          2HH1      ARG  85  13.426  17.599 -20.258
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1 -27.046 -16.094  -5.071
    2    H2   MET   1           2H       MET   1 -28.643 -15.979  -4.498
    3    H3   MET   1           3H       MET   1 -27.508 -16.939  -3.676
    4    HA   MET   1           HA       MET   1 -26.187 -14.895  -3.230
    5    HB2  MET   1           1HB      MET   1 -28.742 -13.623  -4.297
    6    HB3  MET   1           2HB      MET   1 -27.438 -12.745  -3.499
    7    HG2  MET   1           1HG      MET   1 -25.864 -13.466  -5.283
    8    HG3  MET   1           2HG      MET   1 -27.172 -14.336  -6.078
    9    HE1  MET   1           3HE      MET   1 -25.238 -11.092  -5.960
   10    HE2  MET   1           1HE      MET   1 -26.265 -10.839  -4.542
   11    HE3  MET   1           2HE      MET   1 -26.444  -9.809  -5.958
   12    H    ASN   2           H        ASN   2 -26.528 -16.207  -1.347
   13    HA   ASN   2           HA       ASN   2 -28.159 -14.982   0.664
   14    HB2  ASN   2           1HB      ASN   2 -29.652 -16.943   1.109
   15    HB3  ASN   2           2HB      ASN   2 -29.984 -16.196  -0.445
   16   HD21  ASN   2          2HD2      ASN   2 -30.918 -18.345  -1.079
   17   HD22  ASN   2          1HD2      ASN   2 -29.871 -19.584  -1.578
   18    H    TYR   3           H        TYR   3 -25.542 -16.639  -0.278
   19    HA   TYR   3           HA       TYR   3 -25.118 -18.548   1.811
   20    HB2  TYR   3           1HB      TYR   3 -23.111 -17.040   0.081
   21    HB3  TYR   3           2HB      TYR   3 -22.746 -18.459   1.065
   22    HD1  TYR   3           HD1      TYR   3 -23.650 -20.710   0.456
   23    HD2  TYR   3           HD2      TYR   3 -24.443 -17.261  -2.012
   24    HE1  TYR   3           HE1      TYR   3 -24.427 -22.189  -1.377
   25    HE2  TYR   3           HE2      TYR   3 -25.211 -18.757  -3.835
   26    HH   TYR   3           HH       TYR   3 -25.925 -20.905  -4.273
   27    H    SER   4           H        SER   4 -24.304 -18.292   3.823
   28    HA   SER   4           HA       SER   4 -24.257 -15.725   5.082
   29    HB2  SER   4           1HB      SER   4 -23.224 -18.408   6.056
   30    HB3  SER   4           2HB      SER   4 -23.461 -16.981   7.066
   31    HG   SER   4           HG       SER   4 -25.217 -18.717   6.741
   32    H    THR   5           H        THR   5 -22.548 -14.454   5.699
   33    HA   THR   5           HA       THR   5 -20.158 -14.499   4.168
   34    HB   THR   5           HB       THR   5 -20.712 -12.982   6.754
   35    HG1  THR   5           HG1      THR   5 -21.546 -12.665   4.111
   36   HG21  THR   5          3HG2      THR   5 -19.146 -11.318   5.764
   37   HG22  THR   5          1HG2      THR   5 -18.838 -12.414   4.420
   38   HG23  THR   5          2HG2      THR   5 -18.344 -12.859   6.054
   39    H    GLY   6           H        GLY   6 -18.176 -15.328   4.592
   40    HA2  GLY   6           1HA      GLY   6 -17.083 -15.946   7.126
   41    HA3  GLY   6           2HA      GLY   6 -17.786 -17.416   6.455
   42    H    THR   7           H        THR   7 -17.221 -17.266   3.816
   43    HA   THR   7           HA       THR   7 -14.481 -18.018   3.676
   44    HB   THR   7           HB       THR   7 -16.332 -17.278   1.368
   45    HG1  THR   7           HG1      THR   7 -15.934 -19.821   2.526
   46   HG21  THR   7          3HG2      THR   7 -13.966 -17.599   0.699
   47   HG22  THR   7          1HG2      THR   7 -14.961 -18.934   0.120
   48   HG23  THR   7          2HG2      THR   7 -13.935 -19.152   1.536
   49    H    ASP   8           H        ASP   8 -16.215 -15.134   2.522
   50    HA   ASP   8           HA       ASP   8 -13.920 -13.785   1.484
   51    HB2  ASP   8           1HB      ASP   8 -16.629 -12.713   2.365
   52    HB3  ASP   8           2HB      ASP   8 -15.444 -11.818   1.414
   53    H    ALA   9           H        ALA   9 -12.496 -12.456   2.463
   54    HA   ALA   9           HA       ALA   9 -12.226 -12.400   5.303
   55    HB1  ALA   9           3HB      ALA   9 -10.312 -12.270   3.748
   56    HB2  ALA   9           1HB      ALA   9 -10.332 -10.880   4.835
   57    HB3  ALA   9           2HB      ALA   9 -10.880 -10.708   3.165
   58    H    ASN  10           H        ASN  10 -12.627 -10.751   6.760
   59    HA   ASN  10           HA       ASN  10 -14.819  -9.005   6.278
   60    HB2  ASN  10           1HB      ASN  10 -14.220  -9.896   8.519
   61    HB3  ASN  10           2HB      ASN  10 -12.761  -8.911   8.518
   62   HD21  ASN  10          2HD2      ASN  10 -14.441  -8.400  10.607
   63   HD22  ASN  10          1HD2      ASN  10 -15.304  -6.957  10.375
   64    H    THR  11           H        THR  11 -11.313  -8.479   6.368
   65    HA   THR  11           HA       THR  11 -11.432  -5.627   6.019
   66    HB   THR  11           HB       THR  11  -9.002  -5.848   5.527
   67    HG1  THR  11           HG1      THR  11  -8.106  -7.855   5.362
   68   HG21  THR  11          3HG2      THR  11  -8.348  -6.885   7.688
   69   HG22  THR  11          1HG2      THR  11  -9.965  -7.573   7.847
   70   HG23  THR  11          2HG2      THR  11  -9.742  -5.822   7.885
   71    H    LEU  12           H        LEU  12 -10.845  -4.458   4.141
   72    HA   LEU  12           HA       LEU  12 -11.973  -5.566   1.659
   73    HB2  LEU  12           1HB      LEU  12 -11.107  -2.811   2.600
   74    HB3  LEU  12           2HB      LEU  12 -11.421  -3.094   0.889
   75    HG   LEU  12           HG       LEU  12 -13.730  -3.837   1.426
   76   HD11  LEU  12          1HD1      LEU  12 -14.602  -3.404   3.790
   77   HD12  LEU  12          2HD1      LEU  12 -12.921  -3.256   4.305
   78   HD13  LEU  12          3HD1      LEU  12 -13.515  -4.776   3.636
   79   HD21  LEU  12          3HD2      LEU  12 -14.627  -1.623   2.110
   80   HD22  LEU  12          1HD2      LEU  12 -13.313  -1.441   0.946
   81   HD23  LEU  12          2HD2      LEU  12 -13.021  -1.145   2.660
   82    H    PHE  13           H        PHE  13  -8.968  -5.596   3.079
   83    HA   PHE  13           HA       PHE  13  -7.499  -5.668   0.463
   84    HB2  PHE  13           1HB      PHE  13  -6.515  -4.985   3.261
   85    HB3  PHE  13           2HB      PHE  13  -5.489  -5.099   1.829
   86    HD1  PHE  13           HD1      PHE  13  -5.699  -3.445  -0.035
   87    HD2  PHE  13           HD2      PHE  13  -8.066  -3.060   3.551
   88    HE1  PHE  13           HE1      PHE  13  -6.294  -1.124  -0.666
   89    HE2  PHE  13           HE2      PHE  13  -8.647  -0.735   2.912
   90    HZ   PHE  13           HZ       PHE  13  -7.767   0.232   0.803
   91    H    VAL  14           H        VAL  14  -6.288  -7.413   0.002
   92    HA   VAL  14           HA       VAL  14  -6.059  -9.655   1.962
   93    HB   VAL  14           HB       VAL  14  -6.487 -11.234   0.093
   94   HG11  VAL  14          1HG1      VAL  14  -8.349 -10.568   1.601
   95   HG12  VAL  14          2HG1      VAL  14  -8.943 -10.869  -0.031
   96   HG13  VAL  14          3HG1      VAL  14  -8.730  -9.212   0.537
   97   HG21  VAL  14          3HG2      VAL  14  -7.143  -8.697  -1.478
   98   HG22  VAL  14          1HG2      VAL  14  -7.554 -10.327  -2.012
   99   HG23  VAL  14          2HG2      VAL  14  -5.870  -9.863  -1.836
  100    H    ASP  15           H        ASP  15  -4.320 -11.060   1.614
  101    HA   ASP  15           HA       ASP  15  -1.872  -9.815   0.981
  102    HB2  ASP  15           1HB      ASP  15  -0.913 -12.077   1.312
  103    HB3  ASP  15           2HB      ASP  15  -2.087 -11.685   2.565
  104    H    GLY  16           H        GLY  16  -0.509  -9.980  -0.755
  105    HA2  GLY  16           1HA      GLY  16   0.288 -10.656  -2.852
  106    HA3  GLY  16           2HA      GLY  16  -1.173 -11.591  -3.129
  107    H    GLU  17           H        GLU  17  -2.435  -8.869  -2.051
  108    HA   GLU  17           HA       GLU  17  -3.112  -7.848  -4.682
  109    HB2  GLU  17           1HB      GLU  17  -4.727  -7.958  -2.793
  110    HB3  GLU  17           2HB      GLU  17  -3.800  -6.744  -1.926
  111    HG2  GLU  17           1HG      GLU  17  -4.225  -5.111  -3.748
  112    HG3  GLU  17           2HG      GLU  17  -5.097  -6.340  -4.656
  113    H    ARG  18           H        ARG  18  -2.447  -5.989  -5.624
  114    HA   ARG  18           HA       ARG  18  -0.019  -4.679  -4.630
  115    HB2  ARG  18           1HB      ARG  18  -0.347  -5.333  -7.050
  116    HB3  ARG  18           2HB      ARG  18  -1.633  -4.143  -7.159
  117    HG2  ARG  18           1HG      ARG  18   0.231  -2.920  -8.002
  118    HG3  ARG  18           2HG      ARG  18   0.223  -2.411  -6.320
  119    HD2  ARG  18           1HD      ARG  18   2.507  -2.974  -7.038
  120    HD3  ARG  18           2HD      ARG  18   1.974  -4.127  -5.822
  121    HE   ARG  18           HE       ARG  18   1.364  -5.094  -8.434
  122   HH11  ARG  18          1HH2      ARG  18   4.010  -4.563  -6.243
  123   HH12  ARG  18          2HH2      ARG  18   4.997  -5.814  -6.922
  124   HH21  ARG  18          1HH1      ARG  18   2.662  -6.729  -9.319
  125   HH22  ARG  18          2HH1      ARG  18   4.236  -7.038  -8.661
  126    H    VAL  19           H        VAL  19  -0.007  -2.749  -3.589
  127    HA   VAL  19           HA       VAL  19  -2.343  -0.907  -3.748
  128    HB   VAL  19           HB       VAL  19  -2.320  -0.569  -1.312
  129   HG11  VAL  19          1HG1      VAL  19  -2.575  -3.523  -2.015
  130   HG12  VAL  19          2HG1      VAL  19  -3.828  -2.305  -2.263
  131   HG13  VAL  19          3HG1      VAL  19  -3.308  -2.719  -0.629
  132   HG21  VAL  19          3HG2      VAL  19   0.006  -1.070  -0.738
  133   HG22  VAL  19          1HG2      VAL  19  -0.149  -2.725  -1.323
  134   HG23  VAL  19          2HG2      VAL  19  -1.003  -2.212   0.133
  135    H    LEU  20           H        LEU  20  -1.820   1.194  -2.685
  136    HA   LEU  20           HA       LEU  20   0.983   2.029  -3.316
  137    HB2  LEU  20           1HB      LEU  20  -1.564   3.690  -3.404
  138    HB3  LEU  20           2HB      LEU  20   0.044   4.192  -3.923
  139    HG   LEU  20           HG       LEU  20  -1.610   1.957  -5.186
  140   HD11  LEU  20          1HD1      LEU  20  -2.508   4.199  -5.655
  141   HD12  LEU  20          2HD1      LEU  20  -1.815   3.493  -7.110
  142   HD13  LEU  20          3HD1      LEU  20  -0.925   4.731  -6.221
  143   HD21  LEU  20          3HD2      LEU  20   1.189   3.000  -5.800
  144   HD22  LEU  20          1HD2      LEU  20   0.222   2.198  -7.040
  145   HD23  LEU  20          2HD2      LEU  20   0.659   1.330  -5.583
  146    H    CYS  21           H        CYS  21   2.084   3.243  -1.894
  147    HA   CYS  21           HA       CYS  21   0.846   3.871   0.767
  148    HB2  CYS  21           1HB      CYS  21   3.582   2.723   0.122
  149    HB3  CYS  21           2HB      CYS  21   3.134   3.352   1.710
  150    HG   CYS  21           HG       CYS  21   1.416   1.453   1.976
  151    H    PHE  22           H        PHE  22   0.729   6.008   0.947
  152    HA   PHE  22           HA       PHE  22   2.670   7.793  -0.400
  153    HB2  PHE  22           1HB      PHE  22   1.116   9.591   0.273
  154    HB3  PHE  22           2HB      PHE  22   0.283   8.323  -0.623
  155    HD1  PHE  22           HD1      PHE  22   0.747   9.860   2.731
  156    HD2  PHE  22           HD2      PHE  22  -1.338   6.807   0.509
  157    HE1  PHE  22           HE1      PHE  22  -0.826   9.548   4.621
  158    HE2  PHE  22           HE2      PHE  22  -2.904   6.507   2.404
  159    HZ   PHE  22           HZ       PHE  22  -2.654   7.880   4.459
  160    H    HIS  23           H        HIS  23   3.812   9.403   0.757
  161    HA   HIS  23           HA       HIS  23   3.913   9.367   3.671
  162    HB2  HIS  23           1HB      HIS  23   5.327   7.391   3.013
  163    HB3  HIS  23           2HB      HIS  23   6.371   8.470   2.095
  164    HD1  HIS  23           HD1      HIS  23   5.177   7.881   5.661
  165    HD2  HIS  23           HD2      HIS  23   8.298   9.777   3.650
  166    HE1  HIS  23           HE1      HIS  23   6.828   8.617   7.434
  167    HE2  HIS  23           HE2      HIS  23   8.738   9.774   6.225
  168    H    GLY  24           H        GLY  24   3.825  11.029   0.981
  169    HA2  GLY  24           1HA      GLY  24   4.648  13.486   2.077
  170    HA3  GLY  24           2HA      GLY  24   5.956  12.889   1.057
  171    HA   PRO  25           HA       PRO  25   2.899  15.407  -1.527
  172    HB2  PRO  25           1HB      PRO  25   5.584  16.116  -2.766
  173    HB3  PRO  25           2HB      PRO  25   4.179  17.175  -2.475
  174    HG2  PRO  25           1HG      PRO  25   6.234  17.352  -0.838
  175    HG3  PRO  25           2HG      PRO  25   4.600  17.254  -0.134
  176    HD2  PRO  25           1HD      PRO  25   6.631  15.003  -0.434
  177    HD3  PRO  25           2HD      PRO  25   5.678  15.457   1.003
  178    H    LEU  26           H        LEU  26   4.755  12.690  -1.920
  179    HA   LEU  26           HA       LEU  26   3.728  12.170  -4.668
  180    HB2  LEU  26           1HB      LEU  26   6.555  11.847  -3.643
  181    HB3  LEU  26           2HB      LEU  26   5.996  10.824  -4.957
  182    HG   LEU  26           HG       LEU  26   5.717  13.866  -5.161
  183   HD11  LEU  26          1HD1      LEU  26   8.146  12.224  -5.959
  184   HD12  LEU  26          2HD1      LEU  26   8.094  13.444  -4.687
  185   HD13  LEU  26          3HD1      LEU  26   7.888  13.923  -6.368
  186   HD21  LEU  26          3HD2      LEU  26   6.032  11.667  -7.270
  187   HD22  LEU  26          1HD2      LEU  26   5.792  13.381  -7.607
  188   HD23  LEU  26          2HD2      LEU  26   4.514  12.444  -6.852
  189    H    ILE  27           H        ILE  27   3.299  10.094  -5.181
  190    HA   ILE  27           HA       ILE  27   2.749   8.274  -2.908
  191    HB   ILE  27           HB       ILE  27   1.715   8.246  -5.783
  192   HG12  ILE  27          1HG1      ILE  27   0.275   9.085  -3.212
  193   HG13  ILE  27          2HG1      ILE  27   0.955  10.233  -4.358
  194   HG21  ILE  27          1HG2      ILE  27   1.688   5.987  -4.741
  195   HG22  ILE  27          2HG2      ILE  27   0.049   6.599  -4.860
  196   HG23  ILE  27          3HG2      ILE  27   0.890   6.645  -3.314
  197   HD11  ILE  27          3HD1      ILE  27  -0.508   9.299  -6.142
  198   HD12  ILE  27          1HD1      ILE  27  -1.426   9.965  -4.793
  199   HD13  ILE  27          2HD1      ILE  27  -1.237   8.222  -4.951
  200    H    TYR  28           H        TYR  28   3.593   6.264  -2.824
  201    HA   TYR  28           HA       TYR  28   5.640   5.428  -4.858
  202    HB2  TYR  28           1HB      TYR  28   5.593   4.993  -1.845
  203    HB3  TYR  28           2HB      TYR  28   6.841   4.407  -2.949
  204    HD1  TYR  28           HD2      TYR  28   5.317   7.459  -1.427
  205    HD2  TYR  28           HD1      TYR  28   8.491   5.970  -3.945
  206    HE1  TYR  28           HE2      TYR  28   6.448   9.664  -1.328
  207    HE2  TYR  28           HE1      TYR  28   9.600   8.184  -3.836
  208    HH   TYR  28           HH       TYR  28   8.499  10.776  -3.303
  209    H    GLU  29           H        GLU  29   5.795   3.237  -5.318
  210    HA   GLU  29           HA       GLU  29   3.310   1.736  -5.135
  211    HB2  GLU  29           1HB      GLU  29   4.700   1.825  -7.208
  212    HB3  GLU  29           2HB      GLU  29   5.981   0.946  -6.377
  213    HG2  GLU  29           1HG      GLU  29   4.461  -0.988  -6.043
  214    HG3  GLU  29           2HG      GLU  29   3.145  -0.099  -6.805
  215    H    ALA  30           H        ALA  30   2.949  -0.099  -3.995
  216    HA   ALA  30           HA       ALA  30   5.067  -1.454  -2.469
  217    HB1  ALA  30           3HB      ALA  30   3.945  -1.107  -0.323
  218    HB2  ALA  30           1HB      ALA  30   2.692  -0.143  -1.096
  219    HB3  ALA  30           2HB      ALA  30   4.349   0.451  -1.028
  220    H    LYS  31           H        LYS  31   3.950  -3.304  -1.148
  221    HA   LYS  31           HA       LYS  31   1.487  -4.336  -2.418
  222    HB2  LYS  31           1HB      LYS  31   3.393  -5.096  -3.860
  223    HB3  LYS  31           2HB      LYS  31   4.092  -5.915  -2.467
  224    HG2  LYS  31           1HG      LYS  31   2.105  -7.377  -2.289
  225    HG3  LYS  31           2HG      LYS  31   1.314  -6.496  -3.592
  226    HD2  LYS  31           1HD      LYS  31   2.236  -8.578  -4.476
  227    HD3  LYS  31           2HD      LYS  31   3.123  -7.217  -5.156
  228    HE2  LYS  31           1HE      LYS  31   4.218  -8.562  -2.657
  229    HE3  LYS  31           2HE      LYS  31   4.470  -9.317  -4.229
  230    HZ1  LYS  31           3HZ      LYS  31   6.090  -7.900  -4.622
  231    HZ2  LYS  31           1HZ      LYS  31   5.844  -7.152  -3.119
  232    HZ3  LYS  31           2HZ      LYS  31   5.017  -6.588  -4.492
  233    H    VAL  32           H        VAL  32   0.369  -5.765  -1.189
  234    HA   VAL  32           HA       VAL  32   1.067  -5.937   1.648
  235    HB   VAL  32           HB       VAL  32  -1.408  -7.057   0.235
  236   HG11  VAL  32          1HG1      VAL  32  -0.889  -6.264   3.136
  237   HG12  VAL  32          2HG1      VAL  32  -1.016  -7.916   2.537
  238   HG13  VAL  32          3HG1      VAL  32  -2.422  -6.857   2.496
  239   HG21  VAL  32          3HG2      VAL  32  -2.530  -4.940   0.906
  240   HG22  VAL  32          1HG2      VAL  32  -1.228  -4.647  -0.240
  241   HG23  VAL  32          2HG2      VAL  32  -0.985  -4.309   1.470
  242    H    LEU  33           H        LEU  33   2.329  -7.566   2.314
  243    HA   LEU  33           HA       LEU  33   2.477 -10.096   0.809
  244    HB2  LEU  33           1HB      LEU  33   4.428  -8.642   2.112
  245    HB3  LEU  33           2HB      LEU  33   4.054  -9.822   3.359
  246    HG   LEU  33           HG       LEU  33   4.880 -10.471   0.499
  247   HD11  LEU  33          1HD1      LEU  33   6.967 -11.301   1.541
  248   HD12  LEU  33          2HD1      LEU  33   6.382 -10.783   3.124
  249   HD13  LEU  33          3HD1      LEU  33   6.730  -9.585   1.875
  250   HD21  LEU  33          3HD2      LEU  33   3.461 -12.280   1.213
  251   HD22  LEU  33          1HD2      LEU  33   4.127 -12.274   2.846
  252   HD23  LEU  33          2HD2      LEU  33   5.092 -12.857   1.489
  253    H    LYS  34           H        LYS  34   1.288  -8.903   3.893
  254    HA   LYS  34           HA       LYS  34  -0.319 -11.328   4.246
  255    HB2  LYS  34           1HB      LYS  34   2.002 -11.773   5.275
  256    HB3  LYS  34           2HB      LYS  34   1.607 -10.583   6.493
  257    HG2  LYS  34           1HG      LYS  34  -0.497 -11.962   7.007
  258    HG3  LYS  34           2HG      LYS  34   0.169 -13.217   5.969
  259    HD2  LYS  34           1HD      LYS  34   1.445 -12.089   8.505
  260    HD3  LYS  34           2HD      LYS  34   0.708 -13.678   8.334
  261    HE2  LYS  34           1HE      LYS  34   2.483 -14.119   6.481
  262    HE3  LYS  34           2HE      LYS  34   3.314 -12.693   7.117
  263    HZ1  LYS  34           3HZ      LYS  34   2.482 -15.005   8.776
  264    HZ2  LYS  34           1HZ      LYS  34   3.455 -13.696   9.247
  265    HZ3  LYS  34           2HZ      LYS  34   4.034 -14.818   8.110
  266    H    THR  35           H        THR  35  -1.928 -11.104   5.849
  267    HA   THR  35           HA       THR  35  -2.382  -8.398   6.998
  268    HB   THR  35           HB       THR  35  -3.545  -8.256   4.876
  269    HG1  THR  35           HG1      THR  35  -5.110  -8.812   7.143
  270   HG21  THR  35          3HG2      THR  35  -5.273  -9.945   4.250
  271   HG22  THR  35          1HG2      THR  35  -4.745 -10.970   5.571
  272   HG23  THR  35          2HG2      THR  35  -3.647 -10.618   4.242
  273    H    LYS  36           H        LYS  36  -3.633  -8.378   8.810
  274    HA   LYS  36           HA       LYS  36  -4.392 -11.055   9.950
  275    HB2  LYS  36           1HB      LYS  36  -2.568  -9.859  11.132
  276    HB3  LYS  36           2HB      LYS  36  -3.665  -8.536  11.452
  277    HG2  LYS  36           1HG      LYS  36  -5.159 -10.041  12.736
  278    HG3  LYS  36           2HG      LYS  36  -4.105 -11.405  12.360
  279    HD2  LYS  36           1HD      LYS  36  -2.241 -10.295  13.583
  280    HD3  LYS  36           2HD      LYS  36  -3.315  -8.954  13.984
  281    HE2  LYS  36           1HE      LYS  36  -4.801 -10.511  15.217
  282    HE3  LYS  36           2HE      LYS  36  -3.730 -11.855  14.810
  283    HZ1  LYS  36           3HZ      LYS  36  -3.519 -10.376  17.024
  284    HZ2  LYS  36           1HZ      LYS  36  -2.431  -9.567  16.005
  285    HZ3  LYS  36           2HZ      LYS  36  -2.227 -11.225  16.318
  286    HA   PRO  37           HA       PRO  37  -8.363  -8.607   9.527
  287    HB2  PRO  37           1HB      PRO  37  -9.931 -10.389   8.258
  288    HB3  PRO  37           2HB      PRO  37  -8.602  -9.598   7.371
  289    HG2  PRO  37           1HG      PRO  37  -8.587 -12.312   8.709
  290    HG3  PRO  37           2HG      PRO  37  -8.154 -11.908   7.029
  291    HD2  PRO  37           1HD      PRO  37  -6.246 -12.124   8.992
  292    HD3  PRO  37           2HD      PRO  37  -6.063 -10.961   7.660
  293    H    ASP  38           H        ASP  38  -7.255 -10.834  11.546
  294    HA   ASP  38           HA       ASP  38  -9.573 -12.085  12.653
  295    HB2  ASP  38           1HB      ASP  38  -7.239 -12.906  12.935
  296    HB3  ASP  38           2HB      ASP  38  -6.882 -11.514  13.950
  297    H    ALA  39           H        ALA  39  -8.882  -8.883  12.544
  298    HA   ALA  39           HA       ALA  39 -10.742  -8.218  14.679
  299    HB1  ALA  39           3HB      ALA  39  -8.656  -8.552  15.977
  300    HB2  ALA  39           1HB      ALA  39  -9.155  -6.860  16.005
  301    HB3  ALA  39           2HB      ALA  39  -7.829  -7.376  14.958
  302    H    THR  40           H        THR  40 -11.229  -5.943  14.762
  303    HA   THR  40           HA       THR  40 -10.335  -4.306  12.461
  304    HB   THR  40           HB       THR  40 -12.634  -3.720  11.876
  305    HG1  THR  40           HG1      THR  40 -13.414  -5.689  13.752
  306   HG21  THR  40          3HG2      THR  40 -11.545  -5.778  10.842
  307   HG22  THR  40          1HG2      THR  40 -13.310  -5.829  10.870
  308   HG23  THR  40          2HG2      THR  40 -12.387  -6.749  12.052
  309    HA   PRO  41           HA       PRO  41  -9.568  -2.207  12.132
  310    HB2  PRO  41           1HB      PRO  41  -7.765  -0.442  13.150
  311    HB3  PRO  41           2HB      PRO  41  -9.438   0.063  12.798
  312    HG2  PRO  41           1HG      PRO  41  -8.303  -0.881  15.445
  313    HG3  PRO  41           2HG      PRO  41  -9.170   0.640  15.096
  314    HD2  PRO  41           1HD      PRO  41 -10.543  -1.453  16.097
  315    HD3  PRO  41           2HD      PRO  41 -11.267  -0.484  14.788
  316    H    VAL  42           H        VAL  42  -7.077  -2.377  11.868
  317    HA   VAL  42           HA       VAL  42  -5.579  -3.876  13.835
  318    HB   VAL  42           HB       VAL  42  -7.207  -5.608  13.048
  319   HG11  VAL  42          1HG1      VAL  42  -7.206  -6.415  10.754
  320   HG12  VAL  42          2HG1      VAL  42  -5.858  -5.369  10.327
  321   HG13  VAL  42          3HG1      VAL  42  -7.432  -4.671  10.704
  322   HG21  VAL  42          3HG2      VAL  42  -5.627  -7.386  12.907
  323   HG22  VAL  42          1HG2      VAL  42  -4.711  -6.132  13.724
  324   HG23  VAL  42          2HG2      VAL  42  -4.474  -6.419  12.008
  325    H    GLU  43           H        GLU  43  -3.557  -4.904  12.678
  326    HA   GLU  43           HA       GLU  43  -2.356  -2.801  10.989
  327    HB2  GLU  43           1HB      GLU  43  -0.216  -3.884  11.632
  328    HB3  GLU  43           2HB      GLU  43  -1.154  -3.393  13.043
  329    HG2  GLU  43           1HG      GLU  43  -1.989  -5.728  13.292
  330    HG3  GLU  43           2HG      GLU  43  -1.024  -6.223  11.907
  331    H    TYR  44           H        TYR  44  -0.949  -3.472   9.247
  332    HA   TYR  44           HA       TYR  44  -1.643  -6.027   7.881
  333    HB2  TYR  44           1HB      TYR  44  -1.709  -3.219   6.711
  334    HB3  TYR  44           2HB      TYR  44  -1.864  -4.701   5.765
  335    HD1  TYR  44           HD1      TYR  44  -3.493  -2.615   8.422
  336    HD2  TYR  44           HD2      TYR  44  -3.962  -6.004   5.798
  337    HE1  TYR  44           HE1      TYR  44  -5.910  -2.737   8.979
  338    HE2  TYR  44           HE2      TYR  44  -6.372  -6.102   6.366
  339    HH   TYR  44           HH       TYR  44  -7.986  -3.594   7.978
  340    H    TYR  45           H        TYR  45  -0.061  -6.906   6.685
  341    HA   TYR  45           HA       TYR  45   2.683  -5.881   7.158
  342    HB2  TYR  45           1HB      TYR  45   1.980  -8.350   7.391
  343    HB3  TYR  45           2HB      TYR  45   1.987  -8.411   5.638
  344    HD1  TYR  45           HD1      TYR  45   4.171  -7.648   4.381
  345    HD2  TYR  45           HD2      TYR  45   4.096  -8.610   8.574
  346    HE1  TYR  45           HE1      TYR  45   6.621  -7.991   4.358
  347    HE2  TYR  45           HE2      TYR  45   6.549  -8.944   8.535
  348    HH   TYR  45           HH       TYR  45   8.477  -8.061   5.793
  349    H    ILE  46           H        ILE  46   3.471  -4.454   5.755
  350    HA   ILE  46           HA       ILE  46   3.194  -4.951   2.840
  351    HB   ILE  46           HB       ILE  46   2.846  -2.153   4.031
  352   HG12  ILE  46          1HG1      ILE  46   0.698  -4.248   3.414
  353   HG13  ILE  46          2HG1      ILE  46   0.992  -3.445   4.955
  354   HG21  ILE  46          1HG2      ILE  46   1.981  -3.268   1.323
  355   HG22  ILE  46          2HG2      ILE  46   3.530  -2.484   1.583
  356   HG23  ILE  46          3HG2      ILE  46   2.045  -1.576   1.800
  357   HD11  ILE  46          3HD1      ILE  46  -0.118  -2.228   2.432
  358   HD12  ILE  46          1HD1      ILE  46   0.387  -1.277   3.827
  359   HD13  ILE  46          2HD1      ILE  46  -0.926  -2.446   3.978
  360    H    HIS  47           H        HIS  47   4.885  -4.198   1.611
  361    HA   HIS  47           HA       HIS  47   7.197  -2.887   2.894
  362    HB2  HIS  47           1HB      HIS  47   8.733  -4.603   1.962
  363    HB3  HIS  47           2HB      HIS  47   7.635  -5.300   3.150
  364    HD1  HIS  47           HD1      HIS  47   8.977  -6.070  -0.012
  365    HD2  HIS  47           HD2      HIS  47   5.126  -6.316   1.567
  366    HE1  HIS  47           HE1      HIS  47   7.711  -7.713  -1.464
  367    HE2  HIS  47           HE2      HIS  47   5.359  -7.868  -0.517
  368    H    TYR  48           H        TYR  48   8.487  -1.779   1.451
  369    HA   TYR  48           HA       TYR  48   7.246  -0.752  -0.898
  370    HB2  TYR  48           1HB      TYR  48  10.139  -0.599   0.032
  371    HB3  TYR  48           2HB      TYR  48   9.438   0.391  -1.249
  372    HD1  TYR  48           HD2      TYR  48   7.347   1.828  -0.682
  373    HD2  TYR  48           HD1      TYR  48   9.902   0.136   2.359
  374    HE1  TYR  48           HE2      TYR  48   6.451   3.431   0.984
  375    HE2  TYR  48           HE1      TYR  48   8.990   1.748   4.006
  376    HH   TYR  48           HH       TYR  48   7.590   3.423   4.359
  377    H    ALA  49           H        ALA  49   7.436  -1.305  -3.010
  378    HA   ALA  49           HA       ALA  49   8.256  -3.911  -3.766
  379    HB1  ALA  49           3HB      ALA  49   7.781  -3.156  -6.074
  380    HB2  ALA  49           1HB      ALA  49   7.728  -1.481  -5.518
  381    HB3  ALA  49           2HB      ALA  49   6.513  -2.630  -4.963
  382    H    GLY  50           H        GLY  50  10.075  -4.670  -4.791
  383    HA2  GLY  50           1HA      GLY  50  12.189  -4.702  -5.755
  384    HA3  GLY  50           2HA      GLY  50  12.209  -2.943  -5.770
  385    H    TRP  51           H        TRP  51  11.473  -4.677  -2.836
  386    HA   TRP  51           HA       TRP  51  14.236  -4.401  -1.781
  387    HB2  TRP  51           1HB      TRP  51  11.776  -3.150  -0.487
  388    HB3  TRP  51           2HB      TRP  51  13.389  -3.208   0.224
  389    HD1  TRP  51           HD1      TRP  51  11.302  -1.130  -2.076
  390    HE1  TRP  51           HE1      TRP  51  12.730   0.732  -3.135
  391    HE3  TRP  51           HE3      TRP  51  15.962  -2.740  -0.750
  392    HZ2  TRP  51           HZ2      TRP  51  15.485   1.445  -3.393
  393    HZ3  TRP  51           HZ3      TRP  51  17.974  -1.450  -1.417
  394    HH2  TRP  51           HH2      TRP  51  17.741   0.640  -2.736
  395    H    SER  52           H        SER  52  14.604  -5.552   0.152
  396    HA   SER  52           HA       SER  52  13.393  -8.136   0.224
  397    HB2  SER  52           1HB      SER  52  14.852  -8.530   2.151
  398    HB3  SER  52           2HB      SER  52  15.744  -7.660   0.904
  399    HG   SER  52           HG       SER  52  16.047  -6.173   2.339
  400    H    LYS  53           H        LYS  53  12.269  -9.100   2.012
  401    HA   LYS  53           HA       LYS  53  10.175  -7.407   3.129
  402    HB2  LYS  53           1HB      LYS  53   9.155  -9.535   3.846
  403    HB3  LYS  53           2HB      LYS  53   9.573  -9.566   2.133
  404    HG2  LYS  53           1HG      LYS  53  11.657 -10.821   2.675
  405    HG3  LYS  53           2HG      LYS  53  11.203 -10.831   4.381
  406    HD2  LYS  53           1HD      LYS  53   9.130 -12.079   3.836
  407    HD3  LYS  53           2HD      LYS  53   9.564 -12.064   2.124
  408    HE2  LYS  53           1HE      LYS  53  10.176 -14.223   3.171
  409    HE3  LYS  53           2HE      LYS  53  11.618 -13.359   2.634
  410    HZ1  LYS  53           3HZ      LYS  53  11.163 -14.316   5.142
  411    HZ2  LYS  53           1HZ      LYS  53  10.838 -12.658   5.297
  412    HZ3  LYS  53           2HZ      LYS  53  12.347 -13.177   4.711
  413    H    ASN  54           H        ASN  54  13.242  -8.178   4.135
  414    HA   ASN  54           HA       ASN  54  12.921  -8.847   6.866
  415    HB2  ASN  54           1HB      ASN  54  15.191  -7.306   5.550
  416    HB3  ASN  54           2HB      ASN  54  15.265  -8.141   7.102
  417   HD21  ASN  54          2HD2      ASN  54  17.105  -9.336   5.921
  418   HD22  ASN  54          1HD2      ASN  54  16.683 -10.683   4.977
  419    H    TRP  55           H        TRP  55  12.536  -5.869   5.163
  420    HA   TRP  55           HA       TRP  55  12.926  -4.035   7.333
  421    HB2  TRP  55           1HB      TRP  55  11.319  -3.801   4.754
  422    HB3  TRP  55           2HB      TRP  55  11.611  -2.454   5.855
  423    HD1  TRP  55           HD1      TRP  55  13.721  -5.068   3.913
  424    HE1  TRP  55           HE1      TRP  55  15.887  -3.919   3.124
  425    HE3  TRP  55           HE3      TRP  55  13.062  -0.439   5.970
  426    HZ2  TRP  55           HZ2      TRP  55  17.172  -1.373   3.333
  427    HZ3  TRP  55           HZ3      TRP  55  14.772   1.330   5.659
  428    HH2  TRP  55           HH2      TRP  55  16.826   0.869   4.343
  429    H    ASP  56           H        ASP  56  10.225  -5.940   6.199
  430    HA   ASP  56           HA       ASP  56   8.014  -6.097   6.880
  431    HB2  ASP  56           1HB      ASP  56   7.875  -6.921   9.205
  432    HB3  ASP  56           2HB      ASP  56   9.265  -7.606   8.368
  433    H    GLU  57           H        GLU  57   7.483  -3.818   6.302
  434    HA   GLU  57           HA       GLU  57   7.265  -1.920   8.547
  435    HB2  GLU  57           1HB      GLU  57   8.026  -1.320   6.154
  436    HB3  GLU  57           2HB      GLU  57   6.343  -1.483   5.676
  437    HG2  GLU  57           1HG      GLU  57   5.738   0.218   7.436
  438    HG3  GLU  57           2HG      GLU  57   7.444   0.432   7.777
  439    H    TRP  58           H        TRP  58   5.640  -2.581   9.871
  440    HA   TRP  58           HA       TRP  58   3.034  -3.458   8.868
  441    HB2  TRP  58           1HB      TRP  58   4.444  -3.388  11.519
  442    HB3  TRP  58           2HB      TRP  58   2.712  -3.119  11.630
  443    HD1  TRP  58           HD1      TRP  58   1.288  -5.041  10.015
  444    HE1  TRP  58           HE1      TRP  58   1.559  -7.595  10.160
  445    HE3  TRP  58           HE3      TRP  58   5.936  -5.317  12.115
  446    HZ2  TRP  58           HZ2      TRP  58   3.476  -9.515  11.039
  447    HZ3  TRP  58           HZ3      TRP  58   6.962  -7.525  12.604
  448    HH2  TRP  58           HH2      TRP  58   5.739  -9.622  12.074
  449    H    VAL  59           H        VAL  59   1.311  -2.133   8.527
  450    HA   VAL  59           HA       VAL  59   1.229   0.527   9.815
  451    HB   VAL  59           HB       VAL  59   0.560   1.562   7.562
  452   HG11  VAL  59          1HG1      VAL  59   3.368   0.437   7.763
  453   HG12  VAL  59          2HG1      VAL  59   2.813   1.921   8.523
  454   HG13  VAL  59          3HG1      VAL  59   2.886   1.802   6.764
  455   HG21  VAL  59          3HG2      VAL  59   1.240   0.337   5.527
  456   HG22  VAL  59          1HG2      VAL  59   0.031  -0.585   6.418
  457   HG23  VAL  59          2HG2      VAL  59   1.730  -1.047   6.501
  458    HA   PRO  60           HA       PRO  60  -3.144  -0.335  10.026
  459    HB2  PRO  60           1HB      PRO  60  -3.832   2.567  10.070
  460    HB3  PRO  60           2HB      PRO  60  -3.876   1.408  11.417
  461    HG2  PRO  60           1HG      PRO  60  -2.044   3.397  11.346
  462    HG3  PRO  60           2HG      PRO  60  -1.637   1.785  11.990
  463    HD2  PRO  60           1HD      PRO  60  -1.142   2.820   9.163
  464    HD3  PRO  60           2HD      PRO  60   0.030   2.156  10.312
  465    H    GLU  61           H        GLU  61  -5.140  -0.168   8.859
  466    HA   GLU  61           HA       GLU  61  -4.970  -0.183   6.071
  467    HB2  GLU  61           1HB      GLU  61  -7.490  -0.060   6.119
  468    HB3  GLU  61           2HB      GLU  61  -6.827  -1.260   7.223
  469    HG2  GLU  61           1HG      GLU  61  -7.042   0.343   9.112
  470    HG3  GLU  61           2HG      GLU  61  -7.713   1.545   8.014
  471    H    ASN  62           H        ASN  62  -5.052   2.515   8.146
  472    HA   ASN  62           HA       ASN  62  -6.358   4.452   6.531
  473    HB2  ASN  62           1HB      ASN  62  -5.841   4.719   8.959
  474    HB3  ASN  62           2HB      ASN  62  -4.138   4.900   8.561
  475   HD21  ASN  62          2HD2      ASN  62  -5.552   6.988   9.881
  476   HD22  ASN  62          1HD2      ASN  62  -5.700   8.307   8.824
  477    H    ARG  63           H        ARG  63  -2.918   3.516   6.721
  478    HA   ARG  63           HA       ARG  63  -2.100   5.472   4.704
  479    HB2  ARG  63           1HB      ARG  63  -0.626   3.248   6.162
  480    HB3  ARG  63           2HB      ARG  63   0.153   4.287   4.966
  481    HG2  ARG  63           1HG      ARG  63  -0.409   6.281   6.316
  482    HG3  ARG  63           2HG      ARG  63  -1.211   5.260   7.510
  483    HD2  ARG  63           1HD      ARG  63   0.931   4.120   7.989
  484    HD3  ARG  63           2HD      ARG  63   1.733   5.095   6.760
  485    HE   ARG  63           HE       ARG  63   1.836   6.844   8.270
  486   HH11  ARG  63          1HH2      ARG  63  -0.595   4.593   9.298
  487   HH12  ARG  63          2HH2      ARG  63  -0.876   5.378  10.815
  488   HH21  ARG  63          1HH1      ARG  63   1.448   7.884  10.248
  489   HH22  ARG  63          2HH1      ARG  63   0.274   7.239  11.348
  490    H    VAL  64           H        VAL  64  -3.736   2.623   4.468
  491    HA   VAL  64           HA       VAL  64  -2.365   1.675   2.016
  492    HB   VAL  64           HB       VAL  64  -4.753   0.436   3.458
  493   HG11  VAL  64          1HG1      VAL  64  -4.388  -0.308   1.103
  494   HG12  VAL  64          2HG1      VAL  64  -4.049  -1.606   2.240
  495   HG13  VAL  64          3HG1      VAL  64  -2.721  -0.718   1.492
  496   HG21  VAL  64          3HG2      VAL  64  -3.064  -1.093   4.489
  497   HG22  VAL  64          1HG2      VAL  64  -2.833   0.574   5.007
  498   HG23  VAL  64          2HG2      VAL  64  -1.775  -0.116   3.787
  499    H    LEU  65           H        LEU  65  -3.075   2.240   0.075
  500    HA   LEU  65           HA       LEU  65  -5.857   3.280  -0.269
  501    HB2  LEU  65           1HB      LEU  65  -4.102   5.033  -0.488
  502    HB3  LEU  65           2HB      LEU  65  -3.361   4.106  -1.780
  503    HG   LEU  65           HG       LEU  65  -5.475   4.345  -3.130
  504   HD11  LEU  65          1HD1      LEU  65  -7.270   4.642  -1.599
  505   HD12  LEU  65          2HD1      LEU  65  -7.085   6.245  -2.276
  506   HD13  LEU  65          3HD1      LEU  65  -6.423   5.887  -0.682
  507   HD21  LEU  65          3HD2      LEU  65  -5.180   6.748  -3.659
  508   HD22  LEU  65          1HD2      LEU  65  -3.620   5.960  -3.418
  509   HD23  LEU  65          2HD2      LEU  65  -4.304   6.976  -2.146
  510    H    LYS  66           H        LYS  66  -7.084   2.360  -1.789
  511    HA   LYS  66           HA       LYS  66  -6.420  -0.113  -2.957
  512    HB2  LYS  66           1HB      LYS  66  -8.541   0.200  -4.264
  513    HB3  LYS  66           2HB      LYS  66  -8.741   0.510  -2.538
  514    HG2  LYS  66           1HG      LYS  66  -8.519   2.961  -2.961
  515    HG3  LYS  66           2HG      LYS  66  -8.373   2.642  -4.689
  516    HD2  LYS  66           1HD      LYS  66 -10.631   1.598  -4.687
  517    HD3  LYS  66           2HD      LYS  66 -10.778   1.929  -2.961
  518    HE2  LYS  66           1HE      LYS  66 -10.435   4.035  -5.132
  519    HE3  LYS  66           2HE      LYS  66 -11.943   3.665  -4.293
  520    HZ1  LYS  66           3HZ      LYS  66  -9.461   4.819  -3.163
  521    HZ2  LYS  66           1HZ      LYS  66 -10.678   4.160  -2.183
  522    HZ3  LYS  66           2HZ      LYS  66 -11.020   5.493  -3.179
  523    H    TYR  67           H        TYR  67  -5.756  -0.715  -4.992
  524    HA   TYR  67           HA       TYR  67  -4.328   1.308  -6.566
  525    HB2  TYR  67           1HB      TYR  67  -3.337  -0.924  -6.070
  526    HB3  TYR  67           2HB      TYR  67  -4.606  -1.699  -7.011
  527    HD1  TYR  67           HD2      TYR  67  -4.694  -1.406  -9.509
  528    HD2  TYR  67           HD1      TYR  67  -1.529   0.373  -7.180
  529    HE1  TYR  67           HE2      TYR  67  -3.387  -0.991 -11.578
  530    HE2  TYR  67           HE1      TYR  67  -0.241   0.784  -9.259
  531    HH   TYR  67           HH       TYR  67  -1.598   0.047 -12.448
  532    H    ASN  68           H        ASN  68  -5.360   2.412  -8.081
  533    HA   ASN  68           HA       ASN  68  -7.155   1.081  -9.990
  534    HB2  ASN  68           1HB      ASN  68  -8.636   1.769  -8.106
  535    HB3  ASN  68           2HB      ASN  68  -8.110   3.437  -8.308
  536   HD21  ASN  68          2HD2      ASN  68 -10.226   4.202  -8.955
  537   HD22  ASN  68          1HD2      ASN  68 -10.925   3.768 -10.438
  538    H    ASP  69           H        ASP  69  -7.231   2.086 -11.939
  539    HA   ASP  69           HA       ASP  69  -5.160   3.571 -12.894
  540    HB2  ASP  69           1HB      ASP  69  -6.884   2.477 -14.302
  541    HB3  ASP  69           2HB      ASP  69  -8.035   3.734 -13.862
  542    H    ASP  70           H        ASP  70  -7.897   4.798 -11.096
  543    HA   ASP  70           HA       ASP  70  -7.569   7.583 -11.747
  544    HB2  ASP  70           1HB      ASP  70  -8.955   6.240  -9.396
  545    HB3  ASP  70           2HB      ASP  70  -9.134   7.932  -9.860
  546    H    ASN  71           H        ASN  71  -6.592   5.554  -8.962
  547    HA   ASN  71           HA       ASN  71  -5.291   7.661  -7.516
  548    HB2  ASN  71           1HB      ASN  71  -4.865   4.650  -7.398
  549    HB3  ASN  71           2HB      ASN  71  -4.241   5.812  -6.228
  550   HD21  ASN  71          2HD2      ASN  71  -6.519   7.536  -6.017
  551   HD22  ASN  71          1HD2      ASN  71  -7.782   6.656  -5.303
  552    H    VAL  72           H        VAL  72  -4.303   5.415 -10.013
  553    HA   VAL  72           HA       VAL  72  -1.475   5.955  -9.920
  554    HB   VAL  72           HB       VAL  72  -3.216   4.951 -12.214
  555   HG11  VAL  72          1HG1      VAL  72  -1.063   5.792 -13.089
  556   HG12  VAL  72          2HG1      VAL  72  -1.056   4.036 -13.125
  557   HG13  VAL  72          3HG1      VAL  72  -0.188   4.890 -11.851
  558   HG21  VAL  72          3HG2      VAL  72  -3.281   3.494 -10.200
  559   HG22  VAL  72          1HG2      VAL  72  -1.518   3.442 -10.179
  560   HG23  VAL  72          2HG2      VAL  72  -2.410   2.706 -11.512
  561    H    LYS  73           H        LYS  73  -4.215   7.250 -11.738
  562    HA   LYS  73           HA       LYS  73  -2.865   9.073 -13.396
  563    HB2  LYS  73           1HB      LYS  73  -5.264   8.419 -13.580
  564    HB3  LYS  73           2HB      LYS  73  -5.630   9.389 -12.170
  565    HG2  LYS  73           1HG      LYS  73  -4.752  11.414 -13.394
  566    HG3  LYS  73           2HG      LYS  73  -4.556  10.414 -14.829
  567    HD2  LYS  73           1HD      LYS  73  -7.204  10.881 -13.380
  568    HD3  LYS  73           2HD      LYS  73  -6.699  11.730 -14.834
  569    HE2  LYS  73           1HE      LYS  73  -6.523   9.426 -15.975
  570    HE3  LYS  73           2HE      LYS  73  -7.384   8.775 -14.579
  571    HZ1  LYS  73           3HZ      LYS  73  -9.287   9.699 -15.213
  572    HZ2  LYS  73           1HZ      LYS  73  -8.563   9.814 -16.742
  573    HZ3  LYS  73           2HZ      LYS  73  -8.558  11.155 -15.700
  574    H    ARG  74           H        ARG  74  -4.023   9.422 -10.051
  575    HA   ARG  74           HA       ARG  74  -3.405  12.181  -9.729
  576    HB2  ARG  74           1HB      ARG  74  -3.574   9.911  -7.709
  577    HB3  ARG  74           2HB      ARG  74  -3.328  11.592  -7.235
  578    HG2  ARG  74           1HG      ARG  74  -5.460  12.223  -8.335
  579    HG3  ARG  74           2HG      ARG  74  -5.708  10.552  -8.827
  580    HD2  ARG  74           1HD      ARG  74  -7.024  11.013  -6.805
  581    HD3  ARG  74           2HD      ARG  74  -5.734   9.874  -6.423
  582    HE   ARG  74           HE       ARG  74  -4.794  11.469  -5.025
  583   HH11  ARG  74          1HH2      ARG  74  -7.038  13.014  -7.195
  584   HH12  ARG  74          2HH2      ARG  74  -6.910  14.561  -6.428
  585   HH21  ARG  74          1HH1      ARG  74  -4.647  13.497  -4.032
  586   HH22  ARG  74          2HH1      ARG  74  -5.563  14.833  -4.645
  587    H    ARG  75           H        ARG  75  -1.459   9.244  -9.376
  588    HA   ARG  75           HA       ARG  75   0.866  10.527  -8.288
  589    HB2  ARG  75           1HB      ARG  75   0.474   8.056  -8.158
  590    HB3  ARG  75           2HB      ARG  75   0.729   7.937  -9.894
  591    HG2  ARG  75           1HG      ARG  75   3.037   8.807  -9.638
  592    HG3  ARG  75           2HG      ARG  75   2.783   8.989  -7.904
  593    HD2  ARG  75           1HD      ARG  75   4.013   6.915  -8.330
  594    HD3  ARG  75           2HD      ARG  75   2.399   6.519  -7.743
  595    HE   ARG  75           HE       ARG  75   1.938   5.547  -9.800
  596   HH11  ARG  75          1HH2      ARG  75   4.693   7.650 -10.092
  597   HH12  ARG  75          2HH2      ARG  75   5.039   7.186 -11.726
  598   HH21  ARG  75          1HH1      ARG  75   2.396   4.955 -11.937
  599   HH22  ARG  75          2HH1      ARG  75   3.742   5.665 -12.765
  600    H    GLN  76           H        GLN  76  -0.297   9.827 -11.537
  601    HA   GLN  76           HA       GLN  76   2.036  10.706 -12.955
  602    HB2  GLN  76           1HB      GLN  76  -0.871  10.532 -13.843
  603    HB3  GLN  76           2HB      GLN  76   0.455  10.909 -14.934
  604    HG2  GLN  76           1HG      GLN  76   0.292   8.344 -13.283
  605    HG3  GLN  76           2HG      GLN  76  -0.223   8.465 -14.961
  606   HE21  GLN  76          2HE2      GLN  76   2.336   7.366 -13.205
  607   HE22  GLN  76          1HE2      GLN  76   3.595   7.661 -14.304
  608    H    GLU  77           H        GLU  77  -0.933  12.308 -11.881
  609    HA   GLU  77           HA       GLU  77  -0.427  14.878 -13.022
  610    HB2  GLU  77           1HB      GLU  77  -1.996  14.038 -10.555
  611    HB3  GLU  77           2HB      GLU  77  -1.951  15.709 -11.109
  612    HG2  GLU  77           1HG      GLU  77  -2.935  15.051 -13.269
  613    HG3  GLU  77           2HG      GLU  77  -2.927  13.367 -12.792
  614    H    LEU  78           H        LEU  78   0.271  13.581  -9.780
  615    HA   LEU  78           HA       LEU  78   1.684  15.806  -8.773
  616    HB2  LEU  78           1HB      LEU  78   1.788  12.851  -8.112
  617    HB3  LEU  78           2HB      LEU  78   2.651  14.048  -7.156
  618    HG   LEU  78           HG       LEU  78  -0.377  14.237  -7.610
  619   HD11  LEU  78          1HD1      LEU  78  -0.674  13.184  -5.375
  620   HD12  LEU  78          2HD1      LEU  78   1.062  12.873  -5.298
  621   HD13  LEU  78          3HD1      LEU  78   0.075  12.071  -6.518
  622   HD21  LEU  78          3HD2      LEU  78  -0.267  15.584  -5.463
  623   HD22  LEU  78          1HD2      LEU  78   0.645  16.330  -6.764
  624   HD23  LEU  78          2HD2      LEU  78   1.487  15.442  -5.503
  625    H    ALA  79           H        ALA  79   2.737  12.983 -10.609
  626    HA   ALA  79           HA       ALA  79   5.537  13.414 -10.448
  627    HB1  ALA  79           3HB      ALA  79   3.977  12.159 -12.730
  628    HB2  ALA  79           1HB      ALA  79   4.487  11.315 -11.270
  629    HB3  ALA  79           2HB      ALA  79   5.693  11.939 -12.397
  630    H    ARG  80           H        ARG  80   3.121  14.580 -12.790
  631    HA   ARG  80           HA       ARG  80   4.961  16.038 -14.444
  632    HB2  ARG  80           1HB      ARG  80   1.948  16.210 -14.035
  633    HB3  ARG  80           2HB      ARG  80   2.800  17.195 -15.228
  634    HG2  ARG  80           1HG      ARG  80   3.611  15.167 -16.370
  635    HG3  ARG  80           2HG      ARG  80   2.847  14.146 -15.159
  636    HD2  ARG  80           1HD      ARG  80   1.427  14.265 -17.167
  637    HD3  ARG  80           2HD      ARG  80   0.622  15.056 -15.813
  638    HE   ARG  80           HE       ARG  80   0.776  17.072 -16.949
  639   HH11  ARG  80          1HH2      ARG  80   2.987  14.776 -18.336
  640   HH12  ARG  80          2HH2      ARG  80   3.443  15.810 -19.649
  641   HH21  ARG  80          1HH1      ARG  80   1.386  18.420 -18.664
  642   HH22  ARG  80          2HH1      ARG  80   2.538  17.867 -19.834
  643    H    GLN  81           H        GLN  81   2.923  16.873 -11.670
  644    HA   GLN  81           HA       GLN  81   3.318  19.640 -11.622
  645    HB2  GLN  81           1HB      GLN  81   1.688  18.319 -10.209
  646    HB3  GLN  81           2HB      GLN  81   3.041  17.793  -9.217
  647    HG2  GLN  81           1HG      GLN  81   1.962  19.680  -8.105
  648    HG3  GLN  81           2HG      GLN  81   3.531  20.220  -8.686
  649   HE21  GLN  81          2HE2      GLN  81   0.220  19.936 -10.107
  650   HE22  GLN  81          1HE2      GLN  81   0.213  21.498 -10.768
  651    H    CYS  82           H        CYS  82   5.273  17.036 -10.210
  652    HA   CYS  82           HA       CYS  82   7.200  18.668  -8.912
  653    HB2  CYS  82           1HB      CYS  82   7.387  15.821  -9.950
  654    HB3  CYS  82           2HB      CYS  82   8.564  16.579  -8.873
  655    HG   CYS  82           HG       CYS  82   5.586  16.385  -7.962
  656    H    GLY  83           H        GLY  83   6.833  17.535 -12.207
  657    HA2  GLY  83           1HA      GLY  83   7.832  18.328 -14.141
  658    HA3  GLY  83           2HA      GLY  83   8.904  19.339 -13.178
  659    H    GLU  84           H        GLU  84  10.261  18.344 -15.053
  660    HA   GLU  84           HA       GLU  84  11.213  15.632 -14.750
  661    HB2  GLU  84           1HB      GLU  84  12.323  18.004 -16.296
  662    HB3  GLU  84           2HB      GLU  84  12.914  16.348 -16.444
  663    HG2  GLU  84           1HG      GLU  84  10.668  15.607 -17.192
  664    HG3  GLU  84           2HG      GLU  84  10.066  17.256 -17.037
  665    H    ARG  85           H        ARG  85  11.672  18.329 -12.900
  666    HA   ARG  85           HA       ARG  85  13.186  18.980 -11.295
  667    HB2  ARG  85           1HB      ARG  85  13.884  16.021 -11.379
  668    HB3  ARG  85           2HB      ARG  85  14.335  17.133 -10.086
  669    HG2  ARG  85           1HG      ARG  85  11.942  17.567  -9.609
  670    HG3  ARG  85           2HG      ARG  85  11.477  16.476 -10.914
  671    HD2  ARG  85           1HD      ARG  85  11.333  15.301  -8.763
  672    HD3  ARG  85           2HD      ARG  85  12.634  14.603  -9.730
  673    HE   ARG  85           HE       ARG  85  13.660  16.675  -8.068
  674   HH11  ARG  85          1HH2      ARG  85  12.401  13.436  -7.921
  675   HH12  ARG  85          2HH2      ARG  85  13.299  13.011  -6.503
  676   HH21  ARG  85          1HH1      ARG  85  14.831  16.107  -6.213
  677   HH22  ARG  85          2HH1      ARG  85  14.671  14.520  -5.538
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  -8.560 -24.849  -3.724
    2    H2   MET   1           2H       MET   1  -8.803 -25.113  -2.063
    3    H3   MET   1           3H       MET   1  -9.014 -23.560  -2.718
    4    HA   MET   1           HA       MET   1 -10.756 -24.833  -4.216
    5    HB2  MET   1           1HB      MET   1 -10.614 -26.361  -1.584
    6    HB3  MET   1           2HB      MET   1 -11.935 -26.503  -2.743
    7    HG2  MET   1           1HG      MET   1 -10.336 -27.297  -4.469
    8    HG3  MET   1           2HG      MET   1  -9.020 -27.175  -3.298
    9    HE1  MET   1           3HE      MET   1  -9.322 -30.975  -3.517
   10    HE2  MET   1           1HE      MET   1  -8.225 -29.602  -3.324
   11    HE3  MET   1           2HE      MET   1  -9.268 -29.707  -4.739
   12    H    ASN   2           H        ASN   2 -11.226 -22.585  -3.978
   13    HA   ASN   2           HA       ASN   2 -12.050 -21.368  -1.529
   14    HB2  ASN   2           1HB      ASN   2 -12.679 -20.593  -4.406
   15    HB3  ASN   2           2HB      ASN   2 -12.870 -19.551  -2.995
   16   HD21  ASN   2          2HD2      ASN   2 -10.410 -20.367  -1.644
   17   HD22  ASN   2          1HD2      ASN   2  -9.116 -19.763  -2.561
   18    H    TYR   3           H        TYR   3 -13.938 -21.587  -0.472
   19    HA   TYR   3           HA       TYR   3 -16.037 -23.312  -1.299
   20    HB2  TYR   3           1HB      TYR   3 -16.057 -21.118   0.814
   21    HB3  TYR   3           2HB      TYR   3 -17.249 -22.410   0.673
   22    HD1  TYR   3           HD1      TYR   3 -16.633 -24.780   1.177
   23    HD2  TYR   3           HD2      TYR   3 -13.765 -21.595   1.654
   24    HE1  TYR   3           HE1      TYR   3 -15.162 -26.287   2.490
   25    HE2  TYR   3           HE2      TYR   3 -12.309 -23.117   2.967
   26    HH   TYR   3           HH       TYR   3 -12.780 -26.477   3.076
   27    H    SER   4           H        SER   4 -15.722 -19.780  -1.345
   28    HA   SER   4           HA       SER   4 -17.580 -19.518  -3.562
   29    HB2  SER   4           1HB      SER   4 -18.355 -18.382  -0.849
   30    HB3  SER   4           2HB      SER   4 -19.204 -18.087  -2.366
   31    HG   SER   4           HG       SER   4 -19.343 -20.476  -2.457
   32    H    THR   5           H        THR   5 -17.881 -17.178  -4.123
   33    HA   THR   5           HA       THR   5 -15.371 -15.888  -4.373
   34    HB   THR   5           HB       THR   5 -16.662 -14.022  -5.357
   35    HG1  THR   5           HG1      THR   5 -19.082 -15.266  -5.006
   36   HG21  THR   5          3HG2      THR   5 -17.849 -15.294  -7.115
   37   HG22  THR   5          1HG2      THR   5 -17.806 -16.741  -6.109
   38   HG23  THR   5          2HG2      THR   5 -16.305 -16.060  -6.735
   39    H    GLY   6           H        GLY   6 -18.078 -15.383  -2.163
   40    HA2  GLY   6           1HA      GLY   6 -17.110 -12.982  -0.932
   41    HA3  GLY   6           2HA      GLY   6 -18.329 -14.069  -0.280
   42    H    THR   7           H        THR   7 -14.924 -13.334  -0.396
   43    HA   THR   7           HA       THR   7 -13.941 -15.511   1.153
   44    HB   THR   7           HB       THR   7 -12.374 -14.172  -0.126
   45    HG1  THR   7           HG1      THR   7 -11.296 -14.852   1.580
   46   HG21  THR   7          3HG2      THR   7 -13.230 -11.822   1.615
   47   HG22  THR   7          1HG2      THR   7 -13.595 -12.018  -0.099
   48   HG23  THR   7          2HG2      THR   7 -11.930 -11.800   0.429
   49    H    ASP   8           H        ASP   8 -13.554 -15.709   3.339
   50    HA   ASP   8           HA       ASP   8 -15.398 -14.525   5.137
   51    HB2  ASP   8           1HB      ASP   8 -14.370 -16.772   5.438
   52    HB3  ASP   8           2HB      ASP   8 -12.817 -16.010   5.763
   53    H    ALA   9           H        ALA   9 -12.488 -13.341   3.868
   54    HA   ALA   9           HA       ALA   9 -11.447 -11.856   6.049
   55    HB1  ALA   9           3HB      ALA   9 -11.281 -11.292   3.066
   56    HB2  ALA   9           1HB      ALA   9 -10.180 -12.321   3.978
   57    HB3  ALA   9           2HB      ALA   9 -10.240 -10.588   4.304
   58    H    ASN  10           H        ASN  10 -12.774 -10.504   7.167
   59    HA   ASN  10           HA       ASN  10 -14.964  -9.041   6.114
   60    HB2  ASN  10           1HB      ASN  10 -14.722  -9.588   8.519
   61    HB3  ASN  10           2HB      ASN  10 -13.333  -8.515   8.627
   62   HD21  ASN  10          2HD2      ASN  10 -16.853  -8.621   8.403
   63   HD22  ASN  10          1HD2      ASN  10 -17.100  -6.961   8.649
   64    H    THR  11           H        THR  11 -11.559  -8.225   6.595
   65    HA   THR  11           HA       THR  11 -11.739  -5.442   6.049
   66    HB   THR  11           HB       THR  11  -9.294  -5.601   5.648
   67    HG1  THR  11           HG1      THR  11  -9.156  -7.503   4.551
   68   HG21  THR  11          3HG2      THR  11  -8.671  -6.567   7.845
   69   HG22  THR  11          1HG2      THR  11 -10.257  -7.326   7.968
   70   HG23  THR  11          2HG2      THR  11 -10.114  -5.567   7.987
   71    H    LEU  12           H        LEU  12 -11.077  -4.327   4.133
   72    HA   LEU  12           HA       LEU  12 -12.124  -5.535   1.666
   73    HB2  LEU  12           1HB      LEU  12 -11.284  -2.739   2.501
   74    HB3  LEU  12           2HB      LEU  12 -11.547  -3.105   0.797
   75    HG   LEU  12           HG       LEU  12 -13.868  -3.822   1.295
   76   HD11  LEU  12          1HD1      LEU  12 -14.817  -3.290   3.605
   77   HD12  LEU  12          2HD1      LEU  12 -13.155  -3.115   4.168
   78   HD13  LEU  12          3HD1      LEU  12 -13.722  -4.662   3.539
   79   HD21  LEU  12          3HD2      LEU  12 -13.207  -1.070   2.418
   80   HD22  LEU  12          1HD2      LEU  12 -14.789  -1.584   1.829
   81   HD23  LEU  12          2HD2      LEU  12 -13.432  -1.455   0.710
   82    H    PHE  13           H        PHE  13  -9.203  -5.664   3.158
   83    HA   PHE  13           HA       PHE  13  -7.619  -5.740   0.611
   84    HB2  PHE  13           1HB      PHE  13  -6.773  -5.139   3.471
   85    HB3  PHE  13           2HB      PHE  13  -5.659  -5.294   2.112
   86    HD1  PHE  13           HD2      PHE  13  -5.647  -3.620   0.268
   87    HD2  PHE  13           HD1      PHE  13  -8.285  -3.159   3.649
   88    HE1  PHE  13           HE2      PHE  13  -6.094  -1.271  -0.392
   89    HE2  PHE  13           HE1      PHE  13  -8.731  -0.813   2.972
   90    HZ   PHE  13           HZ       PHE  13  -7.636   0.129   0.956
   91    H    VAL  14           H        VAL  14  -6.488  -7.525   0.153
   92    HA   VAL  14           HA       VAL  14  -6.364  -9.809   2.065
   93    HB   VAL  14           HB       VAL  14  -6.936 -11.338   0.181
   94   HG11  VAL  14          1HG1      VAL  14  -9.059  -9.215   0.742
   95   HG12  VAL  14          2HG1      VAL  14  -8.708 -10.606   1.769
   96   HG13  VAL  14          3HG1      VAL  14  -9.372 -10.849   0.155
   97   HG21  VAL  14          3HG2      VAL  14  -7.555  -8.750  -1.315
   98   HG22  VAL  14          1HG2      VAL  14  -8.004 -10.360  -1.873
   99   HG23  VAL  14          2HG2      VAL  14  -6.308  -9.923  -1.735
  100    H    ASP  15           H        ASP  15  -4.779 -11.399   1.502
  101    HA   ASP  15           HA       ASP  15  -2.244 -10.304   0.926
  102    HB2  ASP  15           1HB      ASP  15  -2.610 -12.271   2.375
  103    HB3  ASP  15           2HB      ASP  15  -3.151 -13.200   0.985
  104    H    GLY  16           H        GLY  16  -0.937 -10.441  -0.855
  105    HA2  GLY  16           1HA      GLY  16  -0.233 -11.021  -3.008
  106    HA3  GLY  16           2HA      GLY  16  -1.756 -11.833  -3.307
  107    H    GLU  17           H        GLU  17  -2.933  -9.183  -2.089
  108    HA   GLU  17           HA       GLU  17  -3.569  -7.958  -4.604
  109    HB2  GLU  17           1HB      GLU  17  -5.110  -8.000  -2.649
  110    HB3  GLU  17           2HB      GLU  17  -4.028  -6.927  -1.775
  111    HG2  GLU  17           1HG      GLU  17  -5.857  -5.607  -2.733
  112    HG3  GLU  17           2HG      GLU  17  -4.377  -5.186  -3.574
  113    H    ARG  18           H        ARG  18  -2.782  -6.147  -5.536
  114    HA   ARG  18           HA       ARG  18  -0.241  -5.018  -4.523
  115    HB2  ARG  18           1HB      ARG  18  -0.424  -5.777  -6.887
  116    HB3  ARG  18           2HB      ARG  18  -1.680  -4.572  -7.172
  117    HG2  ARG  18           1HG      ARG  18  -0.101  -2.741  -6.670
  118    HG3  ARG  18           2HG      ARG  18   1.153  -3.907  -6.240
  119    HD2  ARG  18           1HD      ARG  18  -0.113  -3.682  -9.000
  120    HD3  ARG  18           2HD      ARG  18   1.454  -3.005  -8.548
  121    HE   ARG  18           HE       ARG  18   1.505  -5.721  -7.866
  122   HH11  ARG  18          1HH2      ARG  18   1.245  -3.745 -10.720
  123   HH12  ARG  18          2HH2      ARG  18   2.018  -4.903 -11.747
  124   HH21  ARG  18          1HH1      ARG  18   2.516  -7.221  -9.217
  125   HH22  ARG  18          2HH1      ARG  18   2.737  -6.868 -10.896
  126    H    VAL  19           H        VAL  19  -0.199  -3.094  -3.506
  127    HA   VAL  19           HA       VAL  19  -2.378  -1.088  -3.899
  128    HB   VAL  19           HB       VAL  19  -2.466  -0.658  -1.487
  129   HG11  VAL  19          1HG1      VAL  19  -3.576  -2.752  -0.770
  130   HG12  VAL  19          2HG1      VAL  19  -2.844  -3.613  -2.116
  131   HG13  VAL  19          3HG1      VAL  19  -4.022  -2.339  -2.427
  132   HG21  VAL  19          3HG2      VAL  19  -1.298  -2.351   0.086
  133   HG22  VAL  19          1HG2      VAL  19  -0.223  -1.220  -0.730
  134   HG23  VAL  19          2HG2      VAL  19  -0.360  -2.874  -1.313
  135    H    LEU  20           H        LEU  20  -1.784   1.027  -3.005
  136    HA   LEU  20           HA       LEU  20   1.064   1.665  -3.601
  137    HB2  LEU  20           1HB      LEU  20  -1.375   3.475  -3.522
  138    HB3  LEU  20           2HB      LEU  20   0.233   3.897  -4.098
  139    HG   LEU  20           HG       LEU  20  -1.621   1.820  -5.351
  140   HD11  LEU  20          1HD1      LEU  20  -1.816   3.424  -7.210
  141   HD12  LEU  20          2HD1      LEU  20  -0.780   4.562  -6.349
  142   HD13  LEU  20          3HD1      LEU  20  -2.363   4.147  -5.699
  143   HD21  LEU  20          3HD2      LEU  20   1.217   2.683  -6.077
  144   HD22  LEU  20          1HD2      LEU  20   0.137   1.967  -7.277
  145   HD23  LEU  20          2HD2      LEU  20   0.587   1.049  -5.855
  146    H    CYS  21           H        CYS  21   2.277   2.859  -2.209
  147    HA   CYS  21           HA       CYS  21   1.191   3.417   0.529
  148    HB2  CYS  21           1HB      CYS  21   2.684   1.429   0.464
  149    HB3  CYS  21           2HB      CYS  21   3.981   2.434  -0.183
  150    HG   CYS  21           HG       CYS  21   4.180   3.635   2.055
  151    H    PHE  22           H        PHE  22   1.106   5.554   0.775
  152    HA   PHE  22           HA       PHE  22   3.084   7.337  -0.548
  153    HB2  PHE  22           1HB      PHE  22   1.517   9.138   0.050
  154    HB3  PHE  22           2HB      PHE  22   0.705   7.871  -0.864
  155    HD1  PHE  22           HD1      PHE  22   1.068   9.428   2.495
  156    HD2  PHE  22           HD2      PHE  22  -0.976   6.386   0.218
  157    HE1  PHE  22           HE1      PHE  22  -0.584   9.158   4.324
  158    HE2  PHE  22           HE2      PHE  22  -2.621   6.129   2.055
  159    HZ   PHE  22           HZ       PHE  22  -2.428   7.515   4.101
  160    H    HIS  23           H        HIS  23   4.108   9.002   0.687
  161    HA   HIS  23           HA       HIS  23   4.083   9.000   3.571
  162    HB2  HIS  23           1HB      HIS  23   5.397   6.911   3.071
  163    HB3  HIS  23           2HB      HIS  23   6.581   7.892   2.215
  164    HD1  HIS  23           HD1      HIS  23   5.047   7.545   5.685
  165    HD2  HIS  23           HD2      HIS  23   8.501   9.036   3.889
  166    HE1  HIS  23           HE1      HIS  23   6.590   8.240   7.568
  167    HE2  HIS  23           HE2      HIS  23   8.700   9.151   6.490
  168    H    GLY  24           H        GLY  24   4.149  10.638   0.954
  169    HA2  GLY  24           1HA      GLY  24   5.215  13.018   2.030
  170    HA3  GLY  24           2HA      GLY  24   6.419  12.318   0.946
  171    HA   PRO  25           HA       PRO  25   3.426  14.995  -1.503
  172    HB2  PRO  25           1HB      PRO  25   6.012  15.799  -2.854
  173    HB3  PRO  25           2HB      PRO  25   4.672  16.834  -2.309
  174    HG2  PRO  25           1HG      PRO  25   6.941  16.789  -0.913
  175    HG3  PRO  25           2HG      PRO  25   5.381  16.766  -0.055
  176    HD2  PRO  25           1HD      PRO  25   7.202  14.404  -0.663
  177    HD3  PRO  25           2HD      PRO  25   6.429  14.845   0.880
  178    H    LEU  26           H        LEU  26   4.918  12.191  -1.954
  179    HA   LEU  26           HA       LEU  26   3.923  11.871  -4.715
  180    HB2  LEU  26           1HB      LEU  26   6.352  12.513  -4.878
  181    HB3  LEU  26           2HB      LEU  26   6.732  11.081  -3.942
  182    HG   LEU  26           HG       LEU  26   5.744   9.647  -5.735
  183   HD11  LEU  26          1HD1      LEU  26   5.436  10.860  -8.050
  184   HD12  LEU  26          2HD1      LEU  26   5.212  12.318  -7.085
  185   HD13  LEU  26          3HD1      LEU  26   4.129  10.942  -6.881
  186   HD21  LEU  26          3HD2      LEU  26   7.896  11.579  -6.696
  187   HD22  LEU  26          1HD2      LEU  26   7.580   9.980  -7.376
  188   HD23  LEU  26          2HD2      LEU  26   8.169  10.131  -5.724
  189    H    ILE  27           H        ILE  27   3.179   9.898  -5.171
  190    HA   ILE  27           HA       ILE  27   2.853   7.974  -2.979
  191    HB   ILE  27           HB       ILE  27   1.746   8.027  -5.814
  192   HG12  ILE  27          1HG1      ILE  27   0.319   8.764  -3.199
  193   HG13  ILE  27          2HG1      ILE  27   1.053   9.968  -4.246
  194   HG21  ILE  27          1HG2      ILE  27   0.072   6.380  -4.888
  195   HG22  ILE  27          2HG2      ILE  27   0.991   6.328  -3.390
  196   HG23  ILE  27          3HG2      ILE  27   1.707   5.734  -4.886
  197   HD11  ILE  27          3HD1      ILE  27  -1.143   8.061  -5.059
  198   HD12  ILE  27          1HD1      ILE  27  -0.374   9.252  -6.107
  199   HD13  ILE  27          2HD1      ILE  27  -1.324   9.783  -4.721
  200    H    TYR  28           H        TYR  28   3.467   5.808  -3.117
  201    HA   TYR  28           HA       TYR  28   5.452   5.032  -5.222
  202    HB2  TYR  28           1HB      TYR  28   5.708   4.572  -2.225
  203    HB3  TYR  28           2HB      TYR  28   6.820   3.974  -3.454
  204    HD1  TYR  28           HD2      TYR  28   8.235   5.568  -4.785
  205    HD2  TYR  28           HD1      TYR  28   5.716   6.969  -1.575
  206    HE1  TYR  28           HE2      TYR  28   9.440   7.736  -4.768
  207    HE2  TYR  28           HE1      TYR  28   6.936   9.132  -1.575
  208    HH   TYR  28           HH       TYR  28   8.473  10.369  -2.580
  209    H    GLU  29           H        GLU  29   5.743   2.766  -5.463
  210    HA   GLU  29           HA       GLU  29   3.207   1.320  -5.307
  211    HB2  GLU  29           1HB      GLU  29   4.623   1.351  -7.364
  212    HB3  GLU  29           2HB      GLU  29   5.873   0.463  -6.500
  213    HG2  GLU  29           1HG      GLU  29   4.299  -1.423  -6.143
  214    HG3  GLU  29           2HG      GLU  29   3.025  -0.521  -6.955
  215    H    ALA  30           H        ALA  30   2.790  -0.454  -4.111
  216    HA   ALA  30           HA       ALA  30   4.872  -1.782  -2.497
  217    HB1  ALA  30           3HB      ALA  30   3.545  -1.494  -0.427
  218    HB2  ALA  30           1HB      ALA  30   2.387  -0.490  -1.309
  219    HB3  ALA  30           2HB      ALA  30   4.044   0.067  -1.082
  220    H    LYS  31           H        LYS  31   3.805  -3.661  -1.282
  221    HA   LYS  31           HA       LYS  31   1.464  -4.809  -2.711
  222    HB2  LYS  31           1HB      LYS  31   3.605  -5.557  -3.846
  223    HB3  LYS  31           2HB      LYS  31   4.072  -6.339  -2.344
  224    HG2  LYS  31           1HG      LYS  31   2.020  -7.761  -2.444
  225    HG3  LYS  31           2HG      LYS  31   1.528  -6.941  -3.919
  226    HD2  LYS  31           1HD      LYS  31   2.536  -8.932  -4.756
  227    HD3  LYS  31           2HD      LYS  31   3.830  -7.758  -4.916
  228    HE2  LYS  31           1HE      LYS  31   4.823  -8.570  -2.785
  229    HE3  LYS  31           2HE      LYS  31   3.498  -9.720  -2.612
  230    HZ1  LYS  31           3HZ      LYS  31   5.839  -9.859  -4.255
  231    HZ2  LYS  31           1HZ      LYS  31   4.416 -10.170  -5.121
  232    HZ3  LYS  31           2HZ      LYS  31   4.792 -11.097  -3.746
  233    H    VAL  32           H        VAL  32   0.311  -6.305  -1.557
  234    HA   VAL  32           HA       VAL  32   0.704  -6.306   1.362
  235    HB   VAL  32           HB       VAL  32  -1.607  -7.444  -0.289
  236   HG11  VAL  32          1HG1      VAL  32  -1.470  -8.267   2.057
  237   HG12  VAL  32          2HG1      VAL  32  -2.866  -7.220   1.825
  238   HG13  VAL  32          3HG1      VAL  32  -1.424  -6.605   2.638
  239   HG21  VAL  32          3HG2      VAL  32  -2.777  -5.311   0.205
  240   HG22  VAL  32          1HG2      VAL  32  -1.326  -5.021  -0.744
  241   HG23  VAL  32          2HG2      VAL  32  -1.323  -4.686   0.987
  242    H    LEU  33           H        LEU  33   2.064  -7.864   2.069
  243    HA   LEU  33           HA       LEU  33   2.341 -10.434   0.699
  244    HB2  LEU  33           1HB      LEU  33   4.348  -9.378   1.606
  245    HB3  LEU  33           2HB      LEU  33   3.648  -9.341   3.218
  246    HG   LEU  33           HG       LEU  33   3.704 -11.823   3.313
  247   HD11  LEU  33          1HD1      LEU  33   4.736 -11.594   0.470
  248   HD12  LEU  33          2HD1      LEU  33   3.376 -12.541   1.074
  249   HD13  LEU  33          3HD1      LEU  33   5.012 -13.038   1.449
  250   HD21  LEU  33          3HD2      LEU  33   6.384 -10.696   2.426
  251   HD22  LEU  33          1HD2      LEU  33   6.133 -12.129   3.420
  252   HD23  LEU  33          2HD2      LEU  33   5.708 -10.542   4.050
  253    H    LYS  34           H        LYS  34   0.887  -9.159   3.630
  254    HA   LYS  34           HA       LYS  34  -0.769 -11.522   3.931
  255    HB2  LYS  34           1HB      LYS  34   1.341 -12.281   4.995
  256    HB3  LYS  34           2HB      LYS  34   1.292 -10.897   6.074
  257    HG2  LYS  34           1HG      LYS  34  -0.780 -11.706   7.120
  258    HG3  LYS  34           2HG      LYS  34  -0.927 -12.986   5.927
  259    HD2  LYS  34           1HD      LYS  34  -0.061 -13.905   8.031
  260    HD3  LYS  34           2HD      LYS  34   1.160 -14.025   6.770
  261    HE2  LYS  34           1HE      LYS  34   1.948 -13.187   9.102
  262    HE3  LYS  34           2HE      LYS  34   2.468 -12.254   7.707
  263    HZ1  LYS  34           3HZ      LYS  34   1.565 -10.917   9.578
  264    HZ2  LYS  34           1HZ      LYS  34   0.047 -11.625   9.306
  265    HZ3  LYS  34           2HZ      LYS  34   0.762 -10.661   8.104
  266    H    THR  35           H        THR  35  -2.425 -11.247   5.442
  267    HA   THR  35           HA       THR  35  -2.813  -8.502   6.569
  268    HB   THR  35           HB       THR  35  -5.113  -8.462   5.741
  269    HG1  THR  35           HG1      THR  35  -5.754 -10.168   4.313
  270   HG21  THR  35          3HG2      THR  35  -3.248  -9.261   3.489
  271   HG22  THR  35          1HG2      THR  35  -3.284  -7.658   4.222
  272   HG23  THR  35          2HG2      THR  35  -4.692  -8.264   3.348
  273    H    LYS  36           H        LYS  36  -3.925  -8.399   8.448
  274    HA   LYS  36           HA       LYS  36  -4.725 -11.007   9.716
  275    HB2  LYS  36           1HB      LYS  36  -2.791  -9.900  10.773
  276    HB3  LYS  36           2HB      LYS  36  -3.778  -8.490  11.080
  277    HG2  LYS  36           1HG      LYS  36  -5.313  -9.828  12.499
  278    HG3  LYS  36           2HG      LYS  36  -4.386 -11.283  12.139
  279    HD2  LYS  36           1HD      LYS  36  -2.410 -10.335  13.251
  280    HD3  LYS  36           2HD      LYS  36  -3.274  -8.826  13.553
  281    HE2  LYS  36           1HE      LYS  36  -4.098 -11.543  14.647
  282    HE3  LYS  36           2HE      LYS  36  -3.267 -10.287  15.567
  283    HZ1  LYS  36           3HZ      LYS  36  -5.603 -10.146  15.978
  284    HZ2  LYS  36           1HZ      LYS  36  -5.952 -10.094  14.319
  285    HZ3  LYS  36           2HZ      LYS  36  -5.141  -8.795  15.058
  286    HA   PRO  37           HA       PRO  37  -8.595  -8.407   9.505
  287    HB2  PRO  37           1HB      PRO  37 -10.283 -10.093   8.274
  288    HB3  PRO  37           2HB      PRO  37  -8.964  -9.343   7.341
  289    HG2  PRO  37           1HG      PRO  37  -8.999 -12.079   8.637
  290    HG3  PRO  37           2HG      PRO  37  -8.631 -11.669   6.942
  291    HD2  PRO  37           1HD      PRO  37  -6.638 -11.985   8.802
  292    HD3  PRO  37           2HD      PRO  37  -6.484 -10.809   7.480
  293    H    ASP  38           H        ASP  38  -7.499 -10.815  11.385
  294    HA   ASP  38           HA       ASP  38  -9.844 -11.952  12.547
  295    HB2  ASP  38           1HB      ASP  38  -7.577 -12.956  12.726
  296    HB3  ASP  38           2HB      ASP  38  -7.067 -11.618  13.750
  297    H    ALA  39           H        ALA  39  -8.782  -8.803  12.597
  298    HA   ALA  39           HA       ALA  39 -10.523  -8.124  14.879
  299    HB1  ALA  39           3HB      ALA  39  -8.301  -8.456  15.906
  300    HB2  ALA  39           1HB      ALA  39  -8.780  -6.758  15.975
  301    HB3  ALA  39           2HB      ALA  39  -7.598  -7.304  14.781
  302    H    THR  40           H        THR  40 -11.007  -5.875  15.017
  303    HA   THR  40           HA       THR  40 -10.421  -4.193  12.650
  304    HB   THR  40           HB       THR  40 -12.801  -3.677  12.326
  305    HG1  THR  40           HG1      THR  40 -14.273  -5.114  13.469
  306   HG21  THR  40          3HG2      THR  40 -11.710  -5.647  11.105
  307   HG22  THR  40          1HG2      THR  40 -13.461  -5.777  11.281
  308   HG23  THR  40          2HG2      THR  40 -12.403  -6.696  12.342
  309    HA   PRO  41           HA       PRO  41  -9.602  -2.083  12.364
  310    HB2  PRO  41           1HB      PRO  41  -7.753  -0.594  14.220
  311    HB3  PRO  41           2HB      PRO  41  -8.535  -0.019  12.730
  312    HG2  PRO  41           1HG      PRO  41  -9.398   0.869  15.088
  313    HG3  PRO  41           2HG      PRO  41 -10.581   0.412  13.834
  314    HD2  PRO  41           1HD      PRO  41  -9.612  -1.294  16.163
  315    HD3  PRO  41           2HD      PRO  41 -11.295  -0.888  15.715
  316    H    VAL  42           H        VAL  42  -7.106  -2.314  12.001
  317    HA   VAL  42           HA       VAL  42  -5.602  -3.941  13.823
  318    HB   VAL  42           HB       VAL  42  -7.294  -5.605  13.026
  319   HG11  VAL  42          1HG1      VAL  42  -7.531  -4.552  10.701
  320   HG12  VAL  42          2HG1      VAL  42  -7.447  -6.306  10.713
  321   HG13  VAL  42          3HG1      VAL  42  -6.025  -5.362  10.269
  322   HG21  VAL  42          3HG2      VAL  42  -4.785  -6.195  13.613
  323   HG22  VAL  42          1HG2      VAL  42  -4.613  -6.444  11.880
  324   HG23  VAL  42          2HG2      VAL  42  -5.754  -7.407  12.803
  325    H    GLU  43           H        GLU  43  -3.657  -4.970  12.576
  326    HA   GLU  43           HA       GLU  43  -2.487  -2.885  10.851
  327    HB2  GLU  43           1HB      GLU  43  -0.397  -4.609  11.502
  328    HB3  GLU  43           2HB      GLU  43  -0.791  -3.164  12.422
  329    HG2  GLU  43           1HG      GLU  43  -2.205  -4.502  13.945
  330    HG3  GLU  43           2HG      GLU  43  -1.862  -5.954  13.011
  331    H    TYR  44           H        TYR  44  -1.099  -3.611   9.110
  332    HA   TYR  44           HA       TYR  44  -1.859  -6.173   7.813
  333    HB2  TYR  44           1HB      TYR  44  -1.844  -3.434   6.474
  334    HB3  TYR  44           2HB      TYR  44  -2.120  -4.970   5.667
  335    HD1  TYR  44           HD2      TYR  44  -3.491  -2.652   8.283
  336    HD2  TYR  44           HD1      TYR  44  -4.309  -6.078   5.793
  337    HE1  TYR  44           HE2      TYR  44  -5.883  -2.587   8.940
  338    HE2  TYR  44           HE1      TYR  44  -6.689  -5.992   6.467
  339    HH   TYR  44           HH       TYR  44  -8.195  -3.557   7.610
  340    H    TYR  45           H        TYR  45  -0.410  -6.915   6.283
  341    HA   TYR  45           HA       TYR  45   2.400  -6.130   6.828
  342    HB2  TYR  45           1HB      TYR  45   1.274  -8.585   6.847
  343    HB3  TYR  45           2HB      TYR  45   1.761  -8.557   5.175
  344    HD1  TYR  45           HD1      TYR  45   4.326  -7.135   5.115
  345    HD2  TYR  45           HD2      TYR  45   2.880  -9.908   8.060
  346    HE1  TYR  45           HE1      TYR  45   6.642  -7.695   5.757
  347    HE2  TYR  45           HE2      TYR  45   5.210 -10.454   8.687
  348    HH   TYR  45           HH       TYR  45   7.953  -8.840   7.075
  349    H    ILE  46           H        ILE  46   2.851  -4.426   5.608
  350    HA   ILE  46           HA       ILE  46   2.458  -4.529   2.652
  351    HB   ILE  46           HB       ILE  46   3.008  -2.096   4.403
  352   HG12  ILE  46          1HG1      ILE  46   0.833  -3.030   5.055
  353   HG13  ILE  46          2HG1      ILE  46   0.592  -1.554   4.137
  354   HG21  ILE  46          1HG2      ILE  46   3.662  -1.800   2.045
  355   HG22  ILE  46          2HG2      ILE  46   2.240  -0.828   2.408
  356   HG23  ILE  46          3HG2      ILE  46   2.069  -2.342   1.526
  357   HD11  ILE  46          3HD1      ILE  46  -1.015  -3.044   3.272
  358   HD12  ILE  46          1HD1      ILE  46   0.092  -4.408   3.283
  359   HD13  ILE  46          2HD1      ILE  46   0.268  -3.135   2.076
  360    H    HIS  47           H        HIS  47   4.165  -4.110   1.319
  361    HA   HIS  47           HA       HIS  47   6.929  -4.018   2.477
  362    HB2  HIS  47           1HB      HIS  47   5.910  -5.555   0.049
  363    HB3  HIS  47           2HB      HIS  47   7.614  -5.378   0.480
  364    HD1  HIS  47           HD1      HIS  47   8.518  -7.142   1.958
  365    HD2  HIS  47           HD2      HIS  47   4.389  -6.765   2.367
  366    HE1  HIS  47           HE1      HIS  47   7.804  -8.874   3.661
  367    HE2  HIS  47           HE2      HIS  47   5.300  -8.651   3.928
  368    H    TYR  48           H        TYR  48   8.120  -2.405   1.805
  369    HA   TYR  48           HA       TYR  48   7.060  -0.497  -0.138
  370    HB2  TYR  48           1HB      TYR  48   8.496  -0.166   2.197
  371    HB3  TYR  48           2HB      TYR  48   9.807  -0.067   1.041
  372    HD1  TYR  48           HD1      TYR  48   9.705   1.663  -0.841
  373    HD2  TYR  48           HD2      TYR  48   6.843   1.650   2.385
  374    HE1  TYR  48           HE1      TYR  48   9.006   3.969  -1.435
  375    HE2  TYR  48           HE2      TYR  48   6.163   3.957   1.779
  376    HH   TYR  48           HH       TYR  48   6.215   5.360  -0.428
  377    H    ALA  49           H        ALA  49   7.522  -0.550  -2.221
  378    HA   ALA  49           HA       ALA  49   9.243  -2.463  -3.427
  379    HB1  ALA  49           3HB      ALA  49   8.057   0.081  -4.597
  380    HB2  ALA  49           1HB      ALA  49   7.264  -1.494  -4.552
  381    HB3  ALA  49           2HB      ALA  49   8.721  -1.269  -5.521
  382    H    GLY  50           H        GLY  50  11.236  -2.210  -4.449
  383    HA2  GLY  50           1HA      GLY  50  13.225  -1.181  -5.105
  384    HA3  GLY  50           2HA      GLY  50  12.736   0.315  -4.320
  385    H    TRP  51           H        TRP  51  12.219  -2.270  -2.242
  386    HA   TRP  51           HA       TRP  51  14.954  -2.283  -1.071
  387    HB2  TRP  51           1HB      TRP  51  12.433  -1.511   0.461
  388    HB3  TRP  51           2HB      TRP  51  14.034  -1.749   1.170
  389    HD1  TRP  51           HD1      TRP  51  12.006   0.751  -0.854
  390    HE1  TRP  51           HE1      TRP  51  13.374   2.921  -1.126
  391    HE3  TRP  51           HE3      TRP  51  16.513  -0.799   0.991
  392    HZ2  TRP  51           HZ2      TRP  51  16.020   3.875  -0.631
  393    HZ3  TRP  51           HZ3      TRP  51  18.442   0.761   1.077
  394    HH2  TRP  51           HH2      TRP  51  18.201   3.096   0.268
  395    H    SER  52           H        SER  52  15.219  -3.894   0.582
  396    HA   SER  52           HA       SER  52  14.198  -6.435  -0.190
  397    HB2  SER  52           1HB      SER  52  15.662  -5.601   2.336
  398    HB3  SER  52           2HB      SER  52  15.419  -7.264   1.805
  399    HG   SER  52           HG       SER  52  16.424  -6.377  -0.247
  400    H    LYS  53           H        LYS  53  13.150  -7.941   1.378
  401    HA   LYS  53           HA       LYS  53  10.663  -6.781   2.390
  402    HB2  LYS  53           1HB      LYS  53  11.681  -9.648   2.265
  403    HB3  LYS  53           2HB      LYS  53  10.063  -9.183   2.783
  404    HG2  LYS  53           1HG      LYS  53   9.656  -8.122   0.566
  405    HG3  LYS  53           2HG      LYS  53  11.267  -8.623   0.042
  406    HD2  LYS  53           1HD      LYS  53  10.629 -11.006   0.370
  407    HD3  LYS  53           2HD      LYS  53   9.022 -10.502   0.893
  408    HE2  LYS  53           1HE      LYS  53   8.630  -9.450  -1.324
  409    HE3  LYS  53           2HE      LYS  53  10.235  -9.970  -1.848
  410    HZ1  LYS  53           3HZ      LYS  53   7.936 -11.400  -2.085
  411    HZ2  LYS  53           1HZ      LYS  53   8.683 -12.102  -0.734
  412    HZ3  LYS  53           2HZ      LYS  53   9.513 -12.023  -2.215
  413    H    ASN  54           H        ASN  54  13.721  -7.397   3.718
  414    HA   ASN  54           HA       ASN  54  13.027  -8.273   6.343
  415    HB2  ASN  54           1HB      ASN  54  15.449  -6.672   5.431
  416    HB3  ASN  54           2HB      ASN  54  15.311  -7.575   6.940
  417   HD21  ASN  54          2HD2      ASN  54  16.873  -7.875   4.135
  418   HD22  ASN  54          1HD2      ASN  54  16.749  -9.545   3.864
  419    H    TRP  55           H        TRP  55  12.671  -5.270   4.755
  420    HA   TRP  55           HA       TRP  55  12.868  -3.474   6.978
  421    HB2  TRP  55           1HB      TRP  55  11.433  -3.292   4.295
  422    HB3  TRP  55           2HB      TRP  55  11.499  -1.951   5.438
  423    HD1  TRP  55           HD1      TRP  55  14.068  -4.355   3.784
  424    HE1  TRP  55           HE1      TRP  55  16.154  -2.982   3.161
  425    HE3  TRP  55           HE3      TRP  55  12.657   0.239   5.523
  426    HZ2  TRP  55           HZ2      TRP  55  17.103  -0.296   3.364
  427    HZ3  TRP  55           HZ3      TRP  55  14.172   2.188   5.294
  428    HH2  TRP  55           HH2      TRP  55  16.392   1.927   4.216
  429    H    ASP  56           H        ASP  56  10.321  -5.482   5.676
  430    HA   ASP  56           HA       ASP  56   8.116  -5.804   6.251
  431    HB2  ASP  56           1HB      ASP  56   7.860  -6.548   8.589
  432    HB3  ASP  56           2HB      ASP  56   9.351  -7.169   7.878
  433    H    GLU  57           H        GLU  57   7.466  -3.620   5.535
  434    HA   GLU  57           HA       GLU  57   7.080  -1.552   7.524
  435    HB2  GLU  57           1HB      GLU  57   7.538  -1.107   5.100
  436    HB3  GLU  57           2HB      GLU  57   5.961  -1.769   4.705
  437    HG2  GLU  57           1HG      GLU  57   5.784   0.666   4.779
  438    HG3  GLU  57           2HG      GLU  57   4.901   0.011   6.148
  439    H    TRP  58           H        TRP  58   5.781  -2.439   9.123
  440    HA   TRP  58           HA       TRP  58   3.103  -3.514   8.494
  441    HB2  TRP  58           1HB      TRP  58   4.864  -3.326  10.964
  442    HB3  TRP  58           2HB      TRP  58   3.129  -3.494  11.203
  443    HD1  TRP  58           HD1      TRP  58   5.684  -5.250   8.848
  444    HE1  TRP  58           HE1      TRP  58   5.270  -7.794   8.993
  445    HE3  TRP  58           HE3      TRP  58   1.843  -5.336  12.208
  446    HZ2  TRP  58           HZ2      TRP  58   3.532  -9.633  10.362
  447    HZ3  TRP  58           HZ3      TRP  58   0.820  -7.482  12.902
  448    HH2  TRP  58           HH2      TRP  58   1.659  -9.624  11.988
  449    H    VAL  59           H        VAL  59   1.437  -2.120   8.242
  450    HA   VAL  59           HA       VAL  59   1.233   0.278   9.976
  451    HB   VAL  59           HB       VAL  59   0.677   1.674   7.860
  452   HG11  VAL  59          1HG1      VAL  59   3.020   2.215   7.374
  453   HG12  VAL  59          2HG1      VAL  59   3.550   0.724   8.135
  454   HG13  VAL  59          3HG1      VAL  59   2.798   1.986   9.109
  455   HG21  VAL  59          3HG2      VAL  59   1.601   0.884   5.725
  456   HG22  VAL  59          1HG2      VAL  59   0.412  -0.274   6.327
  457   HG23  VAL  59          2HG2      VAL  59   2.136  -0.613   6.482
  458    HA   PRO  60           HA       PRO  60  -3.108  -0.740   9.897
  459    HB2  PRO  60           1HB      PRO  60  -4.313   1.630  10.531
  460    HB3  PRO  60           2HB      PRO  60  -3.278   0.785  11.706
  461    HG2  PRO  60           1HG      PRO  60  -2.501   3.001   9.796
  462    HG3  PRO  60           2HG      PRO  60  -2.273   2.944  11.564
  463    HD2  PRO  60           1HD      PRO  60  -0.239   2.251   9.953
  464    HD3  PRO  60           2HD      PRO  60  -0.553   1.286  11.406
  465    H    GLU  61           H        GLU  61  -5.136  -0.335   8.776
  466    HA   GLU  61           HA       GLU  61  -4.945  -0.170   6.017
  467    HB2  GLU  61           1HB      GLU  61  -6.876  -1.107   7.282
  468    HB3  GLU  61           2HB      GLU  61  -7.389   0.522   7.695
  469    HG2  GLU  61           1HG      GLU  61  -7.710   1.035   5.285
  470    HG3  GLU  61           2HG      GLU  61  -7.137  -0.575   4.862
  471    H    ASN  62           H        ASN  62  -5.124   2.414   8.310
  472    HA   ASN  62           HA       ASN  62  -6.142   4.509   6.740
  473    HB2  ASN  62           1HB      ASN  62  -4.024   4.712   8.909
  474    HB3  ASN  62           2HB      ASN  62  -5.043   6.025   8.325
  475   HD21  ASN  62          2HD2      ASN  62  -4.848   4.533  11.053
  476   HD22  ASN  62          1HD2      ASN  62  -6.464   4.139  11.394
  477    H    ARG  63           H        ARG  63  -2.798   3.291   6.967
  478    HA   ARG  63           HA       ARG  63  -1.799   5.334   5.110
  479    HB2  ARG  63           1HB      ARG  63  -0.531   4.202   7.153
  480    HB3  ARG  63           2HB      ARG  63  -0.205   2.917   6.010
  481    HG2  ARG  63           1HG      ARG  63   1.706   4.254   5.623
  482    HG3  ARG  63           2HG      ARG  63   0.628   4.964   4.432
  483    HD2  ARG  63           1HD      ARG  63   1.705   6.749   5.702
  484    HD3  ARG  63           2HD      ARG  63  -0.005   6.711   6.138
  485    HE   ARG  63           HE       ARG  63   1.550   5.059   7.887
  486   HH11  ARG  63          1HH2      ARG  63   0.715   8.375   7.224
  487   HH12  ARG  63          2HH2      ARG  63   1.050   8.909   8.836
  488   HH21  ARG  63          1HH1      ARG  63   1.980   5.777   9.980
  489   HH22  ARG  63          2HH1      ARG  63   1.765   7.446  10.389
  490    H    VAL  64           H        VAL  64  -3.504   2.501   4.712
  491    HA   VAL  64           HA       VAL  64  -2.092   1.609   2.258
  492    HB   VAL  64           HB       VAL  64  -4.521   0.394   3.644
  493   HG11  VAL  64          1HG1      VAL  64  -2.639  -0.705   1.507
  494   HG12  VAL  64          2HG1      VAL  64  -4.321  -0.251   1.248
  495   HG13  VAL  64          3HG1      VAL  64  -3.931  -1.616   2.285
  496   HG21  VAL  64          3HG2      VAL  64  -2.515   0.357   5.110
  497   HG22  VAL  64          1HG2      VAL  64  -1.567  -0.355   3.806
  498   HG23  VAL  64          2HG2      VAL  64  -2.890  -1.262   4.539
  499    H    LEU  65           H        LEU  65  -2.739   2.253   0.314
  500    HA   LEU  65           HA       LEU  65  -5.435   3.491  -0.037
  501    HB2  LEU  65           1HB      LEU  65  -3.527   5.036  -0.376
  502    HB3  LEU  65           2HB      LEU  65  -2.896   3.979  -1.627
  503    HG   LEU  65           HG       LEU  65  -4.958   4.365  -2.991
  504   HD11  LEU  65          1HD1      LEU  65  -5.813   6.065  -0.621
  505   HD12  LEU  65          2HD1      LEU  65  -6.734   4.841  -1.495
  506   HD13  LEU  65          3HD1      LEU  65  -6.437   6.396  -2.241
  507   HD21  LEU  65          3HD2      LEU  65  -2.975   5.819  -3.303
  508   HD22  LEU  65          1HD2      LEU  65  -3.601   6.932  -2.084
  509   HD23  LEU  65          2HD2      LEU  65  -4.464   6.710  -3.606
  510    H    LYS  66           H        LYS  66  -6.791   2.623  -1.469
  511    HA   LYS  66           HA       LYS  66  -6.315   0.054  -2.596
  512    HB2  LYS  66           1HB      LYS  66  -8.529   0.452  -3.736
  513    HB3  LYS  66           2HB      LYS  66  -8.573   0.711  -1.998
  514    HG2  LYS  66           1HG      LYS  66  -8.413   3.138  -2.291
  515    HG3  LYS  66           2HG      LYS  66  -8.243   2.967  -4.033
  516    HD2  LYS  66           1HD      LYS  66 -10.716   1.807  -2.657
  517    HD3  LYS  66           2HD      LYS  66 -10.646   3.533  -2.993
  518    HE2  LYS  66           1HE      LYS  66 -10.309   1.364  -5.103
  519    HE3  LYS  66           2HE      LYS  66 -11.780   2.287  -4.824
  520    HZ1  LYS  66           3HZ      LYS  66 -10.662   3.387  -6.536
  521    HZ2  LYS  66           1HZ      LYS  66  -9.157   3.280  -5.760
  522    HZ3  LYS  66           2HZ      LYS  66 -10.355   4.319  -5.150
  523    H    TYR  67           H        TYR  67  -5.930  -0.581  -4.705
  524    HA   TYR  67           HA       TYR  67  -4.533   1.359  -6.400
  525    HB2  TYR  67           1HB      TYR  67  -3.664  -0.960  -6.024
  526    HB3  TYR  67           2HB      TYR  67  -5.071  -1.614  -6.848
  527    HD1  TYR  67           HD1      TYR  67  -5.365  -1.291  -9.319
  528    HD2  TYR  67           HD2      TYR  67  -1.895   0.263  -7.283
  529    HE1  TYR  67           HE1      TYR  67  -4.244  -0.902 -11.502
  530    HE2  TYR  67           HE2      TYR  67  -0.788   0.640  -9.472
  531    HH   TYR  67           HH       TYR  67  -1.285  -0.653 -12.038
  532    H    ASN  68           H        ASN  68  -5.576   2.518  -7.878
  533    HA   ASN  68           HA       ASN  68  -7.673   1.348  -9.553
  534    HB2  ASN  68           1HB      ASN  68  -8.870   2.187  -7.504
  535    HB3  ASN  68           2HB      ASN  68  -8.276   3.806  -7.855
  536   HD21  ASN  68          2HD2      ASN  68 -10.928   1.802  -8.334
  537   HD22  ASN  68          1HD2      ASN  68 -11.592   2.563  -9.697
  538    H    ASP  69           H        ASP  69  -8.067   2.516 -11.434
  539    HA   ASP  69           HA       ASP  69  -5.923   3.757 -12.656
  540    HB2  ASP  69           1HB      ASP  69  -8.852   4.264 -13.279
  541    HB3  ASP  69           2HB      ASP  69  -7.495   4.479 -14.389
  542    H    ASP  70           H        ASP  70  -8.395   5.263 -10.637
  543    HA   ASP  70           HA       ASP  70  -7.732   7.983 -11.323
  544    HB2  ASP  70           1HB      ASP  70  -9.120   8.576  -9.356
  545    HB3  ASP  70           2HB      ASP  70  -9.944   7.423 -10.403
  546    H    ASN  71           H        ASN  71  -6.785   5.773  -8.694
  547    HA   ASN  71           HA       ASN  71  -5.205   7.677  -7.254
  548    HB2  ASN  71           1HB      ASN  71  -5.023   4.638  -7.343
  549    HB3  ASN  71           2HB      ASN  71  -4.198   5.672  -6.178
  550   HD21  ASN  71          2HD2      ASN  71  -6.742   3.674  -6.203
  551   HD22  ASN  71          1HD2      ASN  71  -7.811   4.506  -5.181
  552    H    VAL  72           H        VAL  72  -4.566   5.440  -9.900
  553    HA   VAL  72           HA       VAL  72  -1.719   5.841 -10.029
  554    HB   VAL  72           HB       VAL  72  -3.704   4.963 -12.179
  555   HG11  VAL  72          1HG1      VAL  72  -1.650   5.792 -13.276
  556   HG12  VAL  72          2HG1      VAL  72  -1.668   4.038 -13.354
  557   HG13  VAL  72          3HG1      VAL  72  -0.652   4.852 -12.164
  558   HG21  VAL  72          3HG2      VAL  72  -1.808   3.348 -10.419
  559   HG22  VAL  72          1HG2      VAL  72  -2.886   2.683 -11.646
  560   HG23  VAL  72          2HG2      VAL  72  -3.551   3.442 -10.203
  561    H    LYS  73           H        LYS  73  -4.498   7.287 -11.698
  562    HA   LYS  73           HA       LYS  73  -3.193   9.094 -13.371
  563    HB2  LYS  73           1HB      LYS  73  -5.633   8.597 -13.394
  564    HB3  LYS  73           2HB      LYS  73  -5.823   9.509 -11.905
  565    HG2  LYS  73           1HG      LYS  73  -5.025  11.569 -13.048
  566    HG3  LYS  73           2HG      LYS  73  -4.822  10.648 -14.540
  567    HD2  LYS  73           1HD      LYS  73  -7.262  10.125 -14.538
  568    HD3  LYS  73           2HD      LYS  73  -7.453  11.064 -13.056
  569    HE2  LYS  73           1HE      LYS  73  -6.504  12.151 -15.737
  570    HE3  LYS  73           2HE      LYS  73  -8.094  12.416 -15.018
  571    HZ1  LYS  73           3HZ      LYS  73  -6.723  14.292 -14.558
  572    HZ2  LYS  73           1HZ      LYS  73  -5.477  13.319 -13.942
  573    HZ3  LYS  73           2HZ      LYS  73  -6.950  13.447 -13.101
  574    H    ARG  74           H        ARG  74  -4.063   9.423  -9.946
  575    HA   ARG  74           HA       ARG  74  -3.217  12.138  -9.621
  576    HB2  ARG  74           1HB      ARG  74  -3.573   9.853  -7.642
  577    HB3  ARG  74           2HB      ARG  74  -3.111  11.479  -7.132
  578    HG2  ARG  74           1HG      ARG  74  -5.178  12.407  -8.105
  579    HG3  ARG  74           2HG      ARG  74  -5.643  10.818  -8.696
  580    HD2  ARG  74           1HD      ARG  74  -6.844  11.310  -6.606
  581    HD3  ARG  74           2HD      ARG  74  -5.716   9.980  -6.350
  582    HE   ARG  74           HE       ARG  74  -4.550  11.317  -4.860
  583   HH11  ARG  74          1HH2      ARG  74  -6.574  13.322  -6.864
  584   HH12  ARG  74          2HH2      ARG  74  -6.186  14.782  -6.020
  585   HH21  ARG  74          1HH1      ARG  74  -4.062  13.232  -3.758
  586   HH22  ARG  74          2HH1      ARG  74  -4.763  14.730  -4.263
  587    H    ARG  75           H        ARG  75  -1.542   9.033  -9.429
  588    HA   ARG  75           HA       ARG  75   0.921  10.076  -8.376
  589    HB2  ARG  75           1HB      ARG  75   0.310   7.662  -8.247
  590    HB3  ARG  75           2HB      ARG  75   0.474   7.532  -9.990
  591    HG2  ARG  75           1HG      ARG  75   2.869   8.171  -9.831
  592    HG3  ARG  75           2HG      ARG  75   2.706   8.343  -8.085
  593    HD2  ARG  75           1HD      ARG  75   2.070   5.925  -7.942
  594    HD3  ARG  75           2HD      ARG  75   2.345   5.769  -9.677
  595    HE   ARG  75           HE       ARG  75   4.345   5.821  -7.607
  596   HH11  ARG  75          1HH2      ARG  75   3.711   6.712 -10.906
  597   HH12  ARG  75          2HH2      ARG  75   5.378   6.700 -11.371
  598   HH21  ARG  75          1HH1      ARG  75   6.533   5.792  -8.232
  599   HH22  ARG  75          2HH1      ARG  75   6.971   6.181  -9.861
  600    H    GLN  76           H        GLN  76  -0.416   9.561 -11.595
  601    HA   GLN  76           HA       GLN  76   1.938  10.226 -13.091
  602    HB2  GLN  76           1HB      GLN  76  -1.008  10.369 -13.839
  603    HB3  GLN  76           2HB      GLN  76   0.295  10.645 -14.988
  604    HG2  GLN  76           1HG      GLN  76  -0.060   8.059 -13.402
  605    HG3  GLN  76           2HG      GLN  76  -0.630   8.287 -15.050
  606   HE21  GLN  76          2HE2      GLN  76   1.817   6.782 -13.518
  607   HE22  GLN  76          1HE2      GLN  76   3.070   7.005 -14.639
  608    H    GLU  77           H        GLU  77  -0.738  12.106 -11.759
  609    HA   GLU  77           HA       GLU  77   0.004  14.644 -12.900
  610    HB2  GLU  77           1HB      GLU  77  -1.611  13.926 -10.417
  611    HB3  GLU  77           2HB      GLU  77  -1.371  15.594 -10.932
  612    HG2  GLU  77           1HG      GLU  77  -2.500  15.148 -13.062
  613    HG3  GLU  77           2HG      GLU  77  -2.648  13.447 -12.674
  614    H    LEU  78           H        LEU  78   0.476  13.274  -9.644
  615    HA   LEU  78           HA       LEU  78   2.169  15.255  -8.608
  616    HB2  LEU  78           1HB      LEU  78   2.007  12.286  -8.006
  617    HB3  LEU  78           2HB      LEU  78   2.946  13.398  -7.023
  618    HG   LEU  78           HG       LEU  78  -0.043  13.875  -7.502
  619   HD11  LEU  78          1HD1      LEU  78   0.151  11.625  -6.536
  620   HD12  LEU  78          2HD1      LEU  78  -0.504  12.734  -5.339
  621   HD13  LEU  78          3HD1      LEU  78   1.191  12.239  -5.255
  622   HD21  LEU  78          3HD2      LEU  78   0.142  15.101  -5.306
  623   HD22  LEU  78          1HD2      LEU  78   1.206  15.785  -6.526
  624   HD23  LEU  78          2HD2      LEU  78   1.866  14.739  -5.279
  625    H    ALA  79           H        ALA  79   2.906  12.399 -10.557
  626    HA   ALA  79           HA       ALA  79   5.734  12.492 -10.353
  627    HB1  ALA  79           3HB      ALA  79   4.028  11.466 -12.646
  628    HB2  ALA  79           1HB      ALA  79   4.550  10.525 -11.246
  629    HB3  ALA  79           2HB      ALA  79   5.742  11.111 -12.405
  630    H    ARG  80           H        ARG  80   3.435  13.924 -12.592
  631    HA   ARG  80           HA       ARG  80   5.348  15.169 -14.307
  632    HB2  ARG  80           1HB      ARG  80   3.014  14.622 -14.947
  633    HB3  ARG  80           2HB      ARG  80   2.421  15.835 -13.814
  634    HG2  ARG  80           1HG      ARG  80   3.654  17.598 -15.074
  635    HG3  ARG  80           2HG      ARG  80   4.238  16.377 -16.200
  636    HD2  ARG  80           1HD      ARG  80   1.872  15.834 -16.788
  637    HD3  ARG  80           2HD      ARG  80   1.334  17.140 -15.732
  638    HE   ARG  80           HE       ARG  80   2.411  17.409 -18.386
  639   HH11  ARG  80          1HH2      ARG  80   2.194  18.962 -15.282
  640   HH12  ARG  80          2HH2      ARG  80   2.536  20.542 -15.901
  641   HH21  ARG  80          1HH1      ARG  80   2.854  19.476 -19.187
  642   HH22  ARG  80          2HH1      ARG  80   2.911  20.832 -18.111
  643    H    GLN  81           H        GLN  81   3.533  16.180 -11.443
  644    HA   GLN  81           HA       GLN  81   4.193  18.917 -11.453
  645    HB2  GLN  81           1HB      GLN  81   2.451  17.818 -10.020
  646    HB3  GLN  81           2HB      GLN  81   3.736  17.124  -9.036
  647    HG2  GLN  81           1HG      GLN  81   4.533  19.414  -8.468
  648    HG3  GLN  81           2HG      GLN  81   3.248  20.101  -9.459
  649   HE21  GLN  81          2HE2      GLN  81   1.487  20.745  -8.206
  650   HE22  GLN  81          1HE2      GLN  81   0.986  19.995  -6.768
  651    H    CYS  82           H        CYS  82   5.761  16.241  -9.653
  652    HA   CYS  82           HA       CYS  82   7.941  17.779  -8.683
  653    HB2  CYS  82           1HB      CYS  82   8.916  15.642  -8.040
  654    HB3  CYS  82           2HB      CYS  82   7.185  15.583  -7.726
  655    HG   CYS  82           HG       CYS  82   7.116  13.610  -9.205
  656    H    GLY  83           H        GLY  83   7.352  16.106 -11.691
  657    HA2  GLY  83           1HA      GLY  83   8.448  16.234 -13.711
  658    HA3  GLY  83           2HA      GLY  83   9.614  17.344 -12.997
  659    H    GLU  84           H        GLU  84  10.401  15.350 -14.747
  660    HA   GLU  84           HA       GLU  84  11.246  12.932 -13.531
  661    HB2  GLU  84           1HB      GLU  84  11.087  13.334 -15.992
  662    HB3  GLU  84           2HB      GLU  84  12.494  14.387 -15.896
  663    HG2  GLU  84           1HG      GLU  84  13.866  12.484 -15.073
  664    HG3  GLU  84           2HG      GLU  84  12.450  11.439 -15.128
  665    H    ARG  85           H        ARG  85  12.784  16.082 -13.882
  666    HA   ARG  85           HA       ARG  85  15.354  15.389 -12.876
  667    HB2  ARG  85           1HB      ARG  85  13.897  18.062 -12.845
  668    HB3  ARG  85           2HB      ARG  85  15.629  17.839 -12.580
  669    HG2  ARG  85           1HG      ARG  85  15.860  16.888 -14.864
  670    HG3  ARG  85           2HG      ARG  85  14.127  17.092 -15.129
  671    HD2  ARG  85           1HD      ARG  85  15.344  18.962 -16.157
  672    HD3  ARG  85           2HD      ARG  85  14.394  19.558 -14.794
  673    HE   ARG  85           HE       ARG  85  16.998  18.854 -13.904
  674   HH11  ARG  85          1HH2      ARG  85  15.358  21.232 -15.839
  675   HH12  ARG  85          2HH2      ARG  85  16.511  22.480 -15.513
  676   HH21  ARG  85          1HH1      ARG  85  18.497  20.487 -13.486
  677   HH22  ARG  85          2HH1      ARG  85  18.288  22.058 -14.179
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1 -24.499 -18.496   0.015
    2    H2   MET   1           2H       MET   1 -25.969 -17.653  -0.093
    3    H3   MET   1           3H       MET   1 -25.569 -18.821  -1.260
    4    HA   MET   1           HA       MET   1 -26.428 -19.194   1.533
    5    HB2  MET   1           1HB      MET   1 -27.179 -20.528  -1.105
    6    HB3  MET   1           2HB      MET   1 -27.918 -20.869   0.462
    7    HG2  MET   1           1HG      MET   1 -29.421 -19.323  -0.620
    8    HG3  MET   1           2HG      MET   1 -28.538 -18.342   0.546
    9    HE1  MET   1           3HE      MET   1 -29.111 -15.933  -2.444
   10    HE2  MET   1           1HE      MET   1 -29.328 -16.228  -0.713
   11    HE3  MET   1           2HE      MET   1 -30.182 -17.219  -1.893
   12    H    ASN   2           H        ASN   2 -23.673 -19.649   0.142
   13    HA   ASN   2           HA       ASN   2 -23.253 -22.516   0.270
   14    HB2  ASN   2           1HB      ASN   2 -21.958 -21.003  -1.229
   15    HB3  ASN   2           2HB      ASN   2 -21.230 -20.239   0.180
   16   HD21  ASN   2          2HD2      ASN   2 -19.162 -21.072   0.553
   17   HD22  ASN   2          1HD2      ASN   2 -18.692 -22.681   0.279
   18    H    TYR   3           H        TYR   3 -23.956 -23.025   2.404
   19    HA   TYR   3           HA       TYR   3 -23.751 -23.381   4.671
   20    HB2  TYR   3           1HB      TYR   3 -20.802 -22.965   4.041
   21    HB3  TYR   3           2HB      TYR   3 -21.442 -23.760   5.480
   22    HD1  TYR   3           HD2      TYR   3 -22.686 -25.947   5.288
   23    HD2  TYR   3           HD1      TYR   3 -20.750 -24.156   1.871
   24    HE1  TYR   3           HE2      TYR   3 -22.838 -28.097   4.060
   25    HE2  TYR   3           HE1      TYR   3 -20.913 -26.315   0.662
   26    HH   TYR   3           HH       TYR   3 -21.136 -28.996   1.704
   27    H    SER   4           H        SER   4 -22.217 -22.407   6.667
   28    HA   SER   4           HA       SER   4 -23.290 -19.817   7.159
   29    HB2  SER   4           1HB      SER   4 -21.055 -21.300   8.580
   30    HB3  SER   4           2HB      SER   4 -21.888 -19.881   9.207
   31    HG   SER   4           HG       SER   4 -22.724 -22.511   8.989
   32    H    THR   5           H        THR   5 -22.272 -17.809   7.249
   33    HA   THR   5           HA       THR   5 -20.328 -17.242   5.248
   34    HB   THR   5           HB       THR   5 -20.411 -14.940   6.117
   35    HG1  THR   5           HG1      THR   5 -20.413 -15.459   8.317
   36   HG21  THR   5          3HG2      THR   5 -23.148 -16.275   6.202
   37   HG22  THR   5          1HG2      THR   5 -22.322 -15.742   4.736
   38   HG23  THR   5          2HG2      THR   5 -22.842 -14.558   5.935
   39    H    GLY   6           H        GLY   6 -18.162 -16.850   5.392
   40    HA2  GLY   6           1HA      GLY   6 -16.651 -16.356   7.724
   41    HA3  GLY   6           2HA      GLY   6 -16.615 -18.090   7.412
   42    H    THR   7           H        THR   7 -16.886 -17.418   4.446
   43    HA   THR   7           HA       THR   7 -14.126 -17.560   3.761
   44    HB   THR   7           HB       THR   7 -15.778 -18.496   2.236
   45    HG1  THR   7           HG1      THR   7 -15.073 -16.296   0.736
   46   HG21  THR   7          3HG2      THR   7 -17.396 -17.072   1.033
   47   HG22  THR   7          1HG2      THR   7 -16.852 -15.664   1.938
   48   HG23  THR   7          2HG2      THR   7 -17.670 -16.981   2.771
   49    H    ASP   8           H        ASP   8 -16.358 -14.940   4.206
   50    HA   ASP   8           HA       ASP   8 -15.018 -12.886   2.804
   51    HB2  ASP   8           1HB      ASP   8 -16.781 -12.718   5.278
   52    HB3  ASP   8           2HB      ASP   8 -16.356 -11.361   4.235
   53    H    ALA   9           H        ALA   9 -12.976 -12.269   3.157
   54    HA   ALA   9           HA       ALA   9 -11.541 -12.686   5.613
   55    HB1  ALA   9           3HB      ALA   9 -10.451 -12.681   3.391
   56    HB2  ALA   9           1HB      ALA   9  -9.724 -11.477   4.457
   57    HB3  ALA   9           2HB      ALA   9 -10.854 -10.976   3.193
   58    H    ASN  10           H        ASN  10 -14.005 -10.708   5.273
   59    HA   ASN  10           HA       ASN  10 -14.754  -8.786   6.232
   60    HB2  ASN  10           1HB      ASN  10 -12.311  -9.038   8.026
   61    HB3  ASN  10           2HB      ASN  10 -13.753  -8.091   8.358
   62   HD21  ASN  10          2HD2      ASN  10 -12.359 -10.908   9.282
   63   HD22  ASN  10          1HD2      ASN  10 -13.744 -11.845   9.582
   64    H    THR  11           H        THR  11 -11.253  -8.244   6.585
   65    HA   THR  11           HA       THR  11 -11.321  -5.547   5.757
   66    HB   THR  11           HB       THR  11  -8.856  -5.769   5.538
   67    HG1  THR  11           HG1      THR  11  -8.397  -7.689   4.768
   68   HG21  THR  11          3HG2      THR  11  -9.822  -5.487   7.795
   69   HG22  THR  11          1HG2      THR  11  -8.405  -6.535   7.854
   70   HG23  THR  11          2HG2      THR  11 -10.019  -7.236   7.942
   71    H    LEU  12           H        LEU  12 -10.882  -4.562   3.815
   72    HA   LEU  12           HA       LEU  12 -11.550  -6.058   1.415
   73    HB2  LEU  12           1HB      LEU  12 -12.208  -3.574   2.087
   74    HB3  LEU  12           2HB      LEU  12 -10.635  -3.156   1.426
   75    HG   LEU  12           HG       LEU  12 -11.486  -4.587  -0.705
   76   HD11  LEU  12          1HD1      LEU  12 -13.592  -5.374   0.377
   77   HD12  LEU  12          2HD1      LEU  12 -13.922  -4.434  -1.072
   78   HD13  LEU  12          3HD1      LEU  12 -14.134  -3.707   0.519
   79   HD21  LEU  12          3HD2      LEU  12 -12.445  -2.526  -1.717
   80   HD22  LEU  12          1HD2      LEU  12 -10.974  -2.179  -0.809
   81   HD23  LEU  12          2HD2      LEU  12 -12.547  -1.799  -0.110
   82    H    PHE  13           H        PHE  13  -8.733  -5.762   3.077
   83    HA   PHE  13           HA       PHE  13  -6.929  -5.606   0.714
   84    HB2  PHE  13           1HB      PHE  13  -6.294  -5.658   3.698
   85    HB3  PHE  13           2HB      PHE  13  -5.148  -5.363   2.386
   86    HD1  PHE  13           HD1      PHE  13  -5.514  -3.353   0.828
   87    HD2  PHE  13           HD2      PHE  13  -7.676  -3.814   4.539
   88    HE1  PHE  13           HE1      PHE  13  -6.132  -0.954   0.785
   89    HE2  PHE  13           HE2      PHE  13  -8.274  -1.414   4.478
   90    HZ   PHE  13           HZ       PHE  13  -7.500   0.018   2.607
   91    H    VAL  14           H        VAL  14  -6.566  -7.490  -0.243
   92    HA   VAL  14           HA       VAL  14  -6.500 -10.041   1.301
   93    HB   VAL  14           HB       VAL  14  -6.646  -9.589  -1.713
   94   HG11  VAL  14          1HG1      VAL  14  -7.079 -12.080  -0.001
   95   HG12  VAL  14          2HG1      VAL  14  -5.726 -11.812  -1.098
   96   HG13  VAL  14          3HG1      VAL  14  -7.352 -11.989  -1.741
   97   HG21  VAL  14          3HG2      VAL  14  -9.052 -10.187  -1.457
   98   HG22  VAL  14          1HG2      VAL  14  -8.668  -8.708  -0.583
   99   HG23  VAL  14          2HG2      VAL  14  -8.853 -10.226   0.295
  100    H    ASP  15           H        ASP  15  -4.705 -11.334   1.299
  101    HA   ASP  15           HA       ASP  15  -2.151 -10.181   1.038
  102    HB2  ASP  15           1HB      ASP  15  -1.309 -12.493   1.398
  103    HB3  ASP  15           2HB      ASP  15  -2.591 -12.076   2.531
  104    H    GLY  16           H        GLY  16  -0.631 -10.216  -0.536
  105    HA2  GLY  16           1HA      GLY  16   0.454 -10.752  -2.530
  106    HA3  GLY  16           2HA      GLY  16  -0.857 -11.839  -2.966
  107    H    GLU  17           H        GLU  17  -2.227  -9.006  -1.972
  108    HA   GLU  17           HA       GLU  17  -2.879  -8.166  -4.698
  109    HB2  GLU  17           1HB      GLU  17  -4.593  -8.289  -2.875
  110    HB3  GLU  17           2HB      GLU  17  -3.772  -6.976  -2.037
  111    HG2  GLU  17           1HG      GLU  17  -4.181  -5.466  -3.956
  112    HG3  GLU  17           2HG      GLU  17  -4.933  -6.782  -4.849
  113    H    ARG  18           H        ARG  18  -2.113  -6.401  -5.716
  114    HA   ARG  18           HA       ARG  18   0.152  -4.934  -4.612
  115    HB2  ARG  18           1HB      ARG  18   0.138  -5.657  -6.960
  116    HB3  ARG  18           2HB      ARG  18  -1.308  -4.702  -7.266
  117    HG2  ARG  18           1HG      ARG  18  -0.137  -2.614  -6.989
  118    HG3  ARG  18           2HG      ARG  18   1.246  -3.388  -6.212
  119    HD2  ARG  18           1HD      ARG  18   1.531  -2.684  -8.726
  120    HD3  ARG  18           2HD      ARG  18   2.057  -4.299  -8.265
  121    HE   ARG  18           HE       ARG  18   0.461  -5.154  -9.683
  122   HH11  ARG  18          1HH2      ARG  18  -0.437  -1.924  -8.792
  123   HH12  ARG  18          2HH2      ARG  18  -1.870  -1.917  -9.768
  124   HH21  ARG  18          1HH1      ARG  18  -1.413  -5.144 -10.936
  125   HH22  ARG  18          2HH1      ARG  18  -2.424  -3.736 -10.975
  126    H    VAL  19           H        VAL  19   0.028  -3.049  -3.573
  127    HA   VAL  19           HA       VAL  19  -2.362  -1.276  -3.847
  128    HB   VAL  19           HB       VAL  19  -2.316  -0.872  -1.402
  129   HG11  VAL  19          1HG1      VAL  19  -3.200  -3.086  -0.685
  130   HG12  VAL  19          2HG1      VAL  19  -2.527  -3.822  -2.138
  131   HG13  VAL  19          3HG1      VAL  19  -3.815  -2.626  -2.275
  132   HG21  VAL  19          3HG2      VAL  19  -0.119  -2.995  -1.386
  133   HG22  VAL  19          1HG2      VAL  19  -0.935  -2.408   0.062
  134   HG23  VAL  19          2HG2      VAL  19   0.051  -1.315  -0.899
  135    H    LEU  20           H        LEU  20  -1.901   0.846  -2.726
  136    HA   LEU  20           HA       LEU  20   0.847   1.803  -3.401
  137    HB2  LEU  20           1HB      LEU  20  -1.812   3.231  -3.696
  138    HB3  LEU  20           2HB      LEU  20  -0.242   3.902  -4.099
  139    HG   LEU  20           HG       LEU  20  -1.489   1.463  -5.427
  140   HD11  LEU  20          1HD1      LEU  20  -1.179   4.315  -6.441
  141   HD12  LEU  20          2HD1      LEU  20  -2.691   3.517  -6.006
  142   HD13  LEU  20          3HD1      LEU  20  -1.772   2.954  -7.398
  143   HD21  LEU  20          3HD2      LEU  20   1.187   2.870  -5.830
  144   HD22  LEU  20          1HD2      LEU  20   0.428   2.013  -7.175
  145   HD23  LEU  20          2HD2      LEU  20   0.848   1.144  -5.709
  146    H    CYS  21           H        CYS  21   1.792   3.243  -2.058
  147    HA   CYS  21           HA       CYS  21   0.420   3.959   0.507
  148    HB2  CYS  21           1HB      CYS  21   1.944   2.030   0.851
  149    HB3  CYS  21           2HB      CYS  21   3.281   2.975   0.191
  150    HG   CYS  21           HG       CYS  21   2.531   3.074   3.012
  151    H    PHE  22           H        PHE  22   0.546   6.037   0.989
  152    HA   PHE  22           HA       PHE  22   1.562   7.964  -0.750
  153    HB2  PHE  22           1HB      PHE  22   1.073   8.269   2.201
  154    HB3  PHE  22           2HB      PHE  22   1.127   9.577   1.021
  155    HD1  PHE  22           HD2      PHE  22  -0.672   9.787  -0.738
  156    HD2  PHE  22           HD1      PHE  22  -0.920   6.806   2.374
  157    HE1  PHE  22           HE2      PHE  22  -3.070   9.427  -1.257
  158    HE2  PHE  22           HE1      PHE  22  -3.314   6.462   1.842
  159    HZ   PHE  22           HZ       PHE  22  -4.390   7.769   0.031
  160    H    HIS  23           H        HIS  23   2.840   6.941   2.397
  161    HA   HIS  23           HA       HIS  23   4.877   7.102   3.400
  162    HB2  HIS  23           1HB      HIS  23   5.411   5.519   1.535
  163    HB3  HIS  23           2HB      HIS  23   5.935   6.883   0.565
  164    HD1  HIS  23           HD1      HIS  23   6.748   5.388   3.988
  165    HD2  HIS  23           HD2      HIS  23   8.626   7.399   0.855
  166    HE1  HIS  23           HE1      HIS  23   9.213   5.476   4.567
  167    HE2  HIS  23           HE2      HIS  23  10.371   6.698   2.667
  168    H    GLY  24           H        GLY  24   3.539   9.524   2.061
  169    HA2  GLY  24           1HA      GLY  24   4.639  11.663   3.113
  170    HA3  GLY  24           2HA      GLY  24   5.810  11.420   1.822
  171    HA   PRO  25           HA       PRO  25   2.309  14.237   0.348
  172    HB2  PRO  25           1HB      PRO  25   4.742  15.413  -1.036
  173    HB3  PRO  25           2HB      PRO  25   3.365  16.263  -0.291
  174    HG2  PRO  25           1HG      PRO  25   5.676  16.182   1.003
  175    HG3  PRO  25           2HG      PRO  25   4.172  15.876   1.905
  176    HD2  PRO  25           1HD      PRO  25   6.178  13.833   0.870
  177    HD3  PRO  25           2HD      PRO  25   5.374  13.909   2.459
  178    H    LEU  26           H        LEU  26   4.306  11.892  -0.965
  179    HA   LEU  26           HA       LEU  26   3.011  12.051  -3.683
  180    HB2  LEU  26           1HB      LEU  26   5.752  12.301  -3.198
  181    HB3  LEU  26           2HB      LEU  26   5.617  10.580  -3.477
  182    HG   LEU  26           HG       LEU  26   4.247  11.282  -5.657
  183   HD11  LEU  26          1HD1      LEU  26   5.845  13.832  -5.161
  184   HD12  LEU  26          2HD1      LEU  26   4.097  13.710  -5.027
  185   HD13  LEU  26          3HD1      LEU  26   4.870  13.471  -6.587
  186   HD21  LEU  26          3HD2      LEU  26   7.250  11.743  -5.470
  187   HD22  LEU  26          1HD2      LEU  26   6.359  11.474  -6.971
  188   HD23  LEU  26          2HD2      LEU  26   6.460  10.195  -5.762
  189    H    ILE  27           H        ILE  27   3.498   9.765  -4.754
  190    HA   ILE  27           HA       ILE  27   2.439   7.654  -2.895
  191    HB   ILE  27           HB       ILE  27   1.578   8.148  -5.777
  192   HG12  ILE  27          1HG1      ILE  27  -0.061   8.484  -3.209
  193   HG13  ILE  27          2HG1      ILE  27   0.698   9.832  -4.048
  194   HG21  ILE  27          1HG2      ILE  27  -0.114   6.356  -5.280
  195   HG22  ILE  27          2HG2      ILE  27   0.637   6.127  -3.700
  196   HG23  ILE  27          3HG2      ILE  27   1.527   5.738  -5.169
  197   HD11  ILE  27          3HD1      ILE  27  -1.673   9.610  -4.690
  198   HD12  ILE  27          1HD1      ILE  27  -1.367   7.977  -5.280
  199   HD13  ILE  27          2HD1      ILE  27  -0.608   9.357  -6.072
  200    H    TYR  28           H        TYR  28   3.263   5.664  -3.095
  201    HA   TYR  28           HA       TYR  28   5.351   5.102  -5.164
  202    HB2  TYR  28           1HB      TYR  28   5.459   4.468  -2.184
  203    HB3  TYR  28           2HB      TYR  28   6.707   4.094  -3.382
  204    HD1  TYR  28           HD1      TYR  28   4.864   6.882  -1.664
  205    HD2  TYR  28           HD2      TYR  28   8.260   5.846  -4.150
  206    HE1  TYR  28           HE1      TYR  28   5.839   9.152  -1.351
  207    HE2  TYR  28           HE2      TYR  28   9.187   8.121  -3.819
  208    HH   TYR  28           HH       TYR  28   8.927  10.082  -2.857
  209    H    GLU  29           H        GLU  29   5.754   2.857  -5.505
  210    HA   GLU  29           HA       GLU  29   3.314   1.253  -5.472
  211    HB2  GLU  29           1HB      GLU  29   4.833   1.408  -7.460
  212    HB3  GLU  29           2HB      GLU  29   6.075   0.550  -6.552
  213    HG2  GLU  29           1HG      GLU  29   4.555  -1.402  -6.309
  214    HG3  GLU  29           2HG      GLU  29   3.292  -0.535  -7.181
  215    H    ALA  30           H        ALA  30   2.869  -0.366  -4.114
  216    HA   ALA  30           HA       ALA  30   4.970  -1.776  -2.582
  217    HB1  ALA  30           3HB      ALA  30   3.777  -1.388  -0.455
  218    HB2  ALA  30           1HB      ALA  30   2.615  -0.348  -1.281
  219    HB3  ALA  30           2HB      ALA  30   4.304   0.139  -1.157
  220    H    LYS  31           H        LYS  31   3.814  -3.555  -1.222
  221    HA   LYS  31           HA       LYS  31   1.364  -4.604  -2.488
  222    HB2  LYS  31           1HB      LYS  31   3.244  -5.419  -3.893
  223    HB3  LYS  31           2HB      LYS  31   3.973  -6.156  -2.469
  224    HG2  LYS  31           1HG      LYS  31   2.086  -7.704  -2.217
  225    HG3  LYS  31           2HG      LYS  31   1.167  -6.860  -3.457
  226    HD2  LYS  31           1HD      LYS  31   2.093  -8.911  -4.410
  227    HD3  LYS  31           2HD      LYS  31   2.872  -7.522  -5.160
  228    HE2  LYS  31           1HE      LYS  31   4.901  -7.880  -3.897
  229    HE3  LYS  31           2HE      LYS  31   4.104  -9.012  -2.796
  230    HZ1  LYS  31           3HZ      LYS  31   5.194 -10.383  -4.262
  231    HZ2  LYS  31           1HZ      LYS  31   4.893  -9.394  -5.608
  232    HZ3  LYS  31           2HZ      LYS  31   3.637 -10.322  -4.937
  233    H    VAL  32           H        VAL  32   0.276  -6.111  -1.275
  234    HA   VAL  32           HA       VAL  32   0.953  -6.173   1.596
  235    HB   VAL  32           HB       VAL  32  -1.569  -7.238   0.211
  236   HG11  VAL  32          1HG1      VAL  32  -0.992  -6.439   3.105
  237   HG12  VAL  32          2HG1      VAL  32  -1.188  -8.089   2.516
  238   HG13  VAL  32          3HG1      VAL  32  -2.553  -6.980   2.482
  239   HG21  VAL  32          3HG2      VAL  32  -1.034  -4.492   1.433
  240   HG22  VAL  32          1HG2      VAL  32  -2.600  -5.069   0.862
  241   HG23  VAL  32          2HG2      VAL  32  -1.284  -4.833  -0.273
  242    H    LEU  33           H        LEU  33   2.211  -7.814   2.244
  243    HA   LEU  33           HA       LEU  33   2.278 -10.375   0.796
  244    HB2  LEU  33           1HB      LEU  33   4.402  -9.360   1.533
  245    HB3  LEU  33           2HB      LEU  33   3.860  -9.428   3.199
  246    HG   LEU  33           HG       LEU  33   3.815 -11.917   3.100
  247   HD11  LEU  33          1HD1      LEU  33   5.020 -12.987   1.048
  248   HD12  LEU  33          2HD1      LEU  33   4.618 -11.490   0.205
  249   HD13  LEU  33          3HD1      LEU  33   3.339 -12.514   0.858
  250   HD21  LEU  33          3HD2      LEU  33   6.273 -12.257   2.971
  251   HD22  LEU  33          1HD2      LEU  33   5.854 -10.790   3.854
  252   HD23  LEU  33          2HD2      LEU  33   6.433 -10.683   2.194
  253    H    LYS  34           H        LYS  34   1.118  -9.041   3.823
  254    HA   LYS  34           HA       LYS  34  -0.488 -11.445   4.307
  255    HB2  LYS  34           1HB      LYS  34   1.702 -12.012   5.308
  256    HB3  LYS  34           2HB      LYS  34   1.622 -10.593   6.329
  257    HG2  LYS  34           1HG      LYS  34  -0.535 -11.498   7.328
  258    HG3  LYS  34           2HG      LYS  34  -0.279 -12.977   6.402
  259    HD2  LYS  34           1HD      LYS  34   1.590 -11.838   8.531
  260    HD3  LYS  34           2HD      LYS  34   0.520 -13.231   8.732
  261    HE2  LYS  34           1HE      LYS  34   3.036 -13.033   7.021
  262    HE3  LYS  34           2HE      LYS  34   2.667 -14.196   8.291
  263    HZ1  LYS  34           3HZ      LYS  34   1.422 -14.010   5.609
  264    HZ2  LYS  34           1HZ      LYS  34   0.811 -14.982   6.856
  265    HZ3  LYS  34           2HZ      LYS  34   2.363 -15.282   6.233
  266    H    THR  35           H        THR  35  -2.226 -11.059   5.588
  267    HA   THR  35           HA       THR  35  -2.607  -8.318   6.728
  268    HB   THR  35           HB       THR  35  -3.777  -8.336   4.598
  269    HG1  THR  35           HG1      THR  35  -5.641  -8.909   6.650
  270   HG21  THR  35          3HG2      THR  35  -5.114 -10.899   5.550
  271   HG22  THR  35          1HG2      THR  35  -3.928 -10.786   4.252
  272   HG23  THR  35          2HG2      THR  35  -5.506 -10.022   4.077
  273    H    LYS  36           H        LYS  36  -3.760  -8.187   8.573
  274    HA   LYS  36           HA       LYS  36  -4.560 -10.775   9.862
  275    HB2  LYS  36           1HB      LYS  36  -2.625  -9.583  10.891
  276    HB3  LYS  36           2HB      LYS  36  -3.691  -8.257  11.273
  277    HG2  LYS  36           1HG      LYS  36  -5.120  -9.777  12.640
  278    HG3  LYS  36           2HG      LYS  36  -4.088 -11.131  12.207
  279    HD2  LYS  36           1HD      LYS  36  -3.243 -10.562  14.348
  280    HD3  LYS  36           2HD      LYS  36  -2.130  -9.707  13.285
  281    HE2  LYS  36           1HE      LYS  36  -2.852  -8.243  15.128
  282    HE3  LYS  36           2HE      LYS  36  -3.485  -7.625  13.607
  283    HZ1  LYS  36           3HZ      LYS  36  -4.981  -8.021  15.753
  284    HZ2  LYS  36           1HZ      LYS  36  -5.157  -9.536  15.011
  285    HZ3  LYS  36           2HZ      LYS  36  -5.592  -8.125  14.171
  286    HA   PRO  37           HA       PRO  37  -8.456  -8.259   9.631
  287    HB2  PRO  37           1HB      PRO  37 -10.145 -10.047   8.589
  288    HB3  PRO  37           2HB      PRO  37  -8.836  -9.400   7.568
  289    HG2  PRO  37           1HG      PRO  37  -8.888 -12.002   9.109
  290    HG3  PRO  37           2HG      PRO  37  -8.506 -11.749   7.389
  291    HD2  PRO  37           1HD      PRO  37  -6.541 -11.904   9.325
  292    HD3  PRO  37           2HD      PRO  37  -6.336 -10.919   7.860
  293    H    ASP  38           H        ASP  38  -7.273 -10.221  11.808
  294    HA   ASP  38           HA       ASP  38  -9.616 -11.324  13.106
  295    HB2  ASP  38           1HB      ASP  38  -7.341 -12.332  13.279
  296    HB3  ASP  38           2HB      ASP  38  -6.802 -10.929  14.196
  297    H    ALA  39           H        ALA  39  -8.944  -8.226  12.671
  298    HA   ALA  39           HA       ALA  39 -10.373  -7.361  15.062
  299    HB1  ALA  39           3HB      ALA  39  -7.549  -6.350  14.593
  300    HB2  ALA  39           1HB      ALA  39  -8.035  -7.445  15.882
  301    HB3  ALA  39           2HB      ALA  39  -8.653  -5.792  15.845
  302    H    THR  40           H        THR  40 -10.918  -5.090  15.021
  303    HA   THR  40           HA       THR  40 -10.731  -3.729  12.391
  304    HB   THR  40           HB       THR  40 -13.152  -3.329  12.341
  305    HG1  THR  40           HG1      THR  40 -13.516  -3.461  14.565
  306   HG21  THR  40          3HG2      THR  40 -12.153  -5.417  11.253
  307   HG22  THR  40          1HG2      THR  40 -13.856  -5.564  11.686
  308   HG23  THR  40          2HG2      THR  40 -12.627  -6.308  12.700
  309    HA   PRO  41           HA       PRO  41  -9.807  -1.744  11.830
  310    HB2  PRO  41           1HB      PRO  41  -7.828  -0.067  13.355
  311    HB3  PRO  41           2HB      PRO  41  -8.690   0.318  11.847
  312    HG2  PRO  41           1HG      PRO  41  -9.396   1.543  14.103
  313    HG3  PRO  41           2HG      PRO  41 -10.657   0.951  12.993
  314    HD2  PRO  41           1HD      PRO  41  -9.586  -0.442  15.484
  315    HD3  PRO  41           2HD      PRO  41 -11.284  -0.062  15.075
  316    H    VAL  42           H        VAL  42  -7.179  -1.859  11.544
  317    HA   VAL  42           HA       VAL  42  -5.776  -3.460  13.462
  318    HB   VAL  42           HB       VAL  42  -7.462  -5.105  12.466
  319   HG11  VAL  42          1HG1      VAL  42  -7.181  -5.953  10.208
  320   HG12  VAL  42          2HG1      VAL  42  -5.752  -4.956   9.958
  321   HG13  VAL  42          3HG1      VAL  42  -7.335  -4.197  10.119
  322   HG21  VAL  42          3HG2      VAL  42  -6.002  -6.914  12.766
  323   HG22  VAL  42          1HG2      VAL  42  -4.945  -5.662  13.389
  324   HG23  VAL  42          2HG2      VAL  42  -4.763  -6.224  11.739
  325    H    GLU  43           H        GLU  43  -3.907  -4.714  11.913
  326    HA   GLU  43           HA       GLU  43  -2.593  -2.539  10.363
  327    HB2  GLU  43           1HB      GLU  43  -0.463  -3.556  11.167
  328    HB3  GLU  43           2HB      GLU  43  -1.442  -2.921  12.487
  329    HG2  GLU  43           1HG      GLU  43  -2.296  -5.217  12.948
  330    HG3  GLU  43           2HG      GLU  43  -1.282  -5.852  11.656
  331    H    TYR  44           H        TYR  44  -1.163  -3.271   8.704
  332    HA   TYR  44           HA       TYR  44  -1.754  -5.953   7.532
  333    HB2  TYR  44           1HB      TYR  44  -1.757  -3.254   6.118
  334    HB3  TYR  44           2HB      TYR  44  -1.977  -4.824   5.335
  335    HD1  TYR  44           HD2      TYR  44  -3.480  -2.393   7.751
  336    HD2  TYR  44           HD1      TYR  44  -4.111  -6.053   5.554
  337    HE1  TYR  44           HE2      TYR  44  -5.881  -2.361   8.365
  338    HE2  TYR  44           HE1      TYR  44  -6.502  -6.004   6.178
  339    HH   TYR  44           HH       TYR  44  -7.906  -3.260   7.917
  340    H    TYR  45           H        TYR  45  -0.125  -6.869   6.407
  341    HA   TYR  45           HA       TYR  45   2.567  -5.861   6.993
  342    HB2  TYR  45           1HB      TYR  45   1.759  -8.321   7.115
  343    HB3  TYR  45           2HB      TYR  45   1.978  -8.360   5.374
  344    HD1  TYR  45           HD1      TYR  45   4.324  -7.457   4.456
  345    HD2  TYR  45           HD2      TYR  45   3.693  -8.783   8.503
  346    HE1  TYR  45           HE1      TYR  45   6.754  -7.843   4.715
  347    HE2  TYR  45           HE2      TYR  45   6.125  -9.152   8.753
  348    HH   TYR  45           HH       TYR  45   8.071  -9.344   7.632
  349    H    ILE  46           H        ILE  46   3.066  -4.170   5.741
  350    HA   ILE  46           HA       ILE  46   2.845  -4.372   2.768
  351    HB   ILE  46           HB       ILE  46   2.689  -2.098   4.762
  352   HG12  ILE  46          1HG1      ILE  46   0.844  -1.320   3.344
  353   HG13  ILE  46          2HG1      ILE  46   1.258  -2.477   2.085
  354   HG21  ILE  46          1HG2      ILE  46   3.082  -0.436   2.784
  355   HG22  ILE  46          2HG2      ILE  46   3.854  -1.794   1.963
  356   HG23  ILE  46          3HG2      ILE  46   4.521  -1.186   3.471
  357   HD11  ILE  46          3HD1      ILE  46  -0.731  -3.050   3.558
  358   HD12  ILE  46          1HD1      ILE  46   0.420  -3.346   4.862
  359   HD13  ILE  46          2HD1      ILE  46   0.487  -4.305   3.380
  360    H    HIS  47           H        HIS  47   4.607  -4.226   1.567
  361    HA   HIS  47           HA       HIS  47   7.244  -3.531   2.713
  362    HB2  HIS  47           1HB      HIS  47   8.256  -5.553   1.672
  363    HB3  HIS  47           2HB      HIS  47   7.096  -5.979   2.931
  364    HD1  HIS  47           HD1      HIS  47   7.924  -6.713  -0.496
  365    HD2  HIS  47           HD2      HIS  47   4.403  -6.598   1.723
  366    HE1  HIS  47           HE1      HIS  47   6.212  -8.023  -1.814
  367    HE2  HIS  47           HE2      HIS  47   4.043  -7.936  -0.496
  368    H    TYR  48           H        TYR  48   8.493  -2.447   1.314
  369    HA   TYR  48           HA       TYR  48   7.355  -1.435  -1.129
  370    HB2  TYR  48           1HB      TYR  48  10.158  -1.189   0.028
  371    HB3  TYR  48           2HB      TYR  48   9.537  -0.245  -1.327
  372    HD1  TYR  48           HD2      TYR  48   9.265  -0.823   2.344
  373    HD2  TYR  48           HD1      TYR  48   7.828   1.524  -0.980
  374    HE1  TYR  48           HE2      TYR  48   8.200   0.775   3.915
  375    HE2  TYR  48           HE1      TYR  48   6.768   3.106   0.606
  376    HH   TYR  48           HH       TYR  48   7.014   3.815   2.932
  377    H    ALA  49           H        ALA  49   7.558  -2.193  -3.136
  378    HA   ALA  49           HA       ALA  49   8.795  -4.733  -3.680
  379    HB1  ALA  49           3HB      ALA  49   7.998  -4.344  -5.986
  380    HB2  ALA  49           1HB      ALA  49   7.621  -2.668  -5.576
  381    HB3  ALA  49           2HB      ALA  49   6.731  -3.983  -4.812
  382    H    GLY  50           H        GLY  50  10.598  -5.183  -4.955
  383    HA2  GLY  50           1HA      GLY  50  12.567  -4.851  -6.127
  384    HA3  GLY  50           2HA      GLY  50  12.240  -3.122  -6.194
  385    H    TRP  51           H        TRP  51  12.039  -4.582  -3.090
  386    HA   TRP  51           HA       TRP  51  14.843  -3.896  -2.356
  387    HB2  TRP  51           1HB      TRP  51  12.358  -2.839  -0.948
  388    HB3  TRP  51           2HB      TRP  51  14.018  -2.618  -0.393
  389    HD1  TRP  51           HD1      TRP  51  11.480  -1.046  -2.623
  390    HE1  TRP  51           HE1      TRP  51  12.545   0.857  -3.992
  391    HE3  TRP  51           HE3      TRP  51  16.411  -1.953  -1.688
  392    HZ2  TRP  51           HZ2      TRP  51  15.146   1.865  -4.610
  393    HZ3  TRP  51           HZ3      TRP  51  18.168  -0.508  -2.678
  394    HH2  TRP  51           HH2      TRP  51  17.542   1.401  -4.139
  395    H    SER  52           H        SER  52  15.193  -4.470   0.010
  396    HA   SER  52           HA       SER  52  14.835  -7.266   0.315
  397    HB2  SER  52           1HB      SER  52  16.728  -6.046   1.318
  398    HB3  SER  52           2HB      SER  52  15.623  -5.172   2.374
  399    HG   SER  52           HG       SER  52  16.041  -7.982   2.280
  400    H    LYS  53           H        LYS  53  13.450  -8.453   1.568
  401    HA   LYS  53           HA       LYS  53  10.886  -7.273   2.299
  402    HB2  LYS  53           1HB      LYS  53  11.927 -10.128   2.466
  403    HB3  LYS  53           2HB      LYS  53  10.259  -9.625   2.757
  404    HG2  LYS  53           1HG      LYS  53  10.090  -8.781   0.435
  405    HG3  LYS  53           2HG      LYS  53  11.775  -9.213   0.144
  406    HD2  LYS  53           1HD      LYS  53  10.386 -10.968  -0.813
  407    HD3  LYS  53           2HD      LYS  53  11.182 -11.633   0.611
  408    HE2  LYS  53           1HE      LYS  53   9.123 -11.512   1.902
  409    HE3  LYS  53           2HE      LYS  53   8.351 -10.498   0.680
  410    HZ1  LYS  53           3HZ      LYS  53   7.578 -12.374  -0.162
  411    HZ2  LYS  53           1HZ      LYS  53   8.590 -13.332   0.809
  412    HZ3  LYS  53           2HZ      LYS  53   9.160 -12.725  -0.672
  413    H    ASN  54           H        ASN  54  13.827  -7.701   3.896
  414    HA   ASN  54           HA       ASN  54  12.908  -8.454   6.510
  415    HB2  ASN  54           1HB      ASN  54  15.448  -6.995   5.676
  416    HB3  ASN  54           2HB      ASN  54  15.167  -7.779   7.231
  417   HD21  ASN  54          2HD2      ASN  54  16.873  -8.322   4.530
  418   HD22  ASN  54          1HD2      ASN  54  16.728 -10.009   4.394
  419    H    TRP  55           H        TRP  55  12.342  -5.727   4.734
  420    HA   TRP  55           HA       TRP  55  12.717  -3.611   6.591
  421    HB2  TRP  55           1HB      TRP  55  12.352  -3.381   4.117
  422    HB3  TRP  55           2HB      TRP  55  10.664  -3.832   4.346
  423    HD1  TRP  55           HD1      TRP  55   9.072  -1.836   4.803
  424    HE1  TRP  55           HE1      TRP  55   9.366   0.609   5.539
  425    HE3  TRP  55           HE3      TRP  55  14.102  -1.766   5.685
  426    HZ2  TRP  55           HZ2      TRP  55  11.445   2.377   6.381
  427    HZ3  TRP  55           HZ3      TRP  55  15.216   0.314   6.453
  428    HH2  TRP  55           HH2      TRP  55  13.894   2.386   6.800
  429    H    ASP  56           H        ASP  56  10.099  -5.871   6.005
  430    HA   ASP  56           HA       ASP  56   7.989  -6.110   6.988
  431    HB2  ASP  56           1HB      ASP  56   9.642  -7.479   8.245
  432    HB3  ASP  56           2HB      ASP  56   9.840  -6.164   9.394
  433    H    GLU  57           H        GLU  57   7.151  -3.882   6.571
  434    HA   GLU  57           HA       GLU  57   6.995  -2.204   9.060
  435    HB2  GLU  57           1HB      GLU  57   8.100  -1.181   7.042
  436    HB3  GLU  57           2HB      GLU  57   6.568  -1.293   6.188
  437    HG2  GLU  57           1HG      GLU  57   6.765   0.967   7.095
  438    HG3  GLU  57           2HG      GLU  57   5.536   0.131   8.030
  439    H    TRP  58           H        TRP  58   5.177  -2.586  10.095
  440    HA   TRP  58           HA       TRP  58   2.688  -3.357   8.769
  441    HB2  TRP  58           1HB      TRP  58   3.696  -3.192  11.622
  442    HB3  TRP  58           2HB      TRP  58   1.960  -3.183  11.365
  443    HD1  TRP  58           HD1      TRP  58   1.016  -5.316   9.827
  444    HE1  TRP  58           HE1      TRP  58   1.724  -7.789   9.958
  445    HE3  TRP  58           HE3      TRP  58   5.563  -4.809  12.091
  446    HZ2  TRP  58           HZ2      TRP  58   3.923  -9.359  10.891
  447    HZ3  TRP  58           HZ3      TRP  58   6.951  -6.807  12.588
  448    HH2  TRP  58           HH2      TRP  58   6.138  -9.076  11.991
  449    H    VAL  59           H        VAL  59   1.006  -1.983   8.390
  450    HA   VAL  59           HA       VAL  59   1.025   0.743   9.595
  451    HB   VAL  59           HB       VAL  59   0.624   1.755   7.350
  452   HG11  VAL  59          1HG1      VAL  59   3.177   0.085   7.353
  453   HG12  VAL  59          2HG1      VAL  59   2.975   1.550   8.305
  454   HG13  VAL  59          3HG1      VAL  59   2.921   1.630   6.546
  455   HG21  VAL  59          3HG2      VAL  59   1.044   0.364   5.320
  456   HG22  VAL  59          1HG2      VAL  59  -0.344  -0.226   6.221
  457   HG23  VAL  59          2HG2      VAL  59   1.191  -1.062   6.343
  458    HA   PRO  60           HA       PRO  60  -3.382  -0.033   9.841
  459    HB2  PRO  60           1HB      PRO  60  -4.388   2.441  10.314
  460    HB3  PRO  60           2HB      PRO  60  -3.283   1.684  11.493
  461    HG2  PRO  60           1HG      PRO  60  -2.584   3.636   9.288
  462    HG3  PRO  60           2HG      PRO  60  -2.215   3.768  11.023
  463    HD2  PRO  60           1HD      PRO  60  -0.363   2.771   9.311
  464    HD3  PRO  60           2HD      PRO  60  -0.555   2.055  10.927
  465    H    GLU  61           H        GLU  61  -5.308   0.155   8.618
  466    HA   GLU  61           HA       GLU  61  -5.142   0.288   5.856
  467    HB2  GLU  61           1HB      GLU  61  -7.661   0.530   5.895
  468    HB3  GLU  61           2HB      GLU  61  -7.052  -0.766   6.921
  469    HG2  GLU  61           1HG      GLU  61  -7.198   0.729   8.904
  470    HG3  GLU  61           2HG      GLU  61  -7.824   2.020   7.881
  471    H    ASN  62           H        ASN  62  -5.304   2.904   8.065
  472    HA   ASN  62           HA       ASN  62  -6.456   4.930   6.443
  473    HB2  ASN  62           1HB      ASN  62  -6.161   5.117   8.894
  474    HB3  ASN  62           2HB      ASN  62  -4.419   5.185   8.678
  475   HD21  ASN  62          2HD2      ASN  62  -7.435   6.975   8.062
  476   HD22  ASN  62          1HD2      ASN  62  -6.686   8.479   7.830
  477    H    ARG  63           H        ARG  63  -3.063   3.893   6.837
  478    HA   ARG  63           HA       ARG  63  -2.112   5.914   4.910
  479    HB2  ARG  63           1HB      ARG  63  -0.802   5.507   6.940
  480    HB3  ARG  63           2HB      ARG  63  -0.616   3.808   6.509
  481    HG2  ARG  63           1HG      ARG  63   0.856   4.289   4.676
  482    HG3  ARG  63           2HG      ARG  63   0.341   5.973   4.566
  483    HD2  ARG  63           1HD      ARG  63   2.645   5.659   5.581
  484    HD3  ARG  63           2HD      ARG  63   1.520   6.549   6.606
  485    HE   ARG  63           HE       ARG  63   1.408   3.769   7.227
  486   HH11  ARG  63          1HH2      ARG  63   3.461   6.558   7.533
  487   HH12  ARG  63          2HH2      ARG  63   4.182   6.028   9.018
  488   HH21  ARG  63          1HH1      ARG  63   2.329   3.108   9.188
  489   HH22  ARG  63          2HH1      ARG  63   3.550   4.077   9.945
  490    H    VAL  64           H        VAL  64  -3.496   2.900   4.633
  491    HA   VAL  64           HA       VAL  64  -1.884   2.067   2.272
  492    HB   VAL  64           HB       VAL  64  -4.222   0.633   3.608
  493   HG11  VAL  64          1HG1      VAL  64  -3.359  -1.348   2.344
  494   HG12  VAL  64          2HG1      VAL  64  -2.158  -0.314   1.569
  495   HG13  VAL  64          3HG1      VAL  64  -3.871  -0.068   1.251
  496   HG21  VAL  64          3HG2      VAL  64  -1.216   0.202   3.890
  497   HG22  VAL  64          1HG2      VAL  64  -2.469  -0.812   4.612
  498   HG23  VAL  64          2HG2      VAL  64  -2.278   0.856   5.134
  499    H    LEU  65           H        LEU  65  -2.560   2.408   0.258
  500    HA   LEU  65           HA       LEU  65  -5.372   3.294  -0.239
  501    HB2  LEU  65           1HB      LEU  65  -3.702   5.133  -0.483
  502    HB3  LEU  65           2HB      LEU  65  -2.874   4.191  -1.711
  503    HG   LEU  65           HG       LEU  65  -4.991   4.238  -3.106
  504   HD11  LEU  65          1HD1      LEU  65  -6.026   5.907  -0.783
  505   HD12  LEU  65          2HD1      LEU  65  -6.808   4.561  -1.608
  506   HD13  LEU  65          3HD1      LEU  65  -6.688   6.116  -2.406
  507   HD21  LEU  65          3HD2      LEU  65  -4.775   6.611  -3.790
  508   HD22  LEU  65          1HD2      LEU  65  -3.194   5.894  -3.485
  509   HD23  LEU  65          2HD2      LEU  65  -3.924   6.965  -2.288
  510    H    LYS  66           H        LYS  66  -6.482   2.217  -1.725
  511    HA   LYS  66           HA       LYS  66  -5.506  -0.240  -2.803
  512    HB2  LYS  66           1HB      LYS  66  -7.721  -0.262  -4.010
  513    HB3  LYS  66           2HB      LYS  66  -7.853   0.001  -2.270
  514    HG2  LYS  66           1HG      LYS  66  -8.179   2.406  -2.581
  515    HG3  LYS  66           2HG      LYS  66  -7.863   2.274  -4.309
  516    HD2  LYS  66           1HD      LYS  66 -10.277   2.439  -3.931
  517    HD3  LYS  66           2HD      LYS  66  -9.890   0.841  -4.565
  518    HE2  LYS  66           1HE      LYS  66 -10.235  -0.189  -2.404
  519    HE3  LYS  66           2HE      LYS  66 -10.193   1.369  -1.572
  520    HZ1  LYS  66           3HZ      LYS  66 -12.173   1.811  -3.244
  521    HZ2  LYS  66           1HZ      LYS  66 -12.407   1.112  -1.716
  522    HZ3  LYS  66           2HZ      LYS  66 -12.334   0.125  -3.097
  523    H    TYR  67           H        TYR  67  -5.390  -0.815  -5.053
  524    HA   TYR  67           HA       TYR  67  -4.018   1.248  -6.647
  525    HB2  TYR  67           1HB      TYR  67  -3.052  -1.040  -6.390
  526    HB3  TYR  67           2HB      TYR  67  -4.454  -1.722  -7.209
  527    HD1  TYR  67           HD2      TYR  67  -1.420   0.401  -7.632
  528    HD2  TYR  67           HD1      TYR  67  -4.769  -1.406  -9.658
  529    HE1  TYR  67           HE2      TYR  67  -0.382   0.923  -9.820
  530    HE2  TYR  67           HE1      TYR  67  -3.720  -0.876 -11.843
  531    HH   TYR  67           HH       TYR  67  -1.035  -0.457 -12.543
  532    H    ASN  68           H        ASN  68  -5.101   2.411  -8.106
  533    HA   ASN  68           HA       ASN  68  -7.192   1.220  -9.783
  534    HB2  ASN  68           1HB      ASN  68  -8.412   1.984  -7.747
  535    HB3  ASN  68           2HB      ASN  68  -7.808   3.616  -8.003
  536   HD21  ASN  68          2HD2      ASN  68  -9.511   1.057  -9.909
  537   HD22  ASN  68          1HD2      ASN  68 -10.569   2.138 -10.679
  538    H    ASP  69           H        ASP  69  -7.518   2.322 -11.678
  539    HA   ASP  69           HA       ASP  69  -5.464   3.677 -12.879
  540    HB2  ASP  69           1HB      ASP  69  -7.143   4.400 -14.564
  541    HB3  ASP  69           2HB      ASP  69  -7.362   2.715 -14.097
  542    H    ASP  70           H        ASP  70  -7.915   5.029 -10.768
  543    HA   ASP  70           HA       ASP  70  -7.442   7.794 -11.442
  544    HB2  ASP  70           1HB      ASP  70  -9.580   6.970 -10.439
  545    HB3  ASP  70           2HB      ASP  70  -8.729   6.630  -8.934
  546    H    ASN  71           H        ASN  71  -6.378   5.645  -8.795
  547    HA   ASN  71           HA       ASN  71  -4.863   7.603  -7.382
  548    HB2  ASN  71           1HB      ASN  71  -4.425   4.592  -7.483
  549    HB3  ASN  71           2HB      ASN  71  -3.791   5.697  -6.263
  550   HD21  ASN  71          2HD2      ASN  71  -5.957   3.402  -6.289
  551   HD22  ASN  71          1HD2      ASN  71  -7.237   4.100  -5.418
  552    H    VAL  72           H        VAL  72  -4.108   5.392 -10.016
  553    HA   VAL  72           HA       VAL  72  -1.299   5.933 -10.183
  554    HB   VAL  72           HB       VAL  72  -3.265   5.037 -12.342
  555   HG11  VAL  72          1HG1      VAL  72  -1.211   4.142 -13.493
  556   HG12  VAL  72          2HG1      VAL  72  -0.214   4.934 -12.274
  557   HG13  VAL  72          3HG1      VAL  72  -1.190   5.897 -13.380
  558   HG21  VAL  72          3HG2      VAL  72  -1.393   3.422 -10.553
  559   HG22  VAL  72          1HG2      VAL  72  -2.432   2.759 -11.813
  560   HG23  VAL  72          2HG2      VAL  72  -3.144   3.500 -10.384
  561    H    LYS  73           H        LYS  73  -4.175   7.318 -11.748
  562    HA   LYS  73           HA       LYS  73  -2.949   9.213 -13.409
  563    HB2  LYS  73           1HB      LYS  73  -5.340   8.542 -13.518
  564    HB3  LYS  73           2HB      LYS  73  -5.642   9.414 -12.025
  565    HG2  LYS  73           1HG      LYS  73  -4.955  11.542 -13.111
  566    HG3  LYS  73           2HG      LYS  73  -4.639  10.663 -14.609
  567    HD2  LYS  73           1HD      LYS  73  -7.028   9.976 -14.710
  568    HD3  LYS  73           2HD      LYS  73  -7.343  10.856 -13.214
  569    HE2  LYS  73           1HE      LYS  73  -6.680  12.972 -14.321
  570    HE3  LYS  73           2HE      LYS  73  -6.378  12.089 -15.820
  571    HZ1  LYS  73           3HZ      LYS  73  -8.849  12.978 -14.712
  572    HZ2  LYS  73           1HZ      LYS  73  -8.881  11.313 -15.028
  573    HZ3  LYS  73           2HZ      LYS  73  -8.514  12.404 -16.277
  574    H    ARG  74           H        ARG  74  -3.963   9.393 -10.024
  575    HA   ARG  74           HA       ARG  74  -3.356  12.150  -9.587
  576    HB2  ARG  74           1HB      ARG  74  -3.636   9.783  -7.703
  577    HB3  ARG  74           2HB      ARG  74  -3.290  11.409  -7.108
  578    HG2  ARG  74           1HG      ARG  74  -5.368  12.258  -8.124
  579    HG3  ARG  74           2HG      ARG  74  -5.718  10.671  -8.798
  580    HD2  ARG  74           1HD      ARG  74  -7.017  11.003  -6.734
  581    HD3  ARG  74           2HD      ARG  74  -5.827   9.726  -6.499
  582    HE   ARG  74           HE       ARG  74  -4.755  11.059  -4.933
  583   HH11  ARG  74          1HH2      ARG  74  -6.909  13.015  -6.838
  584   HH12  ARG  74          2HH2      ARG  74  -6.659  14.442  -5.888
  585   HH21  ARG  74          1HH1      ARG  74  -4.436  12.924  -3.702
  586   HH22  ARG  74          2HH1      ARG  74  -5.262  14.392  -4.116
  587    H    ARG  75           H        ARG  75  -1.450   9.175  -9.218
  588    HA   ARG  75           HA       ARG  75   0.865  10.402  -8.076
  589    HB2  ARG  75           1HB      ARG  75   0.439   7.957  -7.986
  590    HB3  ARG  75           2HB      ARG  75   0.670   7.851  -9.732
  591    HG2  ARG  75           1HG      ARG  75   3.012   8.602  -9.507
  592    HG3  ARG  75           2HG      ARG  75   2.799   8.852  -7.778
  593    HD2  ARG  75           1HD      ARG  75   2.376   6.435  -7.477
  594    HD3  ARG  75           2HD      ARG  75   2.556   6.176  -9.211
  595    HE   ARG  75           HE       ARG  75   4.677   6.496  -7.286
  596   HH11  ARG  75          1HH2      ARG  75   3.774   7.046 -10.598
  597   HH12  ARG  75          2HH2      ARG  75   5.409   7.095 -11.175
  598   HH21  ARG  75          1HH1      ARG  75   6.809   6.550  -8.050
  599   HH22  ARG  75          2HH1      ARG  75   7.122   6.817  -9.735
  600    H    GLN  76           H        GLN  76  -0.219   9.715 -11.329
  601    HA   GLN  76           HA       GLN  76   2.110  10.580 -12.725
  602    HB2  GLN  76           1HB      GLN  76   0.563   9.096 -13.813
  603    HB3  GLN  76           2HB      GLN  76  -0.791  10.139 -13.437
  604    HG2  GLN  76           1HG      GLN  76  -0.112  10.250 -15.833
  605    HG3  GLN  76           2HG      GLN  76  -0.063  11.810 -15.027
  606   HE21  GLN  76          2HE2      GLN  76   2.332   9.091 -15.104
  607   HE22  GLN  76          1HE2      GLN  76   3.617  10.059 -15.648
  608    H    GLU  77           H        GLU  77  -0.825  12.133 -11.541
  609    HA   GLU  77           HA       GLU  77  -0.440  14.691 -12.795
  610    HB2  GLU  77           1HB      GLU  77  -2.619  13.870 -11.848
  611    HB3  GLU  77           2HB      GLU  77  -1.951  14.036 -10.230
  612    HG2  GLU  77           1HG      GLU  77  -1.641  16.461 -10.583
  613    HG3  GLU  77           2HG      GLU  77  -2.269  16.307 -12.222
  614    H    LEU  78           H        LEU  78   0.145  13.492  -9.506
  615    HA   LEU  78           HA       LEU  78   1.472  15.759  -8.465
  616    HB2  LEU  78           1HB      LEU  78   1.646  12.806  -7.791
  617    HB3  LEU  78           2HB      LEU  78   2.401  14.045  -6.795
  618    HG   LEU  78           HG       LEU  78  -0.597  14.193  -7.413
  619   HD11  LEU  78          1HD1      LEU  78  -1.049  12.995  -5.283
  620   HD12  LEU  78          2HD1      LEU  78   0.676  12.665  -5.108
  621   HD13  LEU  78          3HD1      LEU  78  -0.227  11.957  -6.445
  622   HD21  LEU  78          3HD2      LEU  78   0.459  16.200  -6.367
  623   HD22  LEU  78          1HD2      LEU  78   1.085  15.196  -5.063
  624   HD23  LEU  78          2HD2      LEU  78  -0.651  15.437  -5.241
  625    H    ALA  79           H        ALA  79   2.705  12.888 -10.150
  626    HA   ALA  79           HA       ALA  79   5.481  13.456  -9.887
  627    HB1  ALA  79           3HB      ALA  79   5.758  11.812 -11.711
  628    HB2  ALA  79           1HB      ALA  79   4.023  11.869 -12.010
  629    HB3  ALA  79           2HB      ALA  79   4.634  11.229 -10.481
  630    H    ARG  80           H        ARG  80   3.018  14.401 -12.183
  631    HA   ARG  80           HA       ARG  80   4.808  15.637 -14.071
  632    HB2  ARG  80           1HB      ARG  80   2.562  14.762 -14.657
  633    HB3  ARG  80           2HB      ARG  80   1.816  16.004 -13.654
  634    HG2  ARG  80           1HG      ARG  80   2.805  17.767 -15.082
  635    HG3  ARG  80           2HG      ARG  80   3.607  16.537 -16.056
  636    HD2  ARG  80           1HD      ARG  80   1.415  15.617 -16.714
  637    HD3  ARG  80           2HD      ARG  80   0.601  16.828 -15.723
  638    HE   ARG  80           HE       ARG  80   2.343  18.172 -17.486
  639   HH11  ARG  80          1HH2      ARG  80  -0.569  16.273 -17.583
  640   HH12  ARG  80          2HH2      ARG  80  -1.160  17.028 -19.027
  641   HH21  ARG  80          1HH1      ARG  80   1.566  19.146 -19.360
  642   HH22  ARG  80          2HH1      ARG  80   0.047  18.650 -20.032
  643    H    GLN  81           H        GLN  81   2.714  16.787 -11.444
  644    HA   GLN  81           HA       GLN  81   3.430  19.567 -11.715
  645    HB2  GLN  81           1HB      GLN  81   1.872  17.880  -9.730
  646    HB3  GLN  81           2HB      GLN  81   2.308  19.527  -9.279
  647    HG2  GLN  81           1HG      GLN  81   0.032  19.398 -10.311
  648    HG3  GLN  81           2HG      GLN  81   1.122  20.428 -11.230
  649   HE21  GLN  81          2HE2      GLN  81   2.011  19.525 -13.276
  650   HE22  GLN  81          1HE2      GLN  81   1.184  18.274 -14.074
  651    H    CYS  82           H        CYS  82   5.043  16.866 -10.486
  652    HA   CYS  82           HA       CYS  82   6.395  17.896  -8.240
  653    HB2  CYS  82           1HB      CYS  82   6.419  15.506  -9.002
  654    HB3  CYS  82           2HB      CYS  82   7.578  15.946 -10.251
  655    HG   CYS  82           HG       CYS  82   8.268  15.430  -7.382
  656    H    GLY  83           H        GLY  83   6.937  18.386 -11.663
  657    HA2  GLY  83           1HA      GLY  83   8.519  20.723 -11.250
  658    HA3  GLY  83           2HA      GLY  83   9.526  19.355 -11.735
  659    H    GLU  84           H        GLU  84   8.672  21.902 -13.105
  660    HA   GLU  84           HA       GLU  84   6.928  21.323 -15.270
  661    HB2  GLU  84           1HB      GLU  84   9.204  23.329 -15.082
  662    HB3  GLU  84           2HB      GLU  84   7.974  23.324 -16.346
  663    HG2  GLU  84           1HG      GLU  84   6.204  23.629 -14.635
  664    HG3  GLU  84           2HG      GLU  84   7.423  23.624 -13.364
  665    H    ARG  85           H        ARG  85   7.272  20.548 -17.301
  666    HA   ARG  85           HA       ARG  85   8.169  19.232 -18.947
  667    HB2  ARG  85           1HB      ARG  85  10.667  20.802 -18.229
  668    HB3  ARG  85           2HB      ARG  85  10.442  19.874 -19.714
  669    HG2  ARG  85           1HG      ARG  85   8.521  21.311 -20.338
  670    HG3  ARG  85           2HG      ARG  85   8.710  22.229 -18.843
  671    HD2  ARG  85           1HD      ARG  85   9.768  23.439 -20.699
  672    HD3  ARG  85           2HD      ARG  85  11.005  22.893 -19.564
  673    HE   ARG  85           HE       ARG  85  10.617  20.935 -21.594
  674   HH11  ARG  85          1HH2      ARG  85  11.932  24.110 -21.096
  675   HH12  ARG  85          2HH2      ARG  85  13.113  23.963 -22.357
  676   HH21  ARG  85          1HH1      ARG  85  12.158  20.745 -23.239
  677   HH22  ARG  85          2HH1      ARG  85  13.240  22.058 -23.569
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1 -19.397 -11.502 -10.030
    2    H2   MET   1           2H       MET   1 -20.048 -12.068 -11.494
    3    H3   MET   1           3H       MET   1 -18.867 -12.976 -10.680
    4    HA   MET   1           HA       MET   1 -21.705 -12.565  -9.966
    5    HB2  MET   1           1HB      MET   1 -19.878 -14.997 -10.186
    6    HB3  MET   1           2HB      MET   1 -21.581 -15.059  -9.727
    7    HG2  MET   1           1HG      MET   1 -22.211 -14.079 -11.917
    8    HG3  MET   1           2HG      MET   1 -20.508 -14.021 -12.380
    9    HE1  MET   1           3HE      MET   1 -21.673 -16.851 -14.654
   10    HE2  MET   1           1HE      MET   1 -20.627 -15.436 -14.483
   11    HE3  MET   1           2HE      MET   1 -22.370 -15.277 -14.279
   12    H    ASN   2           H        ASN   2 -18.609 -13.797  -8.677
   13    HA   ASN   2           HA       ASN   2 -19.468 -14.031  -5.976
   14    HB2  ASN   2           1HB      ASN   2 -16.656 -13.631  -7.079
   15    HB3  ASN   2           2HB      ASN   2 -17.057 -14.221  -5.463
   16   HD21  ASN   2          2HD2      ASN   2 -15.633 -15.601  -7.773
   17   HD22  ASN   2          1HD2      ASN   2 -16.508 -17.035  -8.017
   18    H    TYR   3           H        TYR   3 -18.692 -12.718  -4.171
   19    HA   TYR   3           HA       TYR   3 -17.884  -9.944  -4.680
   20    HB2  TYR   3           1HB      TYR   3 -19.845  -9.007  -3.449
   21    HB3  TYR   3           2HB      TYR   3 -20.310  -9.775  -4.967
   22    HD1  TYR   3           HD2      TYR   3 -20.372 -10.111  -1.260
   23    HD2  TYR   3           HD1      TYR   3 -21.555 -11.928  -4.991
   24    HE1  TYR   3           HE2      TYR   3 -21.889 -11.653  -0.044
   25    HE2  TYR   3           HE1      TYR   3 -23.059 -13.461  -3.754
   26    HH   TYR   3           HH       TYR   3 -23.334 -14.377  -1.545
   27    H    SER   4           H        SER   4 -17.277  -8.839  -2.774
   28    HA   SER   4           HA       SER   4 -16.123 -10.586  -0.737
   29    HB2  SER   4           1HB      SER   4 -15.004  -8.534   0.022
   30    HB3  SER   4           2HB      SER   4 -14.841  -8.704  -1.726
   31    HG   SER   4           HG       SER   4 -15.970  -6.950  -1.974
   32    H    THR   5           H        THR   5 -16.818  -7.649   0.664
   33    HA   THR   5           HA       THR   5 -18.061  -7.104   2.537
   34    HB   THR   5           HB       THR   5 -20.483  -7.214   2.226
   35    HG1  THR   5           HG1      THR   5 -21.311  -8.458   0.511
   36   HG21  THR   5          3HG2      THR   5 -19.087  -6.802  -0.449
   37   HG22  THR   5          1HG2      THR   5 -19.238  -5.582   0.817
   38   HG23  THR   5          2HG2      THR   5 -20.676  -6.184  -0.009
   39    H    GLY   6           H        GLY   6 -17.142  -8.443   4.103
   40    HA2  GLY   6           1HA      GLY   6 -17.256  -9.949   5.854
   41    HA3  GLY   6           2HA      GLY   6 -18.860 -10.425   5.307
   42    H    THR   7           H        THR   7 -18.352 -11.373   2.771
   43    HA   THR   7           HA       THR   7 -17.368 -13.991   3.269
   44    HB   THR   7           HB       THR   7 -17.787 -12.658   0.556
   45    HG1  THR   7           HG1      THR   7 -19.616 -14.169   2.096
   46   HG21  THR   7          3HG2      THR   7 -17.875 -15.579   1.429
   47   HG22  THR   7          1HG2      THR   7 -16.621 -14.849   0.425
   48   HG23  THR   7          2HG2      THR   7 -18.268 -14.983  -0.181
   49    H    ASP   8           H        ASP   8 -15.380 -14.844   3.094
   50    HA   ASP   8           HA       ASP   8 -13.089 -14.986   2.903
   51    HB2  ASP   8           1HB      ASP   8 -13.671 -13.426   0.358
   52    HB3  ASP   8           2HB      ASP   8 -12.182 -14.302   0.694
   53    H    ALA   9           H        ALA   9 -12.287 -13.810   4.606
   54    HA   ALA   9           HA       ALA   9 -11.227 -12.138   5.747
   55    HB1  ALA   9           3HB      ALA   9  -9.738 -10.667   4.484
   56    HB2  ALA   9           1HB      ALA   9 -10.588 -11.028   2.983
   57    HB3  ALA   9           2HB      ALA   9  -9.673 -12.290   3.800
   58    H    ASN  10           H        ASN  10 -12.412 -10.733   6.898
   59    HA   ASN  10           HA       ASN  10 -14.629  -9.257   5.922
   60    HB2  ASN  10           1HB      ASN  10 -12.967  -8.760   8.425
   61    HB3  ASN  10           2HB      ASN  10 -14.590  -8.133   8.123
   62   HD21  ASN  10          2HD2      ASN  10 -13.167 -10.446   9.923
   63   HD22  ASN  10          1HD2      ASN  10 -14.350 -11.661   9.861
   64    H    THR  11           H        THR  11 -11.243  -8.363   6.450
   65    HA   THR  11           HA       THR  11 -11.497  -5.577   5.960
   66    HB   THR  11           HB       THR  11  -9.046  -5.647   5.596
   67    HG1  THR  11           HG1      THR  11  -8.040  -7.687   5.599
   68   HG21  THR  11          3HG2      THR  11  -8.413  -6.694   7.758
   69   HG22  THR  11          1HG2      THR  11  -9.981  -7.493   7.835
   70   HG23  THR  11          2HG2      THR  11  -9.882  -5.733   7.924
   71    H    LEU  12           H        LEU  12 -10.838  -4.401   4.083
   72    HA   LEU  12           HA       LEU  12 -11.824  -5.593   1.572
   73    HB2  LEU  12           1HB      LEU  12 -11.082  -2.785   2.470
   74    HB3  LEU  12           2HB      LEU  12 -11.324  -3.133   0.757
   75    HG   LEU  12           HG       LEU  12 -13.627  -3.928   1.226
   76   HD11  LEU  12          1HD1      LEU  12 -14.589  -3.452   3.559
   77   HD12  LEU  12          2HD1      LEU  12 -12.925  -3.283   4.119
   78   HD13  LEU  12          3HD1      LEU  12 -13.486  -4.818   3.454
   79   HD21  LEU  12          3HD2      LEU  12 -13.261  -1.527   0.710
   80   HD22  LEU  12          1HD2      LEU  12 -13.052  -1.186   2.430
   81   HD23  LEU  12          2HD2      LEU  12 -14.615  -1.731   1.821
   82    H    PHE  13           H        PHE  13  -8.892  -5.535   3.111
   83    HA   PHE  13           HA       PHE  13  -7.312  -5.569   0.556
   84    HB2  PHE  13           1HB      PHE  13  -6.448  -4.931   3.411
   85    HB3  PHE  13           2HB      PHE  13  -5.356  -5.037   2.027
   86    HD1  PHE  13           HD2      PHE  13  -5.439  -3.351   0.191
   87    HD2  PHE  13           HD1      PHE  13  -8.025  -3.012   3.627
   88    HE1  PHE  13           HE2      PHE  13  -5.998  -1.019  -0.447
   89    HE2  PHE  13           HE1      PHE  13  -8.577  -0.685   2.973
   90    HZ   PHE  13           HZ       PHE  13  -7.568   0.311   0.937
   91    H    VAL  14           H        VAL  14  -6.230  -7.348   0.052
   92    HA   VAL  14           HA       VAL  14  -5.954  -9.581   2.013
   93    HB   VAL  14           HB       VAL  14  -6.503 -11.169   0.177
   94   HG11  VAL  14          1HG1      VAL  14  -8.677  -9.094   0.737
   95   HG12  VAL  14          2HG1      VAL  14  -8.268 -10.461   1.778
   96   HG13  VAL  14          3HG1      VAL  14  -8.958 -10.746   0.182
   97   HG21  VAL  14          3HG2      VAL  14  -5.963  -9.791  -1.780
   98   HG22  VAL  14          1HG2      VAL  14  -7.232  -8.637  -1.371
   99   HG23  VAL  14          2HG2      VAL  14  -7.648 -10.276  -1.874
  100    H    ASP  15           H        ASP  15  -4.235 -10.991   1.647
  101    HA   ASP  15           HA       ASP  15  -1.819  -9.787   0.859
  102    HB2  ASP  15           1HB      ASP  15  -0.850 -12.035   1.277
  103    HB3  ASP  15           2HB      ASP  15  -1.960 -11.547   2.558
  104    H    GLY  16           H        GLY  16  -0.476 -10.135  -0.891
  105    HA2  GLY  16           1HA      GLY  16   0.217 -10.921  -2.975
  106    HA3  GLY  16           2HA      GLY  16  -1.295 -11.801  -3.167
  107    H    GLU  17           H        GLU  17  -2.514  -9.056  -2.213
  108    HA   GLU  17           HA       GLU  17  -3.094  -8.071  -4.876
  109    HB2  GLU  17           1HB      GLU  17  -4.789  -8.107  -3.056
  110    HB3  GLU  17           2HB      GLU  17  -3.860  -6.913  -2.165
  111    HG2  GLU  17           1HG      GLU  17  -5.690  -5.803  -3.364
  112    HG3  GLU  17           2HG      GLU  17  -4.169  -5.301  -4.078
  113    H    ARG  18           H        ARG  18  -2.469  -6.168  -5.799
  114    HA   ARG  18           HA       ARG  18   0.014  -4.936  -4.824
  115    HB2  ARG  18           1HB      ARG  18  -0.318  -5.559  -7.228
  116    HB3  ARG  18           2HB      ARG  18  -1.606  -4.364  -7.349
  117    HG2  ARG  18           1HG      ARG  18   0.016  -2.564  -6.747
  118    HG3  ARG  18           2HG      ARG  18   1.295  -3.767  -6.614
  119    HD2  ARG  18           1HD      ARG  18   0.887  -4.369  -9.044
  120    HD3  ARG  18           2HD      ARG  18  -0.235  -3.009  -9.130
  121    HE   ARG  18           HE       ARG  18   1.583  -1.551  -9.144
  122   HH11  ARG  18          1HH2      ARG  18   2.603  -4.726  -8.140
  123   HH12  ARG  18          2HH2      ARG  18   4.287  -4.325  -8.133
  124   HH21  ARG  18          1HH1      ARG  18   3.788  -1.049  -9.129
  125   HH22  ARG  18          2HH1      ARG  18   4.955  -2.248  -8.690
  126    H    VAL  19           H        VAL  19   0.100  -2.977  -3.848
  127    HA   VAL  19           HA       VAL  19  -2.228  -1.121  -3.919
  128    HB   VAL  19           HB       VAL  19  -2.042  -0.753  -1.466
  129   HG11  VAL  19          1HG1      VAL  19  -3.110  -2.866  -0.748
  130   HG12  VAL  19          2HG1      VAL  19  -2.531  -3.670  -2.203
  131   HG13  VAL  19          3HG1      VAL  19  -3.713  -2.370  -2.330
  132   HG21  VAL  19          3HG2      VAL  19   0.299  -1.429  -1.097
  133   HG22  VAL  19          1HG2      VAL  19  -0.080  -3.081  -1.564
  134   HG23  VAL  19          2HG2      VAL  19  -0.755  -2.405  -0.086
  135    H    LEU  20           H        LEU  20  -1.681   0.985  -2.999
  136    HA   LEU  20           HA       LEU  20   1.119   1.775  -3.684
  137    HB2  LEU  20           1HB      LEU  20  -1.410   3.455  -3.837
  138    HB3  LEU  20           2HB      LEU  20   0.197   3.891  -4.408
  139    HG   LEU  20           HG       LEU  20  -1.523   1.644  -5.535
  140   HD11  LEU  20          1HD1      LEU  20  -1.757   3.089  -7.510
  141   HD12  LEU  20          2HD1      LEU  20  -0.769   4.335  -6.743
  142   HD13  LEU  20          3HD1      LEU  20  -2.347   3.925  -6.076
  143   HD21  LEU  20          3HD2      LEU  20   0.265   1.720  -7.416
  144   HD22  LEU  20          1HD2      LEU  20   0.755   0.972  -5.903
  145   HD23  LEU  20          2HD2      LEU  20   1.269   2.618  -6.280
  146    H    CYS  21           H        CYS  21   2.167   3.183  -2.378
  147    HA   CYS  21           HA       CYS  21   0.941   3.842   0.285
  148    HB2  CYS  21           1HB      CYS  21   2.625   2.018   0.443
  149    HB3  CYS  21           2HB      CYS  21   3.835   3.083  -0.272
  150    HG   CYS  21           HG       CYS  21   2.419   3.776   2.435
  151    H    PHE  22           H        PHE  22   0.862   5.953   0.670
  152    HA   PHE  22           HA       PHE  22   1.719   7.947  -1.063
  153    HB2  PHE  22           1HB      PHE  22   1.369   8.225   1.907
  154    HB3  PHE  22           2HB      PHE  22   1.313   9.537   0.732
  155    HD1  PHE  22           HD2      PHE  22  -0.564   9.663  -0.952
  156    HD2  PHE  22           HD1      PHE  22  -0.566   6.699   2.183
  157    HE1  PHE  22           HE2      PHE  22  -2.965   9.215  -1.366
  158    HE2  PHE  22           HE1      PHE  22  -2.968   6.259   1.752
  159    HZ   PHE  22           HZ       PHE  22  -4.168   7.515  -0.020
  160    H    HIS  23           H        HIS  23   3.181   7.191   2.089
  161    HA   HIS  23           HA       HIS  23   5.250   7.675   2.980
  162    HB2  HIS  23           1HB      HIS  23   5.680   5.631   1.635
  163    HB3  HIS  23           2HB      HIS  23   6.085   6.631   0.248
  164    HD1  HIS  23           HD1      HIS  23   7.311   5.875   3.760
  165    HD2  HIS  23           HD2      HIS  23   8.714   7.553   0.213
  166    HE1  HIS  23           HE1      HIS  23   9.786   6.293   4.096
  167    HE2  HIS  23           HE2      HIS  23  10.656   7.318   1.942
  168    H    GLY  24           H        GLY  24   4.492  10.023   2.675
  169    HA2  GLY  24           1HA      GLY  24   5.660  12.117   2.603
  170    HA3  GLY  24           2HA      GLY  24   6.560  11.566   1.201
  171    HA   PRO  25           HA       PRO  25   2.855  14.196  -0.107
  172    HB2  PRO  25           1HB      PRO  25   4.189  16.047  -1.664
  173    HB3  PRO  25           2HB      PRO  25   4.019  16.221   0.099
  174    HG2  PRO  25           1HG      PRO  25   6.358  15.118  -1.465
  175    HG3  PRO  25           2HG      PRO  25   6.369  16.297  -0.132
  176    HD2  PRO  25           1HD      PRO  25   6.937  13.677   0.321
  177    HD3  PRO  25           2HD      PRO  25   6.041  14.622   1.529
  178    H    LEU  26           H        LEU  26   4.545  11.828  -1.369
  179    HA   LEU  26           HA       LEU  26   3.337  12.018  -4.110
  180    HB2  LEU  26           1HB      LEU  26   6.105  11.147  -3.243
  181    HB3  LEU  26           2HB      LEU  26   5.451  10.581  -4.769
  182    HG   LEU  26           HG       LEU  26   5.467  13.582  -4.178
  183   HD11  LEU  26          1HD1      LEU  26   7.808  12.008  -5.319
  184   HD12  LEU  26          2HD1      LEU  26   7.788  12.863  -3.777
  185   HD13  LEU  26          3HD1      LEU  26   7.681  13.769  -5.284
  186   HD21  LEU  26          3HD2      LEU  26   4.236  12.644  -6.196
  187   HD22  LEU  26          1HD2      LEU  26   5.767  12.022  -6.793
  188   HD23  LEU  26          2HD2      LEU  26   5.520  13.759  -6.625
  189    H    ILE  27           H        ILE  27   3.670   9.694  -5.116
  190    HA   ILE  27           HA       ILE  27   2.528   7.667  -3.216
  191    HB   ILE  27           HB       ILE  27   1.656   8.172  -6.093
  192   HG12  ILE  27          1HG1      ILE  27   0.072   8.622  -3.509
  193   HG13  ILE  27          2HG1      ILE  27   0.884   9.921  -4.373
  194   HG21  ILE  27          1HG2      ILE  27  -0.119   6.483  -5.570
  195   HG22  ILE  27          2HG2      ILE  27   0.610   6.240  -3.987
  196   HG23  ILE  27          3HG2      ILE  27   1.484   5.778  -5.446
  197   HD11  ILE  27          3HD1      ILE  27  -0.480   9.500  -6.372
  198   HD12  ILE  27          1HD1      ILE  27  -1.508   9.804  -4.975
  199   HD13  ILE  27          2HD1      ILE  27  -1.288   8.160  -5.560
  200    H    TYR  28           H        TYR  28   3.487   5.772  -3.237
  201    HA   TYR  28           HA       TYR  28   5.390   5.021  -5.433
  202    HB2  TYR  28           1HB      TYR  28   5.662   4.465  -2.446
  203    HB3  TYR  28           2HB      TYR  28   6.824   4.041  -3.710
  204    HD1  TYR  28           HD1      TYR  28   5.132   6.896  -1.979
  205    HD2  TYR  28           HD2      TYR  28   8.378   5.746  -4.588
  206    HE1  TYR  28           HE1      TYR  28   6.120   9.164  -1.788
  207    HE2  TYR  28           HE2      TYR  28   9.334   8.022  -4.393
  208    HH   TYR  28           HH       TYR  28   8.210  10.444  -3.822
  209    H    GLU  29           H        GLU  29   5.692   2.772  -5.734
  210    HA   GLU  29           HA       GLU  29   3.213   1.231  -5.487
  211    HB2  GLU  29           1HB      GLU  29   5.886   0.678  -6.829
  212    HB3  GLU  29           2HB      GLU  29   4.531  -0.453  -6.869
  213    HG2  GLU  29           1HG      GLU  29   3.112   1.229  -7.967
  214    HG3  GLU  29           2HG      GLU  29   4.406   2.420  -7.865
  215    H    ALA  30           H        ALA  30   2.856  -0.447  -4.200
  216    HA   ALA  30           HA       ALA  30   5.003  -1.818  -2.724
  217    HB1  ALA  30           3HB      ALA  30   4.365   0.090  -1.263
  218    HB2  ALA  30           1HB      ALA  30   3.887  -1.452  -0.551
  219    HB3  ALA  30           2HB      ALA  30   2.680  -0.422  -1.327
  220    H    LYS  31           H        LYS  31   3.938  -3.605  -1.371
  221    HA   LYS  31           HA       LYS  31   1.452  -4.675  -2.608
  222    HB2  LYS  31           1HB      LYS  31   3.444  -5.548  -3.884
  223    HB3  LYS  31           2HB      LYS  31   4.017  -6.303  -2.398
  224    HG2  LYS  31           1HG      LYS  31   1.991  -7.700  -2.283
  225    HG3  LYS  31           2HG      LYS  31   1.291  -6.867  -3.668
  226    HD2  LYS  31           1HD      LYS  31   2.210  -9.030  -4.376
  227    HD3  LYS  31           2HD      LYS  31   3.123  -7.717  -5.115
  228    HE2  LYS  31           1HE      LYS  31   4.141  -8.898  -2.506
  229    HE3  LYS  31           2HE      LYS  31   4.434  -9.759  -4.015
  230    HZ1  LYS  31           3HZ      LYS  31   6.202  -8.415  -4.113
  231    HZ2  LYS  31           1HZ      LYS  31   5.531  -7.243  -3.088
  232    HZ3  LYS  31           2HZ      LYS  31   5.095  -7.283  -4.729
  233    H    VAL  32           H        VAL  32   0.406  -6.277  -1.390
  234    HA   VAL  32           HA       VAL  32   0.919  -6.109   1.528
  235    HB   VAL  32           HB       VAL  32  -1.507  -7.332   0.107
  236   HG11  VAL  32          1HG1      VAL  32  -1.201  -8.010   2.479
  237   HG12  VAL  32          2HG1      VAL  32  -2.608  -6.966   2.305
  238   HG13  VAL  32          3HG1      VAL  32  -1.100  -6.315   2.958
  239   HG21  VAL  32          3HG2      VAL  32  -2.656  -5.183   0.542
  240   HG22  VAL  32          1HG2      VAL  32  -1.272  -4.939  -0.510
  241   HG23  VAL  32          2HG2      VAL  32  -1.166  -4.499   1.189
  242    H    LEU  33           H        LEU  33   2.348  -7.633   2.176
  243    HA   LEU  33           HA       LEU  33   2.520 -10.247   0.895
  244    HB2  LEU  33           1HB      LEU  33   4.391  -8.732   2.211
  245    HB3  LEU  33           2HB      LEU  33   3.955  -9.805   3.520
  246    HG   LEU  33           HG       LEU  33   4.930 -10.681   0.764
  247   HD11  LEU  33          1HD1      LEU  33   6.716  -9.696   2.138
  248   HD12  LEU  33          2HD1      LEU  33   6.948 -11.435   1.979
  249   HD13  LEU  33          3HD1      LEU  33   6.297 -10.766   3.478
  250   HD21  LEU  33          3HD2      LEU  33   4.017 -12.275   3.201
  251   HD22  LEU  33          1HD2      LEU  33   5.075 -12.972   1.972
  252   HD23  LEU  33          2HD2      LEU  33   3.474 -12.421   1.529
  253    H    LYS  34           H        LYS  34   1.363  -8.962   3.969
  254    HA   LYS  34           HA       LYS  34  -0.322 -11.338   4.368
  255    HB2  LYS  34           1HB      LYS  34   1.846 -11.927   5.428
  256    HB3  LYS  34           2HB      LYS  34   1.744 -10.495   6.421
  257    HG2  LYS  34           1HG      LYS  34  -0.275 -11.333   7.538
  258    HG3  LYS  34           2HG      LYS  34  -0.341 -12.705   6.443
  259    HD2  LYS  34           1HD      LYS  34   0.585 -13.447   8.569
  260    HD3  LYS  34           2HD      LYS  34   1.866 -13.495   7.362
  261    HE2  LYS  34           1HE      LYS  34   2.525 -12.491   9.636
  262    HE3  LYS  34           2HE      LYS  34   2.900 -11.485   8.248
  263    HZ1  LYS  34           3HZ      LYS  34   1.619 -10.578  10.363
  264    HZ2  LYS  34           1HZ      LYS  34   0.276 -11.114   9.478
  265    HZ3  LYS  34           2HZ      LYS  34   1.332  -9.965   8.805
  266    H    THR  35           H        THR  35  -1.914 -11.047   5.978
  267    HA   THR  35           HA       THR  35  -2.382  -8.291   6.987
  268    HB   THR  35           HB       THR  35  -3.543  -8.247   4.858
  269    HG1  THR  35           HG1      THR  35  -4.695  -7.882   7.084
  270   HG21  THR  35          3HG2      THR  35  -3.638 -10.633   4.336
  271   HG22  THR  35          1HG2      THR  35  -5.265  -9.967   4.310
  272   HG23  THR  35          2HG2      THR  35  -4.741 -10.924   5.679
  273    H    LYS  36           H        LYS  36  -3.654  -8.181   8.778
  274    HA   LYS  36           HA       LYS  36  -4.393 -10.811  10.045
  275    HB2  LYS  36           1HB      LYS  36  -2.573  -9.565  11.178
  276    HB3  LYS  36           2HB      LYS  36  -3.681  -8.242  11.453
  277    HG2  LYS  36           1HG      LYS  36  -5.165  -9.720  12.778
  278    HG3  LYS  36           2HG      LYS  36  -4.090 -11.080  12.454
  279    HD2  LYS  36           1HD      LYS  36  -2.251  -9.910  13.655
  280    HD3  LYS  36           2HD      LYS  36  -3.339  -8.564  13.997
  281    HE2  LYS  36           1HE      LYS  36  -3.194 -10.123  15.935
  282    HE3  LYS  36           2HE      LYS  36  -4.829 -10.078  15.276
  283    HZ1  LYS  36           3HZ      LYS  36  -4.509 -12.120  14.189
  284    HZ2  LYS  36           1HZ      LYS  36  -3.881 -12.348  15.750
  285    HZ3  LYS  36           2HZ      LYS  36  -2.829 -12.099  14.439
  286    HA   PRO  37           HA       PRO  37  -8.380  -8.436   9.552
  287    HB2  PRO  37           1HB      PRO  37  -9.924 -10.270   8.343
  288    HB3  PRO  37           2HB      PRO  37  -8.593  -9.510   7.429
  289    HG2  PRO  37           1HG      PRO  37  -8.567 -12.167   8.883
  290    HG3  PRO  37           2HG      PRO  37  -8.138 -11.836   7.183
  291    HD2  PRO  37           1HD      PRO  37  -6.225 -11.951   9.147
  292    HD3  PRO  37           2HD      PRO  37  -6.053 -10.840   7.770
  293    H    ASP  38           H        ASP  38  -7.260 -10.651  11.631
  294    HA   ASP  38           HA       ASP  38  -9.614 -11.807  12.774
  295    HB2  ASP  38           1HB      ASP  38  -7.318 -12.726  13.086
  296    HB3  ASP  38           2HB      ASP  38  -6.900 -11.325  14.066
  297    H    ALA  39           H        ALA  39  -8.874  -8.639  12.569
  298    HA   ALA  39           HA       ALA  39 -10.646  -7.894  14.748
  299    HB1  ALA  39           3HB      ALA  39  -8.494  -8.163  15.951
  300    HB2  ALA  39           1HB      ALA  39  -9.027  -6.477  15.940
  301    HB3  ALA  39           2HB      ALA  39  -7.740  -7.009  14.853
  302    H    THR  40           H        THR  40 -11.167  -5.645  14.757
  303    HA   THR  40           HA       THR  40 -10.406  -4.078  12.361
  304    HB   THR  40           HB       THR  40 -12.730  -3.576  11.813
  305    HG1  THR  40           HG1      THR  40 -13.235  -5.333  13.980
  306   HG21  THR  40          3HG2      THR  40 -11.590  -5.658  10.847
  307   HG22  THR  40          1HG2      THR  40 -13.353  -5.735  10.882
  308   HG23  THR  40          2HG2      THR  40 -12.414  -6.591  12.098
  309    HA   PRO  41           HA       PRO  41  -9.667  -2.013  11.958
  310    HB2  PRO  41           1HB      PRO  41  -7.864  -0.185  12.850
  311    HB3  PRO  41           2HB      PRO  41  -9.540   0.277  12.458
  312    HG2  PRO  41           1HG      PRO  41  -8.360  -0.373  15.165
  313    HG3  PRO  41           2HG      PRO  41  -9.350   1.030  14.694
  314    HD2  PRO  41           1HD      PRO  41 -10.484  -1.141  15.916
  315    HD3  PRO  41           2HD      PRO  41 -11.368  -0.241  14.661
  316    H    VAL  42           H        VAL  42  -7.156  -2.111  11.690
  317    HA   VAL  42           HA       VAL  42  -5.639  -3.553  13.679
  318    HB   VAL  42           HB       VAL  42  -7.236  -5.328  12.909
  319   HG11  VAL  42          1HG1      VAL  42  -7.238  -6.160  10.640
  320   HG12  VAL  42          2HG1      VAL  42  -5.828  -5.200  10.206
  321   HG13  VAL  42          3HG1      VAL  42  -7.376  -4.411  10.506
  322   HG21  VAL  42          3HG2      VAL  42  -5.614  -7.070  12.849
  323   HG22  VAL  42          1HG2      VAL  42  -4.722  -5.775  13.623
  324   HG23  VAL  42          2HG2      VAL  42  -4.476  -6.113  11.920
  325    H    GLU  43           H        GLU  43  -3.601  -4.562  12.561
  326    HA   GLU  43           HA       GLU  43  -2.450  -2.504  10.789
  327    HB2  GLU  43           1HB      GLU  43  -0.286  -3.528  11.499
  328    HB3  GLU  43           2HB      GLU  43  -1.231  -2.937  12.866
  329    HG2  GLU  43           1HG      GLU  43  -2.029  -5.240  13.321
  330    HG3  GLU  43           2HG      GLU  43  -1.090  -5.846  11.961
  331    H    TYR  44           H        TYR  44  -1.021  -3.245   9.096
  332    HA   TYR  44           HA       TYR  44  -1.663  -5.891   7.875
  333    HB2  TYR  44           1HB      TYR  44  -1.737  -3.179   6.488
  334    HB3  TYR  44           2HB      TYR  44  -1.900  -4.738   5.679
  335    HD1  TYR  44           HD2      TYR  44  -3.508  -2.433   8.161
  336    HD2  TYR  44           HD1      TYR  44  -4.005  -6.022   5.823
  337    HE1  TYR  44           HE2      TYR  44  -5.916  -2.509   8.754
  338    HE2  TYR  44           HE1      TYR  44  -6.403  -6.077   6.428
  339    HH   TYR  44           HH       TYR  44  -8.136  -4.656   7.207
  340    H    TYR  45           H        TYR  45  -0.087  -6.778   6.664
  341    HA   TYR  45           HA       TYR  45   2.629  -5.784   7.195
  342    HB2  TYR  45           1HB      TYR  45   1.848  -8.235   7.369
  343    HB3  TYR  45           2HB      TYR  45   1.937  -8.276   5.619
  344    HD1  TYR  45           HD2      TYR  45   4.145  -7.580   4.455
  345    HD2  TYR  45           HD1      TYR  45   3.914  -8.457   8.673
  346    HE1  TYR  45           HE2      TYR  45   6.591  -7.905   4.528
  347    HE2  TYR  45           HE1      TYR  45   6.367  -8.780   8.720
  348    HH   TYR  45           HH       TYR  45   8.228  -8.916   7.508
  349    H    ILE  46           H        ILE  46   3.116  -4.109   5.910
  350    HA   ILE  46           HA       ILE  46   2.825  -4.367   2.942
  351    HB   ILE  46           HB       ILE  46   3.194  -1.821   4.599
  352   HG12  ILE  46          1HG1      ILE  46   1.011  -2.774   5.173
  353   HG13  ILE  46          2HG1      ILE  46   0.767  -1.401   4.110
  354   HG21  ILE  46          1HG2      ILE  46   3.960  -1.585   2.263
  355   HG22  ILE  46          2HG2      ILE  46   2.452  -0.706   2.479
  356   HG23  ILE  46          3HG2      ILE  46   2.446  -2.274   1.671
  357   HD11  ILE  46          3HD1      ILE  46   0.426  -4.339   3.504
  358   HD12  ILE  46          1HD1      ILE  46   0.675  -3.194   2.184
  359   HD13  ILE  46          2HD1      ILE  46  -0.709  -3.022   3.251
  360    H    HIS  47           H        HIS  47   4.562  -4.130   1.683
  361    HA   HIS  47           HA       HIS  47   7.192  -3.334   2.789
  362    HB2  HIS  47           1HB      HIS  47   8.305  -5.326   1.847
  363    HB3  HIS  47           2HB      HIS  47   7.105  -5.803   3.048
  364    HD1  HIS  47           HD1      HIS  47   8.187  -6.721  -0.203
  365    HD2  HIS  47           HD2      HIS  47   4.456  -6.319   1.590
  366    HE1  HIS  47           HE1      HIS  47   6.559  -7.995  -1.661
  367    HE2  HIS  47           HE2      HIS  47   4.262  -7.721  -0.608
  368    H    TYR  48           H        TYR  48   8.534  -2.425   1.283
  369    HA   TYR  48           HA       TYR  48   7.318  -1.385  -1.123
  370    HB2  TYR  48           1HB      TYR  48  10.168  -1.242  -0.066
  371    HB3  TYR  48           2HB      TYR  48   9.574  -0.332  -1.457
  372    HD1  TYR  48           HD1      TYR  48   7.894   1.492  -1.176
  373    HD2  TYR  48           HD2      TYR  48   9.406  -0.661   2.244
  374    HE1  TYR  48           HE1      TYR  48   6.927   3.199   0.338
  375    HE2  TYR  48           HE2      TYR  48   8.437   1.063   3.743
  376    HH   TYR  48           HH       TYR  48   7.162   4.045   2.542
  377    H    ALA  49           H        ALA  49   7.430  -2.145  -3.137
  378    HA   ALA  49           HA       ALA  49   8.369  -4.774  -3.710
  379    HB1  ALA  49           3HB      ALA  49   7.567  -2.538  -5.609
  380    HB2  ALA  49           1HB      ALA  49   6.473  -3.719  -4.889
  381    HB3  ALA  49           2HB      ALA  49   7.710  -4.247  -6.034
  382    H    GLY  50           H        GLY  50  10.173  -5.477  -4.809
  383    HA2  GLY  50           1HA      GLY  50  12.224  -5.435  -5.877
  384    HA3  GLY  50           2HA      GLY  50  12.112  -3.684  -6.026
  385    H    TRP  51           H        TRP  51  11.634  -5.150  -2.916
  386    HA   TRP  51           HA       TRP  51  14.436  -4.707  -2.054
  387    HB2  TRP  51           1HB      TRP  51  12.038  -3.344  -0.759
  388    HB3  TRP  51           2HB      TRP  51  13.688  -3.317  -0.136
  389    HD1  TRP  51           HD1      TRP  51  11.459  -1.512  -2.526
  390    HE1  TRP  51           HE1      TRP  51  12.810   0.239  -3.848
  391    HE3  TRP  51           HE3      TRP  51  16.199  -2.941  -1.284
  392    HZ2  TRP  51           HZ2      TRP  51  15.539   0.937  -4.324
  393    HZ3  TRP  51           HZ3      TRP  51  18.159  -1.720  -2.185
  394    HH2  TRP  51           HH2      TRP  51  17.836   0.218  -3.704
  395    H    SER  52           H        SER  52  14.803  -5.442   0.155
  396    HA   SER  52           HA       SER  52  13.821  -8.102   0.512
  397    HB2  SER  52           1HB      SER  52  15.217  -8.120   2.520
  398    HB3  SER  52           2HB      SER  52  16.092  -7.326   1.208
  399    HG   SER  52           HG       SER  52  16.056  -5.538   2.309
  400    H    LYS  53           H        LYS  53  12.582  -8.931   2.222
  401    HA   LYS  53           HA       LYS  53  10.397  -7.224   3.128
  402    HB2  LYS  53           1HB      LYS  53   9.387  -9.329   3.930
  403    HB3  LYS  53           2HB      LYS  53   9.878  -9.441   2.235
  404    HG2  LYS  53           1HG      LYS  53  11.961 -10.613   2.919
  405    HG3  LYS  53           2HG      LYS  53  11.452 -10.532   4.608
  406    HD2  LYS  53           1HD      LYS  53   9.429 -11.868   4.077
  407    HD3  LYS  53           2HD      LYS  53   9.914 -11.939   2.381
  408    HE2  LYS  53           1HE      LYS  53  10.554 -14.015   3.584
  409    HE3  LYS  53           2HE      LYS  53  11.982 -13.147   3.016
  410    HZ1  LYS  53           3HZ      LYS  53  12.275 -12.204   5.189
  411    HZ2  LYS  53           1HZ      LYS  53  12.181 -13.891   5.331
  412    HZ3  LYS  53           2HZ      LYS  53  10.844 -12.929   5.752
  413    H    ASN  54           H        ASN  54  13.417  -7.780   4.324
  414    HA   ASN  54           HA       ASN  54  12.957  -8.301   7.086
  415    HB2  ASN  54           1HB      ASN  54  15.280  -6.825   5.779
  416    HB3  ASN  54           2HB      ASN  54  15.277  -7.536   7.397
  417   HD21  ASN  54          2HD2      ASN  54  16.850  -8.212   4.816
  418   HD22  ASN  54          1HD2      ASN  54  16.615  -9.883   4.635
  419    H    TRP  55           H        TRP  55  12.426  -5.538   5.161
  420    HA   TRP  55           HA       TRP  55  12.812  -3.452   7.069
  421    HB2  TRP  55           1HB      TRP  55  11.082  -3.697   4.574
  422    HB3  TRP  55           2HB      TRP  55  11.190  -2.201   5.500
  423    HD1  TRP  55           HD1      TRP  55  13.739  -4.716   3.985
  424    HE1  TRP  55           HE1      TRP  55  15.654  -3.363   2.923
  425    HE3  TRP  55           HE3      TRP  55  12.178   0.023   5.077
  426    HZ2  TRP  55           HZ2      TRP  55  16.424  -0.632   2.579
  427    HZ3  TRP  55           HZ3      TRP  55  13.522   1.983   4.372
  428    HH2  TRP  55           HH2      TRP  55  15.643   1.662   3.125
  429    H    ASP  56           H        ASP  56  10.164  -5.632   6.364
  430    HA   ASP  56           HA       ASP  56   8.029  -5.846   7.231
  431    HB2  ASP  56           1HB      ASP  56   9.632  -7.033   8.741
  432    HB3  ASP  56           2HB      ASP  56   9.657  -5.621   9.790
  433    H    GLU  57           H        GLU  57   7.363  -3.629   6.479
  434    HA   GLU  57           HA       GLU  57   7.113  -1.588   8.619
  435    HB2  GLU  57           1HB      GLU  57   7.886  -0.957   6.314
  436    HB3  GLU  57           2HB      GLU  57   6.304  -1.410   5.681
  437    HG2  GLU  57           1HG      GLU  57   5.236   0.283   7.143
  438    HG3  GLU  57           2HG      GLU  57   6.801   0.718   7.816
  439    H    TRP  58           H        TRP  58   5.520  -2.328   9.970
  440    HA   TRP  58           HA       TRP  58   2.920  -3.246   8.969
  441    HB2  TRP  58           1HB      TRP  58   4.282  -3.080  11.664
  442    HB3  TRP  58           2HB      TRP  58   2.528  -2.991  11.689
  443    HD1  TRP  58           HD1      TRP  58   1.409  -5.053   9.961
  444    HE1  TRP  58           HE1      TRP  58   1.958  -7.566  10.115
  445    HE3  TRP  58           HE3      TRP  58   5.888  -4.837  12.417
  446    HZ2  TRP  58           HZ2      TRP  58   4.005  -9.266  11.132
  447    HZ3  TRP  58           HZ3      TRP  58   7.114  -6.924  12.973
  448    HH2  TRP  58           HH2      TRP  58   6.180  -9.135  12.337
  449    H    VAL  59           H        VAL  59   1.239  -1.936   8.603
  450    HA   VAL  59           HA       VAL  59   1.031   0.661   9.994
  451    HB   VAL  59           HB       VAL  59   0.476   1.680   7.587
  452   HG11  VAL  59          1HG1      VAL  59   2.367   2.467   8.959
  453   HG12  VAL  59          2HG1      VAL  59   2.846   2.343   7.267
  454   HG13  VAL  59          3HG1      VAL  59   3.337   1.103   8.415
  455   HG21  VAL  59          3HG2      VAL  59   1.712   0.672   5.739
  456   HG22  VAL  59          1HG2      VAL  59   0.631  -0.542   6.423
  457   HG23  VAL  59          2HG2      VAL  59   2.358  -0.585   6.793
  458    HA   PRO  60           HA       PRO  60  -3.312  -0.314   9.933
  459    HB2  PRO  60           1HB      PRO  60  -4.476   2.124  10.288
  460    HB3  PRO  60           2HB      PRO  60  -3.432   1.425  11.552
  461    HG2  PRO  60           1HG      PRO  60  -2.635   3.365   9.359
  462    HG3  PRO  60           2HG      PRO  60  -2.430   3.558  11.121
  463    HD2  PRO  60           1HD      PRO  60  -0.383   2.630   9.646
  464    HD3  PRO  60           2HD      PRO  60  -0.727   1.875  11.222
  465    H    GLU  61           H        GLU  61  -5.246  -0.141   8.667
  466    HA   GLU  61           HA       GLU  61  -4.971  -0.129   5.901
  467    HB2  GLU  61           1HB      GLU  61  -7.490   0.056   5.850
  468    HB3  GLU  61           2HB      GLU  61  -6.902  -1.170   6.965
  469    HG2  GLU  61           1HG      GLU  61  -7.150   0.429   8.860
  470    HG3  GLU  61           2HG      GLU  61  -7.759   1.649   7.746
  471    H    ASN  62           H        ASN  62  -5.229   2.556   8.019
  472    HA   ASN  62           HA       ASN  62  -6.376   4.502   6.312
  473    HB2  ASN  62           1HB      ASN  62  -4.366   4.900   8.554
  474    HB3  ASN  62           2HB      ASN  62  -5.394   6.146   7.862
  475   HD21  ASN  62          2HD2      ASN  62  -5.286   4.808  10.665
  476   HD22  ASN  62          1HD2      ASN  62  -6.902   4.371  10.953
  477    H    ARG  63           H        ARG  63  -2.976   3.528   6.775
  478    HA   ARG  63           HA       ARG  63  -2.019   5.502   4.836
  479    HB2  ARG  63           1HB      ARG  63  -0.808   4.569   7.029
  480    HB3  ARG  63           2HB      ARG  63  -0.308   3.263   5.973
  481    HG2  ARG  63           1HG      ARG  63   1.516   4.753   5.687
  482    HG3  ARG  63           2HG      ARG  63   0.489   5.258   4.349
  483    HD2  ARG  63           1HD      ARG  63  -0.488   7.041   5.890
  484    HD3  ARG  63           2HD      ARG  63   0.738   6.596   7.072
  485    HE   ARG  63           HE       ARG  63   2.000   7.130   4.592
  486   HH11  ARG  63          1HH2      ARG  63   0.264   8.752   7.142
  487   HH12  ARG  63          2HH2      ARG  63   1.053  10.272   6.889
  488   HH21  ARG  63          1HH1      ARG  63   3.015   9.135   4.272
  489   HH22  ARG  63          2HH1      ARG  63   2.601  10.486   5.271
  490    H    VAL  64           H        VAL  64  -3.518   2.573   4.527
  491    HA   VAL  64           HA       VAL  64  -1.919   1.637   2.205
  492    HB   VAL  64           HB       VAL  64  -4.357   0.353   3.534
  493   HG11  VAL  64          1HG1      VAL  64  -3.590  -1.686   2.297
  494   HG12  VAL  64          2HG1      VAL  64  -2.329  -0.729   1.517
  495   HG13  VAL  64          3HG1      VAL  64  -4.022  -0.391   1.185
  496   HG21  VAL  64          3HG2      VAL  64  -2.684  -1.178   4.561
  497   HG22  VAL  64          1HG2      VAL  64  -2.411   0.485   5.071
  498   HG23  VAL  64          2HG2      VAL  64  -1.380  -0.233   3.840
  499    H    LEU  65           H        LEU  65  -2.522   2.027   0.185
  500    HA   LEU  65           HA       LEU  65  -5.274   3.053  -0.375
  501    HB2  LEU  65           1HB      LEU  65  -3.521   4.823  -0.560
  502    HB3  LEU  65           2HB      LEU  65  -2.706   3.858  -1.780
  503    HG   LEU  65           HG       LEU  65  -4.774   4.018  -3.227
  504   HD11  LEU  65          1HD1      LEU  65  -5.817   5.705  -0.918
  505   HD12  LEU  65          2HD1      LEU  65  -6.620   4.374  -1.750
  506   HD13  LEU  65          3HD1      LEU  65  -6.435   5.914  -2.555
  507   HD21  LEU  65          3HD2      LEU  65  -4.489   6.423  -3.821
  508   HD22  LEU  65          1HD2      LEU  65  -2.942   5.621  -3.559
  509   HD23  LEU  65          2HD2      LEU  65  -3.613   6.675  -2.319
  510    H    LYS  66           H        LYS  66  -6.413   1.997  -1.831
  511    HA   LYS  66           HA       LYS  66  -5.467  -0.457  -2.949
  512    HB2  LYS  66           1HB      LYS  66  -7.773  -0.252  -4.247
  513    HB3  LYS  66           2HB      LYS  66  -7.778  -0.514  -2.508
  514    HG2  LYS  66           1HG      LYS  66  -9.406   1.239  -3.230
  515    HG3  LYS  66           2HG      LYS  66  -8.236   1.846  -2.063
  516    HD2  LYS  66           1HD      LYS  66  -6.993   3.011  -3.787
  517    HD3  LYS  66           2HD      LYS  66  -7.896   2.214  -5.077
  518    HE2  LYS  66           1HE      LYS  66  -8.674   4.554  -4.710
  519    HE3  LYS  66           2HE      LYS  66  -9.952   3.392  -4.357
  520    HZ1  LYS  66           3HZ      LYS  66  -8.427   3.810  -2.035
  521    HZ2  LYS  66           1HZ      LYS  66 -10.064   4.157  -2.301
  522    HZ3  LYS  66           2HZ      LYS  66  -8.880   5.323  -2.659
  523    H    TYR  67           H        TYR  67  -5.537  -1.002  -5.246
  524    HA   TYR  67           HA       TYR  67  -4.075   1.011  -6.842
  525    HB2  TYR  67           1HB      TYR  67  -3.244  -1.332  -6.642
  526    HB3  TYR  67           2HB      TYR  67  -4.711  -1.921  -7.416
  527    HD1  TYR  67           HD1      TYR  67  -1.705   0.278  -7.911
  528    HD2  TYR  67           HD2      TYR  67  -4.935  -1.813  -9.865
  529    HE1  TYR  67           HE1      TYR  67  -0.707   0.781 -10.125
  530    HE2  TYR  67           HE2      TYR  67  -3.916  -1.307 -12.065
  531    HH   TYR  67           HH       TYR  67  -0.786  -0.241 -12.457
  532    H    ASN  68           H        ASN  68  -5.151   2.291  -8.158
  533    HA   ASN  68           HA       ASN  68  -7.343   1.301  -9.846
  534    HB2  ASN  68           1HB      ASN  68  -8.444   2.023  -7.704
  535    HB3  ASN  68           2HB      ASN  68  -7.806   3.645  -7.942
  536   HD21  ASN  68          2HD2      ASN  68 -10.685   2.582  -7.978
  537   HD22  ASN  68          1HD2      ASN  68 -11.314   3.119  -9.460
  538    H    ASP  69           H        ASP  69  -7.285   2.249 -11.778
  539    HA   ASP  69           HA       ASP  69  -5.250   3.786 -12.741
  540    HB2  ASP  69           1HB      ASP  69  -8.123   3.825 -13.697
  541    HB3  ASP  69           2HB      ASP  69  -6.719   4.315 -14.652
  542    H    ASP  70           H        ASP  70  -7.749   4.890 -10.685
  543    HA   ASP  70           HA       ASP  70  -7.717   7.693 -11.467
  544    HB2  ASP  70           1HB      ASP  70  -8.784   6.382  -8.934
  545    HB3  ASP  70           2HB      ASP  70  -9.128   8.024  -9.487
  546    H    ASN  71           H        ASN  71  -6.437   5.860  -8.651
  547    HA   ASN  71           HA       ASN  71  -5.040   8.127  -7.551
  548    HB2  ASN  71           1HB      ASN  71  -3.854   6.385  -6.172
  549    HB3  ASN  71           2HB      ASN  71  -5.610   6.305  -6.060
  550   HD21  ASN  71          2HD2      ASN  71  -6.245   4.154  -6.051
  551   HD22  ASN  71          1HD2      ASN  71  -5.534   2.931  -6.979
  552    H    VAL  72           H        VAL  72  -4.290   5.646  -9.889
  553    HA   VAL  72           HA       VAL  72  -1.452   6.036 -10.031
  554    HB   VAL  72           HB       VAL  72  -3.404   5.165 -12.188
  555   HG11  VAL  72          1HG1      VAL  72  -1.357   4.140 -13.291
  556   HG12  VAL  72          2HG1      VAL  72  -0.361   4.994 -12.112
  557   HG13  VAL  72          3HG1      VAL  72  -1.323   5.901 -13.278
  558   HG21  VAL  72          3HG2      VAL  72  -3.370   3.638 -10.249
  559   HG22  VAL  72          1HG2      VAL  72  -1.617   3.540 -10.337
  560   HG23  VAL  72          2HG2      VAL  72  -2.614   2.864 -11.626
  561    H    LYS  73           H        LYS  73  -4.226   7.518 -11.672
  562    HA   LYS  73           HA       LYS  73  -2.847   9.268 -13.407
  563    HB2  LYS  73           1HB      LYS  73  -5.278   8.668 -13.536
  564    HB3  LYS  73           2HB      LYS  73  -5.577   9.658 -12.117
  565    HG2  LYS  73           1HG      LYS  73  -4.747  11.667 -13.332
  566    HG3  LYS  73           2HG      LYS  73  -4.459  10.665 -14.758
  567    HD2  LYS  73           1HD      LYS  73  -6.886  10.097 -14.844
  568    HD3  LYS  73           2HD      LYS  73  -7.169  11.111 -13.424
  569    HE2  LYS  73           1HE      LYS  73  -7.729  12.339 -15.497
  570    HE3  LYS  73           2HE      LYS  73  -6.347  13.090 -14.695
  571    HZ1  LYS  73           3HZ      LYS  73  -6.356  12.421 -17.259
  572    HZ2  LYS  73           1HZ      LYS  73  -5.743  10.981 -16.602
  573    HZ3  LYS  73           2HZ      LYS  73  -4.943  12.453 -16.316
  574    H    ARG  74           H        ARG  74  -3.915   9.614 -10.044
  575    HA   ARG  74           HA       ARG  74  -3.250  12.370  -9.739
  576    HB2  ARG  74           1HB      ARG  74  -3.465  10.145  -7.673
  577    HB3  ARG  74           2HB      ARG  74  -3.203  11.840  -7.252
  578    HG2  ARG  74           1HG      ARG  74  -5.324  12.458  -8.395
  579    HG3  ARG  74           2HG      ARG  74  -5.598  10.762  -8.798
  580    HD2  ARG  74           1HD      ARG  74  -6.884  11.388  -6.789
  581    HD3  ARG  74           2HD      ARG  74  -5.642  10.210  -6.368
  582    HE   ARG  74           HE       ARG  74  -4.595  12.820  -6.058
  583   HH11  ARG  74          1HH2      ARG  74  -6.920  10.666  -4.614
  584   HH12  ARG  74          2HH2      ARG  74  -6.753  11.347  -3.032
  585   HH21  ARG  74          1HH1      ARG  74  -4.385  13.688  -3.994
  586   HH22  ARG  74          2HH1      ARG  74  -5.320  13.055  -2.684
  587    H    ARG  75           H        ARG  75  -1.374   9.391  -9.394
  588    HA   ARG  75           HA       ARG  75   0.974  10.590  -8.288
  589    HB2  ARG  75           1HB      ARG  75   0.538   8.135  -8.267
  590    HB3  ARG  75           2HB      ARG  75   0.756   8.086 -10.007
  591    HG2  ARG  75           1HG      ARG  75   3.093   8.874  -9.775
  592    HG3  ARG  75           2HG      ARG  75   2.891   9.004  -8.032
  593    HD2  ARG  75           1HD      ARG  75   2.490   6.567  -7.896
  594    HD3  ARG  75           2HD      ARG  75   2.643   6.439  -9.653
  595    HE   ARG  75           HE       ARG  75   4.950   7.663  -8.403
  596   HH11  ARG  75          1HH2      ARG  75   3.414   4.658  -9.222
  597   HH12  ARG  75          2HH2      ARG  75   4.886   3.746  -9.199
  598   HH21  ARG  75          1HH1      ARG  75   6.876   6.460  -8.383
  599   HH22  ARG  75          2HH1      ARG  75   6.839   4.764  -8.727
  600    H    GLN  76           H        GLN  76  -0.164   9.981 -11.577
  601    HA   GLN  76           HA       GLN  76   2.160  10.961 -12.937
  602    HB2  GLN  76           1HB      GLN  76  -0.732  10.654 -13.842
  603    HB3  GLN  76           2HB      GLN  76   0.590  11.084 -14.924
  604    HG2  GLN  76           1HG      GLN  76   0.482   8.514 -13.282
  605    HG3  GLN  76           2HG      GLN  76   0.031   8.626 -14.977
  606   HE21  GLN  76          2HE2      GLN  76   2.518   7.539 -13.160
  607   HE22  GLN  76          1HE2      GLN  76   3.826   7.888 -14.183
  608    H    GLU  77           H        GLU  77  -0.812  12.383 -11.709
  609    HA   GLU  77           HA       GLU  77  -0.496  14.990 -12.876
  610    HB2  GLU  77           1HB      GLU  77  -2.626  14.058 -11.819
  611    HB3  GLU  77           2HB      GLU  77  -1.891  14.334 -10.243
  612    HG2  GLU  77           1HG      GLU  77  -1.668  16.752 -10.767
  613    HG3  GLU  77           2HG      GLU  77  -2.429  16.477 -12.333
  614    H    LEU  78           H        LEU  78   0.203  13.693  -9.648
  615    HA   LEU  78           HA       LEU  78   1.486  15.948  -8.561
  616    HB2  LEU  78           1HB      LEU  78   1.725  12.989  -7.979
  617    HB3  LEU  78           2HB      LEU  78   2.506  14.202  -6.971
  618    HG   LEU  78           HG       LEU  78  -0.514  14.331  -7.478
  619   HD11  LEU  78          1HD1      LEU  78  -0.089  12.078  -6.576
  620   HD12  LEU  78          2HD1      LEU  78  -0.865  13.080  -5.353
  621   HD13  LEU  78          3HD1      LEU  78   0.870  12.763  -5.263
  622   HD21  LEU  78          3HD2      LEU  78  -0.515  15.535  -5.296
  623   HD22  LEU  78          1HD2      LEU  78   0.574  16.331  -6.421
  624   HD23  LEU  78          2HD2      LEU  78   1.226  15.303  -5.156
  625    H    ALA  79           H        ALA  79   2.766  13.168 -10.340
  626    HA   ALA  79           HA       ALA  79   5.524  13.821 -10.104
  627    HB1  ALA  79           3HB      ALA  79   5.847  12.259 -11.979
  628    HB2  ALA  79           1HB      ALA  79   4.118  12.289 -12.312
  629    HB3  ALA  79           2HB      ALA  79   4.707  11.592 -10.805
  630    H    ARG  80           H        ARG  80   3.030  14.695 -12.431
  631    HA   ARG  80           HA       ARG  80   4.766  16.165 -14.185
  632    HB2  ARG  80           1HB      ARG  80   2.489  15.093 -14.745
  633    HB3  ARG  80           2HB      ARG  80   1.738  16.445 -13.919
  634    HG2  ARG  80           1HG      ARG  80   1.755  17.259 -16.136
  635    HG3  ARG  80           2HG      ARG  80   3.296  17.896 -15.580
  636    HD2  ARG  80           1HD      ARG  80   4.395  15.781 -16.515
  637    HD3  ARG  80           2HD      ARG  80   2.840  15.374 -17.222
  638    HE   ARG  80           HE       ARG  80   3.537  18.004 -18.007
  639   HH11  ARG  80          1HH2      ARG  80   4.531  14.698 -18.471
  640   HH12  ARG  80          2HH2      ARG  80   5.202  14.983 -20.042
  641   HH21  ARG  80          1HH1      ARG  80   4.435  18.358 -20.068
  642   HH22  ARG  80          2HH1      ARG  80   5.149  17.042 -20.937
  643    H    GLN  81           H        GLN  81   2.574  16.967 -11.541
  644    HA   GLN  81           HA       GLN  81   2.748  19.786 -11.712
  645    HB2  GLN  81           1HB      GLN  81   1.033  18.431 -10.408
  646    HB3  GLN  81           2HB      GLN  81   2.274  18.131  -9.195
  647    HG2  GLN  81           1HG      GLN  81   2.509  20.591  -8.854
  648    HG3  GLN  81           2HG      GLN  81   1.246  20.863 -10.049
  649   HE21  GLN  81          2HE2      GLN  81   1.111  21.667  -7.237
  650   HE22  GLN  81          1HE2      GLN  81  -0.192  20.827  -6.546
  651    H    CYS  82           H        CYS  82   4.656  17.372  -9.955
  652    HA   CYS  82           HA       CYS  82   6.286  19.134  -8.467
  653    HB2  CYS  82           1HB      CYS  82   6.028  16.711  -7.994
  654    HB3  CYS  82           2HB      CYS  82   6.909  16.333  -9.473
  655    HG   CYS  82           HG       CYS  82   8.191  17.825  -7.035
  656    H    GLY  83           H        GLY  83   6.285  18.210 -11.802
  657    HA2  GLY  83           1HA      GLY  83   7.459  19.061 -13.581
  658    HA3  GLY  83           2HA      GLY  83   8.370  20.092 -12.482
  659    H    GLU  84           H        GLU  84   9.952  19.231 -14.259
  660    HA   GLU  84           HA       GLU  84  10.991  16.605 -14.134
  661    HB2  GLU  84           1HB      GLU  84  12.971  17.606 -15.289
  662    HB3  GLU  84           2HB      GLU  84  11.442  18.082 -16.028
  663    HG2  GLU  84           1HG      GLU  84  11.507  20.241 -14.806
  664    HG3  GLU  84           2HG      GLU  84  13.033  19.781 -14.058
  665    H    ARG  85           H        ARG  85  13.251  16.116 -13.443
  666    HA   ARG  85           HA       ARG  85  14.491  17.565 -11.295
  667    HB2  ARG  85           1HB      ARG  85  12.508  16.596 -10.103
  668    HB3  ARG  85           2HB      ARG  85  13.044  14.978 -10.554
  669    HG2  ARG  85           1HG      ARG  85  15.162  15.320  -9.297
  670    HG3  ARG  85           2HG      ARG  85  14.651  16.953  -8.871
  671    HD2  ARG  85           1HD      ARG  85  13.190  14.399  -8.086
  672    HD3  ARG  85           2HD      ARG  85  14.235  15.337  -7.018
  673    HE   ARG  85           HE       ARG  85  11.511  15.942  -7.722
  674   HH11  ARG  85          1HH2      ARG  85  14.567  17.366  -6.848
  675   HH12  ARG  85          2HH2      ARG  85  13.857  18.832  -6.261
  676   HH21  ARG  85          1HH1      ARG  85  10.605  17.858  -6.945
  677   HH22  ARG  85          2HH1      ARG  85  11.623  19.110  -6.319
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1 -31.335 -25.485   1.924
    2    H2   MET   1           2H       MET   1 -32.233 -24.348   1.037
    3    H3   MET   1           3H       MET   1 -31.447 -23.883   2.470
    4    HA   MET   1           HA       MET   1 -30.340 -24.354  -0.201
    5    HB2  MET   1           1HB      MET   1 -29.753 -22.424   2.084
    6    HB3  MET   1           2HB      MET   1 -28.954 -22.386   0.513
    7    HG2  MET   1           1HG      MET   1 -31.154 -22.003  -0.590
    8    HG3  MET   1           2HG      MET   1 -31.938 -22.025   0.987
    9    HE1  MET   1           3HE      MET   1 -29.326 -18.714  -0.827
   10    HE2  MET   1           1HE      MET   1 -30.443 -19.780  -1.686
   11    HE3  MET   1           2HE      MET   1 -28.967 -20.429  -0.983
   12    H    ASN   2           H        ASN   2 -27.739 -24.033   0.132
   13    HA   ASN   2           HA       ASN   2 -26.522 -25.480   2.284
   14    HB2  ASN   2           1HB      ASN   2 -25.821 -27.487   0.984
   15    HB3  ASN   2           2HB      ASN   2 -27.569 -27.420   1.183
   16   HD21  ASN   2          2HD2      ASN   2 -25.413 -28.265  -1.106
   17   HD22  ASN   2          1HD2      ASN   2 -26.233 -27.762  -2.506
   18    H    TYR   3           H        TYR   3 -26.206 -23.023   0.668
   19    HA   TYR   3           HA       TYR   3 -23.324 -23.139   0.315
   20    HB2  TYR   3           1HB      TYR   3 -23.341 -22.418  -2.054
   21    HB3  TYR   3           2HB      TYR   3 -24.059 -24.017  -1.867
   22    HD1  TYR   3           HD2      TYR   3 -24.808 -20.409  -2.463
   23    HD2  TYR   3           HD1      TYR   3 -26.479 -24.383  -2.255
   24    HE1  TYR   3           HE2      TYR   3 -26.916 -19.588  -3.477
   25    HE2  TYR   3           HE1      TYR   3 -28.578 -23.541  -3.269
   26    HH   TYR   3           HH       TYR   3 -29.620 -21.805  -4.167
   27    H    SER   4           H        SER   4 -22.437 -21.011  -0.227
   28    HA   SER   4           HA       SER   4 -24.101 -18.638   0.000
   29    HB2  SER   4           1HB      SER   4 -23.167 -17.854   2.129
   30    HB3  SER   4           2HB      SER   4 -23.961 -19.409   2.373
   31    HG   SER   4           HG       SER   4 -22.092 -19.955   3.173
   32    H    THR   5           H        THR   5 -22.805 -16.671  -0.068
   33    HA   THR   5           HA       THR   5 -20.782 -16.776  -2.036
   34    HB   THR   5           HB       THR   5 -21.336 -14.490  -0.097
   35    HG1  THR   5           HG1      THR   5 -22.512 -14.736  -2.619
   36   HG21  THR   5          3HG2      THR   5 -20.269 -14.526  -2.949
   37   HG22  THR   5          1HG2      THR   5 -19.322 -14.166  -1.503
   38   HG23  THR   5          2HG2      THR   5 -20.614 -13.078  -2.005
   39    H    GLY   6           H        GLY   6 -20.617 -16.340   1.475
   40    HA2  GLY   6           1HA      GLY   6 -18.904 -16.612   2.990
   41    HA3  GLY   6           2HA      GLY   6 -18.108 -17.618   1.784
   42    H    THR   7           H        THR   7 -18.873 -14.174   2.281
   43    HA   THR   7           HA       THR   7 -16.739 -13.133   0.742
   44    HB   THR   7           HB       THR   7 -18.440 -11.545   1.237
   45    HG1  THR   7           HG1      THR   7 -17.323  -9.958   2.147
   46   HG21  THR   7          3HG2      THR   7 -19.156 -11.037   3.600
   47   HG22  THR   7          1HG2      THR   7 -18.206 -12.413   4.152
   48   HG23  THR   7          2HG2      THR   7 -19.580 -12.664   3.076
   49    H    ASP   8           H        ASP   8 -14.892 -14.343   1.267
   50    HA   ASP   8           HA       ASP   8 -13.803 -14.691   3.841
   51    HB2  ASP   8           1HB      ASP   8 -13.158 -15.984   1.814
   52    HB3  ASP   8           2HB      ASP   8 -12.350 -14.561   1.168
   53    H    ALA   9           H        ALA   9 -12.119 -13.624   4.915
   54    HA   ALA   9           HA       ALA   9 -11.056 -11.791   5.784
   55    HB1  ALA   9           3HB      ALA   9 -10.666 -11.106   2.845
   56    HB2  ALA   9           1HB      ALA   9  -9.636 -12.179   3.791
   57    HB3  ALA   9           2HB      ALA   9  -9.727 -10.463   4.193
   58    H    ASN  10           H        ASN  10 -12.522 -10.532   6.845
   59    HA   ASN  10           HA       ASN  10 -14.637  -9.053   5.681
   60    HB2  ASN  10           1HB      ASN  10 -13.215  -8.574   8.329
   61    HB3  ASN  10           2HB      ASN  10 -14.806  -7.953   7.885
   62   HD21  ASN  10          2HD2      ASN  10 -13.833 -10.029   9.996
   63   HD22  ASN  10          1HD2      ASN  10 -14.868 -11.351   9.744
   64    H    THR  11           H        THR  11 -11.278  -8.257   6.334
   65    HA   THR  11           HA       THR  11 -11.417  -5.445   6.003
   66    HB   THR  11           HB       THR  11  -8.980  -5.590   5.586
   67    HG1  THR  11           HG1      THR  11  -8.115  -7.772   5.557
   68   HG21  THR  11          3HG2      THR  11  -9.795  -5.811   7.920
   69   HG22  THR  11          1HG2      THR  11  -8.346  -6.785   7.659
   70   HG23  THR  11          2HG2      THR  11  -9.928  -7.560   7.708
   71    H    LEU  12           H        LEU  12 -10.667  -4.197   4.177
   72    HA   LEU  12           HA       LEU  12 -11.811  -5.137   1.640
   73    HB2  LEU  12           1HB      LEU  12 -10.739  -2.488   2.668
   74    HB3  LEU  12           2HB      LEU  12 -11.056  -2.704   0.946
   75    HG   LEU  12           HG       LEU  12 -13.424  -3.265   1.439
   76   HD11  LEU  12          1HD1      LEU  12 -14.283  -2.825   3.809
   77   HD12  LEU  12          2HD1      LEU  12 -12.600  -2.846   4.341
   78   HD13  LEU  12          3HD1      LEU  12 -13.320  -4.283   3.614
   79   HD21  LEU  12          3HD2      LEU  12 -12.508  -0.674   2.752
   80   HD22  LEU  12          1HD2      LEU  12 -14.142  -1.005   2.174
   81   HD23  LEU  12          2HD2      LEU  12 -12.805  -0.904   1.029
   82    H    PHE  13           H        PHE  13  -8.794  -5.322   3.113
   83    HA   PHE  13           HA       PHE  13  -7.293  -5.420   0.526
   84    HB2  PHE  13           1HB      PHE  13  -6.305  -5.142   3.395
   85    HB3  PHE  13           2HB      PHE  13  -5.284  -5.171   1.955
   86    HD1  PHE  13           HD2      PHE  13  -5.402  -3.309   0.264
   87    HD2  PHE  13           HD1      PHE  13  -7.636  -3.126   3.953
   88    HE1  PHE  13           HE2      PHE  13  -5.799  -0.885  -0.082
   89    HE2  PHE  13           HE1      PHE  13  -8.028  -0.708   3.584
   90    HZ   PHE  13           HZ       PHE  13  -7.109   0.413   1.573
   91    H    VAL  14           H        VAL  14  -6.318  -7.248  -0.092
   92    HA   VAL  14           HA       VAL  14  -6.478  -9.700   1.633
   93    HB   VAL  14           HB       VAL  14  -6.883  -9.553  -1.385
   94   HG11  VAL  14          1HG1      VAL  14  -7.189 -11.851   0.598
   95   HG12  VAL  14          2HG1      VAL  14  -5.934 -11.719  -0.634
   96   HG13  VAL  14          3HG1      VAL  14  -7.612 -11.928  -1.113
   97   HG21  VAL  14          3HG2      VAL  14  -8.790  -8.526  -0.177
   98   HG22  VAL  14          1HG2      VAL  14  -8.913  -9.951   0.857
   99   HG23  VAL  14          2HG2      VAL  14  -9.263 -10.075  -0.868
  100    H    ASP  15           H        ASP  15  -4.746 -11.058   1.588
  101    HA   ASP  15           HA       ASP  15  -2.189 -10.044   1.116
  102    HB2  ASP  15           1HB      ASP  15  -1.423 -12.364   1.515
  103    HB3  ASP  15           2HB      ASP  15  -2.677 -11.898   2.664
  104    H    GLY  16           H        GLY  16  -0.764 -10.160  -0.553
  105    HA2  GLY  16           1HA      GLY  16   0.176 -10.870  -2.591
  106    HA3  GLY  16           2HA      GLY  16  -1.262 -11.805  -2.951
  107    H    GLU  17           H        GLU  17  -2.490  -8.992  -1.960
  108    HA   GLU  17           HA       GLU  17  -3.113  -8.060  -4.636
  109    HB2  GLU  17           1HB      GLU  17  -4.753  -8.051  -2.756
  110    HB3  GLU  17           2HB      GLU  17  -3.796  -6.821  -1.936
  111    HG2  GLU  17           1HG      GLU  17  -4.156  -5.257  -3.826
  112    HG3  GLU  17           2HG      GLU  17  -5.051  -6.497  -4.696
  113    H    ARG  18           H        ARG  18  -2.274  -6.356  -5.696
  114    HA   ARG  18           HA       ARG  18   0.130  -5.030  -4.666
  115    HB2  ARG  18           1HB      ARG  18  -0.018  -5.842  -7.016
  116    HB3  ARG  18           2HB      ARG  18  -1.322  -4.701  -7.328
  117    HG2  ARG  18           1HG      ARG  18   0.184  -2.796  -6.863
  118    HG3  ARG  18           2HG      ARG  18   1.486  -3.901  -6.423
  119    HD2  ARG  18           1HD      ARG  18   0.191  -3.778  -9.177
  120    HD3  ARG  18           2HD      ARG  18   1.724  -3.017  -8.753
  121    HE   ARG  18           HE       ARG  18   1.897  -5.726  -8.034
  122   HH11  ARG  18          1HH2      ARG  18   1.591  -3.771 -10.894
  123   HH12  ARG  18          2HH2      ARG  18   2.419  -4.902 -11.911
  124   HH21  ARG  18          1HH1      ARG  18   2.979  -7.191  -9.372
  125   HH22  ARG  18          2HH1      ARG  18   3.203  -6.832 -11.051
  126    H    VAL  19           H        VAL  19   0.107  -3.075  -3.703
  127    HA   VAL  19           HA       VAL  19  -2.159  -1.168  -4.126
  128    HB   VAL  19           HB       VAL  19  -2.197  -0.657  -1.719
  129   HG11  VAL  19          1HG1      VAL  19  -2.496  -3.639  -2.265
  130   HG12  VAL  19          2HG1      VAL  19  -3.722  -2.410  -2.571
  131   HG13  VAL  19          3HG1      VAL  19  -3.222  -2.765  -0.918
  132   HG21  VAL  19          3HG2      VAL  19   0.091  -1.140  -1.022
  133   HG22  VAL  19          1HG2      VAL  19  -0.034  -2.821  -1.536
  134   HG23  VAL  19          2HG2      VAL  19  -0.939  -2.255  -0.131
  135    H    LEU  20           H        LEU  20  -1.559   0.960  -2.975
  136    HA   LEU  20           HA       LEU  20   1.240   1.711  -3.725
  137    HB2  LEU  20           1HB      LEU  20  -1.270   3.415  -3.764
  138    HB3  LEU  20           2HB      LEU  20   0.327   3.896  -4.327
  139    HG   LEU  20           HG       LEU  20  -1.387   1.671  -5.535
  140   HD11  LEU  20          1HD1      LEU  20  -0.705   4.438  -6.595
  141   HD12  LEU  20          2HD1      LEU  20  -2.277   3.914  -5.992
  142   HD13  LEU  20          3HD1      LEU  20  -1.625   3.205  -7.462
  143   HD21  LEU  20          3HD2      LEU  20   1.397   2.697  -6.248
  144   HD22  LEU  20          1HD2      LEU  20   0.389   1.873  -7.442
  145   HD23  LEU  20          2HD2      LEU  20   0.880   1.031  -5.983
  146    H    CYS  21           H        CYS  21   2.392   2.967  -2.358
  147    HA   CYS  21           HA       CYS  21   1.223   3.627   0.334
  148    HB2  CYS  21           1HB      CYS  21   2.732   1.648   0.402
  149    HB3  CYS  21           2HB      CYS  21   4.037   2.627  -0.263
  150    HG   CYS  21           HG       CYS  21   4.470   3.201   2.118
  151    H    PHE  22           H        PHE  22   1.101   5.770   0.462
  152    HA   PHE  22           HA       PHE  22   3.066   7.499  -0.912
  153    HB2  PHE  22           1HB      PHE  22   1.542   9.323  -0.453
  154    HB3  PHE  22           2HB      PHE  22   0.642   7.980  -1.151
  155    HD1  PHE  22           HD1      PHE  22   1.304   9.902   1.961
  156    HD2  PHE  22           HD2      PHE  22  -0.990   6.688   0.226
  157    HE1  PHE  22           HE1      PHE  22  -0.190   9.893   3.937
  158    HE2  PHE  22           HE2      PHE  22  -2.477   6.691   2.211
  159    HZ   PHE  22           HZ       PHE  22  -2.079   8.292   4.064
  160    H    HIS  23           H        HIS  23   4.296   9.050   0.149
  161    HA   HIS  23           HA       HIS  23   4.718   8.632   3.080
  162    HB2  HIS  23           1HB      HIS  23   6.606   7.869   1.615
  163    HB3  HIS  23           2HB      HIS  23   6.746   9.503   0.975
  164    HD1  HIS  23           HD1      HIS  23   6.561   7.968   4.479
  165    HD2  HIS  23           HD2      HIS  23   8.668  10.901   2.395
  166    HE1  HIS  23           HE1      HIS  23   8.185   8.991   6.130
  167    HE2  HIS  23           HE2      HIS  23   9.476  10.782   4.876
  168    H    GLY  24           H        GLY  24   4.349  10.951   0.459
  169    HA2  GLY  24           1HA      GLY  24   3.108  13.001   1.653
  170    HA3  GLY  24           2HA      GLY  24   4.767  13.291   2.177
  171    HA   PRO  25           HA       PRO  25   5.799  15.275  -1.603
  172    HB2  PRO  25           1HB      PRO  25   8.094  14.056  -2.581
  173    HB3  PRO  25           2HB      PRO  25   8.084  15.063  -1.113
  174    HG2  PRO  25           1HG      PRO  25   7.826  12.054  -1.306
  175    HG3  PRO  25           2HG      PRO  25   8.960  13.002  -0.311
  176    HD2  PRO  25           1HD      PRO  25   6.728  12.073   0.822
  177    HD3  PRO  25           2HD      PRO  25   7.214  13.750   1.164
  178    H    LEU  26           H        LEU  26   5.828  11.734  -2.137
  179    HA   LEU  26           HA       LEU  26   4.051  12.027  -4.460
  180    HB2  LEU  26           1HB      LEU  26   6.752  12.135  -5.065
  181    HB3  LEU  26           2HB      LEU  26   6.516  10.397  -5.095
  182    HG   LEU  26           HG       LEU  26   4.424  10.967  -6.667
  183   HD11  LEU  26          1HD1      LEU  26   4.593  13.005  -7.950
  184   HD12  LEU  26          2HD1      LEU  26   6.154  13.409  -7.237
  185   HD13  LEU  26          3HD1      LEU  26   4.699  13.490  -6.260
  186   HD21  LEU  26          3HD2      LEU  26   5.859  10.868  -8.689
  187   HD22  LEU  26          1HD2      LEU  26   6.419   9.732  -7.462
  188   HD23  LEU  26          2HD2      LEU  26   7.274  11.256  -7.706
  189    H    ILE  27           H        ILE  27   3.345   9.963  -5.327
  190    HA   ILE  27           HA       ILE  27   2.901   8.004  -3.208
  191    HB   ILE  27           HB       ILE  27   1.841   8.101  -6.057
  192   HG12  ILE  27          1HG1      ILE  27   0.457   8.916  -3.447
  193   HG13  ILE  27          2HG1      ILE  27   1.180  10.066  -4.557
  194   HG21  ILE  27          1HG2      ILE  27   0.112   6.497  -5.183
  195   HG22  ILE  27          2HG2      ILE  27   0.961   6.449  -3.640
  196   HG23  ILE  27          3HG2      ILE  27   1.728   5.811  -5.091
  197   HD11  ILE  27          3HD1      ILE  27  -0.333   9.275  -6.357
  198   HD12  ILE  27          1HD1      ILE  27  -1.210   9.930  -4.976
  199   HD13  ILE  27          2HD1      ILE  27  -1.105   8.187  -5.204
  200    H    TYR  28           H        TYR  28   3.871   6.054  -3.075
  201    HA   TYR  28           HA       TYR  28   5.748   5.173  -5.239
  202    HB2  TYR  28           1HB      TYR  28   5.868   4.694  -2.234
  203    HB3  TYR  28           2HB      TYR  28   7.032   4.099  -3.416
  204    HD1  TYR  28           HD1      TYR  28   8.538   5.682  -4.638
  205    HD2  TYR  28           HD2      TYR  28   5.801   7.109  -1.617
  206    HE1  TYR  28           HE1      TYR  28   9.731   7.854  -4.567
  207    HE2  TYR  28           HE2      TYR  28   7.023   9.271  -1.558
  208    HH   TYR  28           HH       TYR  28   8.877  10.401  -3.800
  209    H    GLU  29           H        GLU  29   5.970   2.922  -5.555
  210    HA   GLU  29           HA       GLU  29   3.424   1.477  -5.355
  211    HB2  GLU  29           1HB      GLU  29   4.736   1.593  -7.480
  212    HB3  GLU  29           2HB      GLU  29   6.034   0.681  -6.718
  213    HG2  GLU  29           1HG      GLU  29   4.496  -1.233  -6.357
  214    HG3  GLU  29           2HG      GLU  29   3.168  -0.311  -7.055
  215    H    ALA  30           H        ALA  30   3.085  -0.342  -4.195
  216    HA   ALA  30           HA       ALA  30   5.234  -1.789  -2.826
  217    HB1  ALA  30           3HB      ALA  30   4.218  -1.471  -0.593
  218    HB2  ALA  30           1HB      ALA  30   3.028  -0.363  -1.287
  219    HB3  ALA  30           2HB      ALA  30   4.736   0.072  -1.272
  220    H    LYS  31           H        LYS  31   4.129  -3.583  -1.441
  221    HA   LYS  31           HA       LYS  31   1.599  -4.542  -2.662
  222    HB2  LYS  31           1HB      LYS  31   3.550  -5.430  -3.963
  223    HB3  LYS  31           2HB      LYS  31   4.136  -6.213  -2.507
  224    HG2  LYS  31           1HG      LYS  31   1.261  -6.855  -3.206
  225    HG3  LYS  31           2HG      LYS  31   2.425  -7.436  -4.374
  226    HD2  LYS  31           1HD      LYS  31   2.802  -8.014  -1.407
  227    HD3  LYS  31           2HD      LYS  31   1.748  -9.014  -2.380
  228    HE2  LYS  31           1HE      LYS  31   4.687  -8.533  -2.999
  229    HE3  LYS  31           2HE      LYS  31   4.037  -9.977  -2.228
  230    HZ1  LYS  31           3HZ      LYS  31   3.728 -10.758  -4.263
  231    HZ2  LYS  31           1HZ      LYS  31   4.057  -9.260  -4.987
  232    HZ3  LYS  31           2HZ      LYS  31   2.486  -9.614  -4.449
  233    H    VAL  32           H        VAL  32   0.544  -6.163  -1.485
  234    HA   VAL  32           HA       VAL  32   1.021  -6.028   1.448
  235    HB   VAL  32           HB       VAL  32  -1.381  -7.190  -0.063
  236   HG11  VAL  32          1HG1      VAL  32  -1.143  -7.991   2.283
  237   HG12  VAL  32          2HG1      VAL  32  -2.523  -6.914   2.133
  238   HG13  VAL  32          3HG1      VAL  32  -1.019  -6.325   2.843
  239   HG21  VAL  32          3HG2      VAL  32  -1.036  -4.420   1.167
  240   HG22  VAL  32          1HG2      VAL  32  -2.519  -5.055   0.451
  241   HG23  VAL  32          2HG2      VAL  32  -1.110  -4.774  -0.558
  242    H    LEU  33           H        LEU  33   2.452  -7.591   2.077
  243    HA   LEU  33           HA       LEU  33   2.617 -10.163   0.766
  244    HB2  LEU  33           1HB      LEU  33   4.446  -8.764   2.224
  245    HB3  LEU  33           2HB      LEU  33   3.863  -9.817   3.500
  246    HG   LEU  33           HG       LEU  33   5.015 -10.717   0.822
  247   HD11  LEU  33          1HD1      LEU  33   6.118 -10.912   3.649
  248   HD12  LEU  33          2HD1      LEU  33   6.711  -9.845   2.376
  249   HD13  LEU  33          3HD1      LEU  33   6.870 -11.592   2.205
  250   HD21  LEU  33          3HD2      LEU  33   3.437 -12.408   1.382
  251   HD22  LEU  33          1HD2      LEU  33   3.760 -12.289   3.115
  252   HD23  LEU  33          2HD2      LEU  33   4.938 -13.038   2.034
  253    H    LYS  34           H        LYS  34   1.225  -8.960   3.783
  254    HA   LYS  34           HA       LYS  34  -0.662 -11.163   3.852
  255    HB2  LYS  34           1HB      LYS  34   0.028 -12.080   6.060
  256    HB3  LYS  34           2HB      LYS  34   1.263 -12.339   4.829
  257    HG2  LYS  34           1HG      LYS  34   2.501 -10.359   5.650
  258    HG3  LYS  34           2HG      LYS  34   1.274 -10.111   6.897
  259    HD2  LYS  34           1HD      LYS  34   1.820 -12.323   7.873
  260    HD3  LYS  34           2HD      LYS  34   3.054 -12.560   6.639
  261    HE2  LYS  34           1HE      LYS  34   4.265 -10.553   7.450
  262    HE3  LYS  34           2HE      LYS  34   3.031 -10.312   8.689
  263    HZ1  LYS  34           3HZ      LYS  34   5.013 -11.489   9.500
  264    HZ2  LYS  34           1HZ      LYS  34   4.691 -12.756   8.417
  265    HZ3  LYS  34           2HZ      LYS  34   3.593 -12.407   9.665
  266    H    THR  35           H        THR  35  -2.223 -10.949   5.558
  267    HA   THR  35           HA       THR  35  -2.347  -8.284   6.894
  268    HB   THR  35           HB       THR  35  -3.611  -7.943   4.856
  269    HG1  THR  35           HG1      THR  35  -5.793  -7.905   5.780
  270   HG21  THR  35          3HG2      THR  35  -5.478  -9.474   4.212
  271   HG22  THR  35          1HG2      THR  35  -4.970 -10.600   5.468
  272   HG23  THR  35          2HG2      THR  35  -3.902 -10.256   4.107
  273    H    LYS  36           H        LYS  36  -3.710  -8.186   8.681
  274    HA   LYS  36           HA       LYS  36  -4.398 -10.864   9.875
  275    HB2  LYS  36           1HB      LYS  36  -2.617  -9.585  11.036
  276    HB3  LYS  36           2HB      LYS  36  -3.764  -8.300  11.338
  277    HG2  LYS  36           1HG      LYS  36  -5.200  -9.846  12.641
  278    HG3  LYS  36           2HG      LYS  36  -4.090 -11.168  12.287
  279    HD2  LYS  36           1HD      LYS  36  -2.280  -9.975  13.502
  280    HD3  LYS  36           2HD      LYS  36  -3.402  -8.666  13.876
  281    HE2  LYS  36           1HE      LYS  36  -4.846 -10.257  15.124
  282    HE3  LYS  36           2HE      LYS  36  -3.728 -11.569  14.744
  283    HZ1  LYS  36           3HZ      LYS  36  -2.388  -9.322  15.876
  284    HZ2  LYS  36           1HZ      LYS  36  -2.373 -10.946  16.365
  285    HZ3  LYS  36           2HZ      LYS  36  -3.602  -9.907  16.909
  286    HA   PRO  37           HA       PRO  37  -8.454  -8.599   9.445
  287    HB2  PRO  37           1HB      PRO  37  -9.956 -10.447   8.218
  288    HB3  PRO  37           2HB      PRO  37  -8.642  -9.655   7.310
  289    HG2  PRO  37           1HG      PRO  37  -8.572 -12.326   8.730
  290    HG3  PRO  37           2HG      PRO  37  -8.138 -11.966   7.041
  291    HD2  PRO  37           1HD      PRO  37  -6.239 -12.066   9.031
  292    HD3  PRO  37           2HD      PRO  37  -6.076 -10.962   7.647
  293    H    ASP  38           H        ASP  38  -7.257 -10.764  11.507
  294    HA   ASP  38           HA       ASP  38  -9.532 -12.074  12.617
  295    HB2  ASP  38           1HB      ASP  38  -7.182 -12.824  12.952
  296    HB3  ASP  38           2HB      ASP  38  -6.872 -11.392  13.928
  297    H    ALA  39           H        ALA  39  -8.944  -8.853  12.454
  298    HA   ALA  39           HA       ALA  39 -10.850  -8.210  14.555
  299    HB1  ALA  39           3HB      ALA  39  -9.327  -6.764  15.857
  300    HB2  ALA  39           1HB      ALA  39  -7.974  -7.253  14.831
  301    HB3  ALA  39           2HB      ALA  39  -8.762  -8.436  15.871
  302    H    THR  40           H        THR  40 -11.400  -5.946  14.598
  303    HA   THR  40           HA       THR  40 -10.574  -4.328  12.257
  304    HB   THR  40           HB       THR  40 -12.903  -3.845  11.679
  305    HG1  THR  40           HG1      THR  40 -13.786  -4.148  13.734
  306   HG21  THR  40          3HG2      THR  40 -13.479  -6.000  10.697
  307   HG22  THR  40          1HG2      THR  40 -12.510  -6.858  11.891
  308   HG23  THR  40          2HG2      THR  40 -11.722  -5.865  10.664
  309    HA   PRO  41           HA       PRO  41  -9.889  -2.195  11.895
  310    HB2  PRO  41           1HB      PRO  41  -8.141  -0.362  12.900
  311    HB3  PRO  41           2HB      PRO  41  -9.825   0.085  12.523
  312    HG2  PRO  41           1HG      PRO  41  -8.680  -0.753  15.195
  313    HG3  PRO  41           2HG      PRO  41  -9.616   0.715  14.806
  314    HD2  PRO  41           1HD      PRO  41 -10.884  -1.428  15.846
  315    HD3  PRO  41           2HD      PRO  41 -11.654  -0.507  14.532
  316    H    VAL  42           H        VAL  42  -7.353  -2.216  11.700
  317    HA   VAL  42           HA       VAL  42  -5.860  -3.694  13.672
  318    HB   VAL  42           HB       VAL  42  -7.387  -5.493  12.822
  319   HG11  VAL  42          1HG1      VAL  42  -7.573  -4.526  10.473
  320   HG12  VAL  42          2HG1      VAL  42  -7.302  -6.261  10.517
  321   HG13  VAL  42          3HG1      VAL  42  -5.968  -5.176  10.143
  322   HG21  VAL  42          3HG2      VAL  42  -5.718  -7.190  12.743
  323   HG22  VAL  42          1HG2      VAL  42  -4.865  -5.888  13.555
  324   HG23  VAL  42          2HG2      VAL  42  -4.597  -6.184  11.845
  325    H    GLU  43           H        GLU  43  -3.773  -4.634  12.550
  326    HA   GLU  43           HA       GLU  43  -2.624  -2.491  10.871
  327    HB2  GLU  43           1HB      GLU  43  -0.451  -3.464  11.615
  328    HB3  GLU  43           2HB      GLU  43  -1.447  -2.940  12.969
  329    HG2  GLU  43           1HG      GLU  43  -2.201  -5.291  13.316
  330    HG3  GLU  43           2HG      GLU  43  -1.177  -5.820  11.987
  331    H    TYR  44           H        TYR  44  -1.102  -3.151   9.215
  332    HA   TYR  44           HA       TYR  44  -1.663  -5.761   7.891
  333    HB2  TYR  44           1HB      TYR  44  -1.620  -3.023   6.540
  334    HB3  TYR  44           2HB      TYR  44  -1.867  -4.576   5.745
  335    HD1  TYR  44           HD1      TYR  44  -3.360  -2.123   8.138
  336    HD2  TYR  44           HD2      TYR  44  -4.032  -5.765   5.931
  337    HE1  TYR  44           HE1      TYR  44  -5.773  -2.037   8.701
  338    HE2  TYR  44           HE2      TYR  44  -6.439  -5.660   6.503
  339    HH   TYR  44           HH       TYR  44  -7.980  -3.028   7.528
  340    H    TYR  45           H        TYR  45  -0.065  -6.468   6.484
  341    HA   TYR  45           HA       TYR  45   2.667  -5.468   7.174
  342    HB2  TYR  45           1HB      TYR  45   2.044  -7.885   7.525
  343    HB3  TYR  45           2HB      TYR  45   1.942  -8.049   5.779
  344    HD1  TYR  45           HD1      TYR  45   3.997  -7.582   4.336
  345    HD2  TYR  45           HD2      TYR  45   4.243  -7.798   8.626
  346    HE1  TYR  45           HE1      TYR  45   6.447  -7.903   4.186
  347    HE2  TYR  45           HE2      TYR  45   6.692  -8.110   8.463
  348    HH   TYR  45           HH       TYR  45   8.428  -7.543   5.634
  349    H    ILE  46           H        ILE  46   3.251  -3.932   5.819
  350    HA   ILE  46           HA       ILE  46   2.931  -4.270   2.868
  351    HB   ILE  46           HB       ILE  46   3.382  -1.703   4.457
  352   HG12  ILE  46          1HG1      ILE  46   1.179  -2.605   5.053
  353   HG13  ILE  46          2HG1      ILE  46   0.967  -1.223   3.992
  354   HG21  ILE  46          1HG2      ILE  46   2.593  -2.169   1.551
  355   HG22  ILE  46          2HG2      ILE  46   4.157  -1.573   2.107
  356   HG23  ILE  46          3HG2      ILE  46   2.713  -0.594   2.333
  357   HD11  ILE  46          3HD1      ILE  46   0.807  -3.023   2.073
  358   HD12  ILE  46          1HD1      ILE  46  -0.565  -2.791   3.154
  359   HD13  ILE  46          2HD1      ILE  46   0.527  -4.148   3.402
  360    H    HIS  47           H        HIS  47   4.677  -4.084   1.584
  361    HA   HIS  47           HA       HIS  47   7.334  -3.371   2.678
  362    HB2  HIS  47           1HB      HIS  47   8.397  -5.396   1.820
  363    HB3  HIS  47           2HB      HIS  47   7.124  -5.852   2.947
  364    HD1  HIS  47           HD1      HIS  47   8.371  -6.635  -0.318
  365    HD2  HIS  47           HD2      HIS  47   4.573  -6.455   1.375
  366    HE1  HIS  47           HE1      HIS  47   6.840  -7.931  -1.861
  367    HE2  HIS  47           HE2      HIS  47   4.525  -7.833  -0.838
  368    H    TYR  48           H        TYR  48   8.596  -2.351   1.202
  369    HA   TYR  48           HA       TYR  48   7.410  -1.427  -1.250
  370    HB2  TYR  48           1HB      TYR  48  10.288  -1.221  -0.268
  371    HB3  TYR  48           2HB      TYR  48   9.578  -0.287  -1.585
  372    HD1  TYR  48           HD1      TYR  48   7.564   1.234  -1.107
  373    HD2  TYR  48           HD2      TYR  48   9.936  -0.497   2.057
  374    HE1  TYR  48           HE1      TYR  48   6.645   2.883   0.499
  375    HE2  TYR  48           HE2      TYR  48   9.009   1.165   3.644
  376    HH   TYR  48           HH       TYR  48   7.295   3.914   2.650
  377    H    ALA  49           H        ALA  49   7.599  -2.208  -3.269
  378    HA   ALA  49           HA       ALA  49   8.569  -4.849  -3.756
  379    HB1  ALA  49           3HB      ALA  49   7.793  -2.669  -5.733
  380    HB2  ALA  49           1HB      ALA  49   6.693  -3.846  -5.015
  381    HB3  ALA  49           2HB      ALA  49   7.967  -4.386  -6.110
  382    H    GLY  50           H        GLY  50  10.492  -5.557  -4.569
  383    HA2  GLY  50           1HA      GLY  50  12.568  -5.539  -5.617
  384    HA3  GLY  50           2HA      GLY  50  12.405  -3.816  -5.930
  385    H    TRP  51           H        TRP  51  11.837  -4.927  -2.705
  386    HA   TRP  51           HA       TRP  51  14.603  -4.278  -1.801
  387    HB2  TRP  51           1HB      TRP  51  12.052  -3.019  -0.710
  388    HB3  TRP  51           2HB      TRP  51  13.663  -2.819  -0.017
  389    HD1  TRP  51           HD1      TRP  51  11.440  -1.447  -2.716
  390    HE1  TRP  51           HE1      TRP  51  12.712   0.339  -4.070
  391    HE3  TRP  51           HE3      TRP  51  16.161  -2.212  -0.946
  392    HZ2  TRP  51           HZ2      TRP  51  15.382   1.314  -4.363
  393    HZ3  TRP  51           HZ3      TRP  51  18.057  -0.843  -1.778
  394    HH2  TRP  51           HH2      TRP  51  17.673   0.919  -3.484
  395    H    SER  52           H        SER  52  14.960  -4.842   0.443
  396    HA   SER  52           HA       SER  52  14.258  -7.531   0.974
  397    HB2  SER  52           1HB      SER  52  15.441  -7.209   3.096
  398    HB3  SER  52           2HB      SER  52  16.323  -6.403   1.798
  399    HG   SER  52           HG       SER  52  15.295  -5.361   4.029
  400    H    LYS  53           H        LYS  53  12.592  -8.405   2.075
  401    HA   LYS  53           HA       LYS  53  10.410  -6.741   3.050
  402    HB2  LYS  53           1HB      LYS  53   9.226  -8.893   3.355
  403    HB3  LYS  53           2HB      LYS  53   9.886  -8.729   1.729
  404    HG2  LYS  53           1HG      LYS  53  11.827 -10.140   2.366
  405    HG3  LYS  53           2HG      LYS  53  11.171 -10.321   3.992
  406    HD2  LYS  53           1HD      LYS  53   9.150 -11.413   3.079
  407    HD3  LYS  53           2HD      LYS  53   9.769 -11.218   1.437
  408    HE2  LYS  53           1HE      LYS  53  10.200 -13.506   2.269
  409    HE3  LYS  53           2HE      LYS  53  11.721 -12.646   2.021
  410    HZ1  LYS  53           3HZ      LYS  53  10.378 -12.586   4.644
  411    HZ2  LYS  53           1HZ      LYS  53  12.017 -12.350   4.278
  412    HZ3  LYS  53           2HZ      LYS  53  11.348 -13.910   4.208
  413    H    ASN  54           H        ASN  54  13.240  -7.850   4.435
  414    HA   ASN  54           HA       ASN  54  12.316  -8.693   7.015
  415    HB2  ASN  54           1HB      ASN  54  15.018  -7.563   6.184
  416    HB3  ASN  54           2HB      ASN  54  14.680  -8.434   7.682
  417   HD21  ASN  54          2HD2      ASN  54  16.452  -9.153   5.282
  418   HD22  ASN  54          1HD2      ASN  54  15.925 -10.701   4.828
  419    H    TRP  55           H        TRP  55  12.370  -5.683   5.501
  420    HA   TRP  55           HA       TRP  55  12.962  -3.963   7.705
  421    HB2  TRP  55           1HB      TRP  55  12.987  -3.305   5.268
  422    HB3  TRP  55           2HB      TRP  55  11.229  -3.371   5.262
  423    HD1  TRP  55           HD1      TRP  55  10.010  -1.669   7.112
  424    HE1  TRP  55           HE1      TRP  55  10.700   0.721   7.783
  425    HE3  TRP  55           HE3      TRP  55  14.871  -1.700   5.569
  426    HZ2  TRP  55           HZ2      TRP  55  13.013   2.399   7.679
  427    HZ3  TRP  55           HZ3      TRP  55  16.301   0.306   5.865
  428    HH2  TRP  55           HH2      TRP  55  15.378   2.356   6.919
  429    H    ASP  56           H        ASP  56  10.154  -5.717   6.688
  430    HA   ASP  56           HA       ASP  56   7.960  -5.800   7.400
  431    HB2  ASP  56           1HB      ASP  56   7.783  -6.270   9.825
  432    HB3  ASP  56           2HB      ASP  56   9.158  -7.099   9.101
  433    H    GLU  57           H        GLU  57   7.424  -3.630   6.503
  434    HA   GLU  57           HA       GLU  57   7.230  -1.412   8.431
  435    HB2  GLU  57           1HB      GLU  57   7.905  -1.109   5.990
  436    HB3  GLU  57           2HB      GLU  57   6.252  -1.483   5.544
  437    HG2  GLU  57           1HG      GLU  57   5.462   0.422   6.933
  438    HG3  GLU  57           2HG      GLU  57   7.124   0.812   7.346
  439    H    TRP  58           H        TRP  58   5.703  -2.272   9.909
  440    HA   TRP  58           HA       TRP  58   3.049  -3.128   9.114
  441    HB2  TRP  58           1HB      TRP  58   4.243  -2.359  11.813
  442    HB3  TRP  58           2HB      TRP  58   2.610  -2.981  11.610
  443    HD1  TRP  58           HD1      TRP  58   6.280  -4.084  11.348
  444    HE1  TRP  58           HE1      TRP  58   6.361  -6.660  11.417
  445    HE3  TRP  58           HE3      TRP  58   1.295  -5.130  11.092
  446    HZ2  TRP  58           HZ2      TRP  58   4.544  -8.881  11.363
  447    HZ3  TRP  58           HZ3      TRP  58   0.491  -7.476  11.106
  448    HH2  TRP  58           HH2      TRP  58   2.110  -9.352  11.242
  449    H    VAL  59           H        VAL  59   1.437  -1.763   8.540
  450    HA   VAL  59           HA       VAL  59   1.251   0.925   9.779
  451    HB   VAL  59           HB       VAL  59   0.744   1.853   7.360
  452   HG11  VAL  59          1HG1      VAL  59   3.561   1.107   8.225
  453   HG12  VAL  59          2HG1      VAL  59   2.716   2.600   8.584
  454   HG13  VAL  59          3HG1      VAL  59   3.200   2.236   6.931
  455   HG21  VAL  59          3HG2      VAL  59   0.664  -0.410   6.295
  456   HG22  VAL  59          1HG2      VAL  59   2.385  -0.616   6.627
  457   HG23  VAL  59          2HG2      VAL  59   1.848   0.650   5.529
  458    HA   PRO  60           HA       PRO  60  -3.104  -0.005   9.735
  459    HB2  PRO  60           1HB      PRO  60  -4.235   2.440  10.088
  460    HB3  PRO  60           2HB      PRO  60  -3.171   1.754  11.345
  461    HG2  PRO  60           1HG      PRO  60  -2.410   3.665   9.121
  462    HG3  PRO  60           2HG      PRO  60  -2.168   3.872  10.873
  463    HD2  PRO  60           1HD      PRO  60  -0.160   2.905   9.347
  464    HD3  PRO  60           2HD      PRO  60  -0.460   2.208  10.956
  465    H    GLU  61           H        GLU  61  -5.053   0.242   8.484
  466    HA   GLU  61           HA       GLU  61  -4.754   0.232   5.710
  467    HB2  GLU  61           1HB      GLU  61  -7.276   0.423   5.652
  468    HB3  GLU  61           2HB      GLU  61  -6.684  -0.818   6.751
  469    HG2  GLU  61           1HG      GLU  61  -6.939   0.748   8.667
  470    HG3  GLU  61           2HG      GLU  61  -7.537   1.991   7.572
  471    H    ASN  62           H        ASN  62  -4.968   2.925   7.815
  472    HA   ASN  62           HA       ASN  62  -6.139   4.876   6.129
  473    HB2  ASN  62           1HB      ASN  62  -5.787   5.157   8.571
  474    HB3  ASN  62           2HB      ASN  62  -4.056   5.270   8.302
  475   HD21  ASN  62          2HD2      ASN  62  -3.865   7.479   9.011
  476   HD22  ASN  62          1HD2      ASN  62  -4.555   8.769   8.150
  477    H    ARG  63           H        ARG  63  -2.719   3.884   6.469
  478    HA   ARG  63           HA       ARG  63  -1.836   5.845   4.472
  479    HB2  ARG  63           1HB      ARG  63  -0.492   5.171   6.540
  480    HB3  ARG  63           2HB      ARG  63  -0.171   3.630   5.753
  481    HG2  ARG  63           1HG      ARG  63   0.925   4.817   3.861
  482    HG3  ARG  63           2HG      ARG  63   0.561   6.367   4.608
  483    HD2  ARG  63           1HD      ARG  63   2.304   4.201   5.822
  484    HD3  ARG  63           2HD      ARG  63   2.903   5.655   5.031
  485    HE   ARG  63           HE       ARG  63   1.113   6.435   7.061
  486   HH11  ARG  63          1HH2      ARG  63   4.228   4.945   6.673
  487   HH12  ARG  63          2HH2      ARG  63   4.829   5.497   8.201
  488   HH21  ARG  63          1HH1      ARG  63   1.902   7.150   9.054
  489   HH22  ARG  63          2HH1      ARG  63   3.512   6.743   9.548
  490    H    VAL  64           H        VAL  64  -3.331   2.887   4.264
  491    HA   VAL  64           HA       VAL  64  -1.979   2.137   1.704
  492    HB   VAL  64           HB       VAL  64  -3.743   0.393   3.474
  493   HG11  VAL  64          1HG1      VAL  64  -1.923  -0.272   1.117
  494   HG12  VAL  64          2HG1      VAL  64  -3.681  -0.297   1.083
  495   HG13  VAL  64          3HG1      VAL  64  -2.812  -1.451   2.082
  496   HG21  VAL  64          3HG2      VAL  64  -1.636   0.984   4.643
  497   HG22  VAL  64          1HG2      VAL  64  -0.706   0.499   3.225
  498   HG23  VAL  64          2HG2      VAL  64  -1.611  -0.704   4.144
  499    H    LEU  65           H        LEU  65  -3.137   2.079  -0.137
  500    HA   LEU  65           HA       LEU  65  -6.096   2.496  -0.069
  501    HB2  LEU  65           1HB      LEU  65  -5.898   4.149  -1.883
  502    HB3  LEU  65           2HB      LEU  65  -5.095   4.700  -0.423
  503    HG   LEU  65           HG       LEU  65  -3.185   3.232  -2.193
  504   HD11  LEU  65          1HD1      LEU  65  -4.468   4.057  -4.051
  505   HD12  LEU  65          2HD1      LEU  65  -3.038   5.075  -3.924
  506   HD13  LEU  65          3HD1      LEU  65  -4.593   5.668  -3.347
  507   HD21  LEU  65          3HD2      LEU  65  -3.189   6.111  -1.167
  508   HD22  LEU  65          1HD2      LEU  65  -1.796   5.234  -1.809
  509   HD23  LEU  65          2HD2      LEU  65  -2.534   4.727  -0.291
  510    H    LYS  66           H        LYS  66  -7.194   1.853  -1.962
  511    HA   LYS  66           HA       LYS  66  -6.219  -0.607  -3.062
  512    HB2  LYS  66           1HB      LYS  66  -8.363  -0.555  -4.357
  513    HB3  LYS  66           2HB      LYS  66  -8.588  -0.306  -2.627
  514    HG2  LYS  66           1HG      LYS  66  -8.837   2.114  -2.944
  515    HG3  LYS  66           2HG      LYS  66  -8.454   1.971  -4.656
  516    HD2  LYS  66           1HD      LYS  66 -10.878   2.187  -4.400
  517    HD3  LYS  66           2HD      LYS  66 -10.503   0.570  -4.985
  518    HE2  LYS  66           1HE      LYS  66 -10.979  -0.410  -2.823
  519    HE3  LYS  66           2HE      LYS  66 -10.933   1.163  -2.020
  520    HZ1  LYS  66           3HZ      LYS  66 -12.906   0.427  -4.112
  521    HZ2  LYS  66           1HZ      LYS  66 -12.917   1.810  -3.129
  522    HZ3  LYS  66           2HZ      LYS  66 -13.193   0.280  -2.444
  523    H    TYR  67           H        TYR  67  -5.688  -1.096  -5.186
  524    HA   TYR  67           HA       TYR  67  -4.367   1.050  -6.681
  525    HB2  TYR  67           1HB      TYR  67  -3.280  -1.165  -6.360
  526    HB3  TYR  67           2HB      TYR  67  -4.586  -1.941  -7.249
  527    HD1  TYR  67           HD2      TYR  67  -4.851  -1.559  -9.719
  528    HD2  TYR  67           HD1      TYR  67  -1.580   0.218  -7.541
  529    HE1  TYR  67           HE2      TYR  67  -3.704  -1.029 -11.853
  530    HE2  TYR  67           HE1      TYR  67  -0.450   0.745  -9.685
  531    HH   TYR  67           HH       TYR  67  -0.435   0.019 -11.981
  532    H    ASN  68           H        ASN  68  -5.455   2.194  -8.127
  533    HA   ASN  68           HA       ASN  68  -7.251   0.920 -10.063
  534    HB2  ASN  68           1HB      ASN  68  -9.147   2.464  -9.540
  535    HB3  ASN  68           2HB      ASN  68  -8.806   1.348  -8.220
  536   HD21  ASN  68          2HD2      ASN  68 -10.027   3.195  -7.001
  537   HD22  ASN  68          1HD2      ASN  68  -9.068   4.456  -6.391
  538    H    ASP  69           H        ASP  69  -7.613   2.168 -11.890
  539    HA   ASP  69           HA       ASP  69  -5.571   3.736 -12.831
  540    HB2  ASP  69           1HB      ASP  69  -8.488   3.952 -13.646
  541    HB3  ASP  69           2HB      ASP  69  -7.101   4.442 -14.619
  542    H    ASP  70           H        ASP  70  -8.051   4.711 -10.641
  543    HA   ASP  70           HA       ASP  70  -7.926   7.556 -11.157
  544    HB2  ASP  70           1HB      ASP  70  -9.909   6.435 -10.138
  545    HB3  ASP  70           2HB      ASP  70  -8.961   6.095  -8.693
  546    H    ASN  71           H        ASN  71  -6.623   5.442  -8.575
  547    HA   ASN  71           HA       ASN  71  -5.173   7.528  -7.241
  548    HB2  ASN  71           1HB      ASN  71  -4.794   4.513  -7.184
  549    HB3  ASN  71           2HB      ASN  71  -3.986   5.650  -6.109
  550   HD21  ASN  71          2HD2      ASN  71  -6.139   7.441  -5.570
  551   HD22  ASN  71          1HD2      ASN  71  -7.329   6.597  -4.701
  552    H    VAL  72           H        VAL  72  -4.479   5.397  -9.913
  553    HA   VAL  72           HA       VAL  72  -1.644   5.902 -10.084
  554    HB   VAL  72           HB       VAL  72  -3.641   5.069 -12.226
  555   HG11  VAL  72          1HG1      VAL  72  -0.594   5.042 -12.278
  556   HG12  VAL  72          2HG1      VAL  72  -1.641   6.000 -13.324
  557   HG13  VAL  72          3HG1      VAL  72  -1.613   4.251 -13.482
  558   HG21  VAL  72          3HG2      VAL  72  -1.679   3.422 -10.576
  559   HG22  VAL  72          1HG2      VAL  72  -2.754   2.787 -11.823
  560   HG23  VAL  72          2HG2      VAL  72  -3.424   3.454 -10.338
  561    H    LYS  73           H        LYS  73  -4.544   7.356 -11.500
  562    HA   LYS  73           HA       LYS  73  -3.344   9.292 -13.154
  563    HB2  LYS  73           1HB      LYS  73  -5.761   8.660 -13.187
  564    HB3  LYS  73           2HB      LYS  73  -5.985   9.492 -11.662
  565    HG2  LYS  73           1HG      LYS  73  -5.297  11.638 -12.716
  566    HG3  LYS  73           2HG      LYS  73  -5.080  10.798 -14.253
  567    HD2  LYS  73           1HD      LYS  73  -7.487  10.163 -14.245
  568    HD3  LYS  73           2HD      LYS  73  -7.702  10.998 -12.706
  569    HE2  LYS  73           1HE      LYS  73  -8.455  12.431 -14.563
  570    HE3  LYS  73           2HE      LYS  73  -7.030  13.139 -13.799
  571    HZ1  LYS  73           3HZ      LYS  73  -6.670  11.297 -16.053
  572    HZ2  LYS  73           1HZ      LYS  73  -5.710  12.609 -15.569
  573    HZ3  LYS  73           2HZ      LYS  73  -7.181  12.885 -16.373
  574    H    ARG  74           H        ARG  74  -4.171   9.361  -9.703
  575    HA   ARG  74           HA       ARG  74  -3.553  12.093  -9.222
  576    HB2  ARG  74           1HB      ARG  74  -3.537   9.681  -7.362
  577    HB3  ARG  74           2HB      ARG  74  -3.268  11.330  -6.798
  578    HG2  ARG  74           1HG      ARG  74  -5.492  11.998  -7.691
  579    HG3  ARG  74           2HG      ARG  74  -5.765  10.347  -8.235
  580    HD2  ARG  74           1HD      ARG  74  -5.613   9.550  -5.883
  581    HD3  ARG  74           2HD      ARG  74  -5.357  11.211  -5.348
  582    HE   ARG  74           HE       ARG  74  -7.718  11.148  -6.882
  583   HH11  ARG  74          1HH2      ARG  74  -6.495   9.942  -3.857
  584   HH12  ARG  74          2HH2      ARG  74  -8.051   9.915  -3.096
  585   HH21  ARG  74          1HH1      ARG  74  -9.736  11.109  -5.878
  586   HH22  ARG  74          2HH1      ARG  74  -9.880  10.574  -4.236
  587    H    ARG  75           H        ARG  75  -1.565   9.153  -9.208
  588    HA   ARG  75           HA       ARG  75   0.837  10.380  -8.245
  589    HB2  ARG  75           1HB      ARG  75   0.487   7.910  -8.288
  590    HB3  ARG  75           2HB      ARG  75   0.565   7.937 -10.048
  591    HG2  ARG  75           1HG      ARG  75   2.891   8.783  -9.961
  592    HG3  ARG  75           2HG      ARG  75   2.814   8.858  -8.202
  593    HD2  ARG  75           1HD      ARG  75   3.990   6.815  -8.902
  594    HD3  ARG  75           2HD      ARG  75   2.457   6.383  -8.141
  595    HE   ARG  75           HE       ARG  75   2.091   6.658 -10.946
  596   HH11  ARG  75          1HH2      ARG  75   3.580   4.558  -8.604
  597   HH12  ARG  75          2HH2      ARG  75   3.433   3.143  -9.593
  598   HH21  ARG  75          1HH1      ARG  75   1.911   4.808 -12.223
  599   HH22  ARG  75          2HH1      ARG  75   2.492   3.285 -11.637
  600    H    GLN  76           H        GLN  76  -0.525   9.862 -11.465
  601    HA   GLN  76           HA       GLN  76   1.651  10.987 -12.959
  602    HB2  GLN  76           1HB      GLN  76  -1.296  10.637 -13.634
  603    HB3  GLN  76           2HB      GLN  76  -0.085  11.181 -14.799
  604    HG2  GLN  76           1HG      GLN  76   1.178   9.074 -14.487
  605    HG3  GLN  76           2HG      GLN  76  -0.009   8.525 -13.309
  606   HE21  GLN  76          2HE2      GLN  76   0.800   8.307 -16.575
  607   HE22  GLN  76          1HE2      GLN  76  -0.714   7.836 -17.182
  608    H    GLU  77           H        GLU  77  -1.262  12.266 -11.452
  609    HA   GLU  77           HA       GLU  77  -1.101  14.924 -12.512
  610    HB2  GLU  77           1HB      GLU  77  -3.135  13.859 -11.378
  611    HB3  GLU  77           2HB      GLU  77  -2.313  14.092  -9.840
  612    HG2  GLU  77           1HG      GLU  77  -3.809  15.981 -10.133
  613    HG3  GLU  77           2HG      GLU  77  -2.175  16.584 -10.374
  614    H    LEU  78           H        LEU  78  -0.075  13.484  -9.430
  615    HA   LEU  78           HA       LEU  78   1.222  15.752  -8.345
  616    HB2  LEU  78           1HB      LEU  78   1.565  12.772  -7.892
  617    HB3  LEU  78           2HB      LEU  78   2.397  13.967  -6.909
  618    HG   LEU  78           HG       LEU  78  -0.655  14.068  -7.169
  619   HD11  LEU  78          1HD1      LEU  78   0.901  12.444  -5.114
  620   HD12  LEU  78          2HD1      LEU  78  -0.104  11.775  -6.398
  621   HD13  LEU  78          3HD1      LEU  78  -0.844  12.711  -5.103
  622   HD21  LEU  78          3HD2      LEU  78   1.269  14.951  -4.954
  623   HD22  LEU  78          1HD2      LEU  78  -0.483  15.160  -4.922
  624   HD23  LEU  78          2HD2      LEU  78   0.482  16.029  -6.103
  625    H    ALA  79           H        ALA  79   2.320  13.148 -10.446
  626    HA   ALA  79           HA       ALA  79   5.097  13.694 -10.378
  627    HB1  ALA  79           3HB      ALA  79   3.476  12.584 -12.686
  628    HB2  ALA  79           1HB      ALA  79   4.155  11.636 -11.363
  629    HB3  ALA  79           2HB      ALA  79   5.224  12.459 -12.502
  630    H    ARG  80           H        ARG  80   2.501  15.078 -12.356
  631    HA   ARG  80           HA       ARG  80   4.155  16.698 -14.027
  632    HB2  ARG  80           1HB      ARG  80   1.249  16.999 -13.186
  633    HB3  ARG  80           2HB      ARG  80   2.007  17.996 -14.418
  634    HG2  ARG  80           1HG      ARG  80   2.169  14.965 -14.732
  635    HG3  ARG  80           2HG      ARG  80   0.645  15.756 -15.110
  636    HD2  ARG  80           1HD      ARG  80   3.315  16.515 -16.339
  637    HD3  ARG  80           2HD      ARG  80   2.112  15.485 -17.115
  638    HE   ARG  80           HE       ARG  80   2.016  18.368 -16.865
  639   HH11  ARG  80          1HH2      ARG  80   0.104  15.476 -17.163
  640   HH12  ARG  80          2HH2      ARG  80  -1.291  16.303 -17.771
  641   HH21  ARG  80          1HH1      ARG  80   0.177  19.439 -17.653
  642   HH22  ARG  80          2HH1      ARG  80  -1.251  18.541 -18.047
  643    H    GLN  81           H        GLN  81   2.534  17.278 -10.920
  644    HA   GLN  81           HA       GLN  81   3.259  20.013 -10.621
  645    HB2  GLN  81           1HB      GLN  81   2.619  17.871  -8.556
  646    HB3  GLN  81           2HB      GLN  81   2.761  19.591  -8.182
  647    HG2  GLN  81           1HG      GLN  81   0.907  20.093  -9.744
  648    HG3  GLN  81           2HG      GLN  81   0.769  18.385 -10.148
  649   HE21  GLN  81          2HE2      GLN  81  -1.132  17.665  -9.144
  650   HE22  GLN  81          1HE2      GLN  81  -1.541  17.970  -7.524
  651    H    CYS  82           H        CYS  82   4.823  16.977  -9.645
  652    HA   CYS  82           HA       CYS  82   6.947  18.066  -8.145
  653    HB2  CYS  82           1HB      CYS  82   6.273  15.684  -8.133
  654    HB3  CYS  82           2HB      CYS  82   6.894  15.501  -9.770
  655    HG   CYS  82           HG       CYS  82   9.295  16.180  -8.776
  656    H    GLY  83           H        GLY  83   6.589  17.427 -11.605
  657    HA2  GLY  83           1HA      GLY  83   9.256  17.883 -12.403
  658    HA3  GLY  83           2HA      GLY  83   7.833  18.045 -13.427
  659    H    GLU  84           H        GLU  84   6.501  20.086 -12.007
  660    HA   GLU  84           HA       GLU  84   6.318  22.357 -11.955
  661    HB2  GLU  84           1HB      GLU  84   7.865  22.024 -10.037
  662    HB3  GLU  84           2HB      GLU  84   9.238  22.230 -11.113
  663    HG2  GLU  84           1HG      GLU  84   8.499  24.541 -11.638
  664    HG3  GLU  84           2HG      GLU  84   7.093  24.329 -10.600
  665    H    ARG  85           H        ARG  85   9.704  22.292 -12.931
  666    HA   ARG  85           HA       ARG  85   9.418  24.243 -14.960
  667    HB2  ARG  85           1HB      ARG  85  11.550  23.617 -13.768
  668    HB3  ARG  85           2HB      ARG  85  11.613  22.140 -14.726
  669    HG2  ARG  85           1HG      ARG  85  11.679  23.508 -16.812
  670    HG3  ARG  85           2HG      ARG  85  11.622  24.980 -15.841
  671    HD2  ARG  85           1HD      ARG  85  13.943  24.494 -16.490
  672    HD3  ARG  85           2HD      ARG  85  13.763  24.308 -14.745
  673    HE   ARG  85           HE       ARG  85  13.299  21.813 -16.019
  674   HH11  ARG  85          1HH2      ARG  85  15.861  24.058 -15.326
  675   HH12  ARG  85          2HH2      ARG  85  17.093  22.841 -15.288
  676   HH21  ARG  85          1HH1      ARG  85  14.906  20.234 -15.967
  677   HH22  ARG  85          2HH1      ARG  85  16.551  20.676 -15.651
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1 -18.543 -20.133   9.656
    2    H2   MET   1           2H       MET   1 -18.662 -19.805   7.993
    3    H3   MET   1           3H       MET   1 -17.977 -18.657   9.040
    4    HA   MET   1           HA       MET   1 -16.077 -19.546   8.189
    5    HB2  MET   1           1HB      MET   1 -16.869 -21.414  10.456
    6    HB3  MET   1           2HB      MET   1 -15.225 -21.241   9.844
    7    HG2  MET   1           1HG      MET   1 -15.255 -18.831  10.441
    8    HG3  MET   1           2HG      MET   1 -16.891 -19.005  11.075
    9    HE1  MET   1           3HE      MET   1 -17.345 -19.491  13.547
   10    HE2  MET   1           1HE      MET   1 -16.566 -20.858  14.350
   11    HE3  MET   1           2HE      MET   1 -17.407 -21.094  12.824
   12    H    ASN   2           H        ASN   2 -18.678 -20.836   7.106
   13    HA   ASN   2           HA       ASN   2 -18.146 -23.577   6.538
   14    HB2  ASN   2           1HB      ASN   2 -19.838 -21.572   4.993
   15    HB3  ASN   2           2HB      ASN   2 -19.919 -23.327   4.835
   16   HD21  ASN   2          2HD2      ASN   2 -19.625 -23.858   7.737
   17   HD22  ASN   2          1HD2      ASN   2 -21.082 -23.369   8.457
   18    H    TYR   3           H        TYR   3 -17.745 -24.416   4.317
   19    HA   TYR   3           HA       TYR   3 -15.272 -23.506   3.278
   20    HB2  TYR   3           1HB      TYR   3 -16.059 -25.841   3.056
   21    HB3  TYR   3           2HB      TYR   3 -17.349 -25.316   1.984
   22    HD1  TYR   3           HD1      TYR   3 -13.604 -25.317   2.369
   23    HD2  TYR   3           HD2      TYR   3 -16.895 -25.096  -0.417
   24    HE1  TYR   3           HE1      TYR   3 -12.021 -25.443   0.466
   25    HE2  TYR   3           HE2      TYR   3 -15.291 -25.226  -2.304
   26    HH   TYR   3           HH       TYR   3 -11.854 -25.804  -1.763
   27    H    SER   4           H        SER   4 -18.598 -23.099   2.087
   28    HA   SER   4           HA       SER   4 -19.517 -21.716   0.499
   29    HB2  SER   4           1HB      SER   4 -17.236 -19.899   1.346
   30    HB3  SER   4           2HB      SER   4 -18.704 -19.390   0.511
   31    HG   SER   4           HG       SER   4 -18.811 -20.835   2.936
   32    H    THR   5           H        THR   5 -18.506 -19.942  -1.326
   33    HA   THR   5           HA       THR   5 -17.586 -21.607  -3.415
   34    HB   THR   5           HB       THR   5 -17.387 -18.568  -3.270
   35    HG1  THR   5           HG1      THR   5 -19.476 -19.727  -2.777
   36   HG21  THR   5          3HG2      THR   5 -16.258 -19.568  -5.234
   37   HG22  THR   5          1HG2      THR   5 -17.724 -18.722  -5.726
   38   HG23  THR   5          2HG2      THR   5 -17.717 -20.479  -5.618
   39    H    GLY   6           H        GLY   6 -15.884 -19.253  -1.381
   40    HA2  GLY   6           1HA      GLY   6 -13.407 -20.655  -1.413
   41    HA3  GLY   6           2HA      GLY   6 -13.356 -19.332  -2.576
   42    H    THR   7           H        THR   7 -11.598 -18.688  -1.060
   43    HA   THR   7           HA       THR   7 -12.103 -17.781   1.580
   44    HB   THR   7           HB       THR   7  -9.815 -18.172   0.874
   45    HG1  THR   7           HG1      THR   7 -10.689 -15.767   1.777
   46   HG21  THR   7          3HG2      THR   7 -10.072 -17.657  -1.540
   47   HG22  THR   7          1HG2      THR   7  -8.722 -16.766  -0.842
   48   HG23  THR   7          2HG2      THR   7 -10.244 -15.944  -1.160
   49    H    ASP   8           H        ASP   8 -12.359 -15.668   2.376
   50    HA   ASP   8           HA       ASP   8 -12.824 -13.383   0.684
   51    HB2  ASP   8           1HB      ASP   8 -15.254 -13.152   1.167
   52    HB3  ASP   8           2HB      ASP   8 -14.911 -14.592   0.210
   53    H    ALA   9           H        ALA   9 -11.205 -12.728   2.235
   54    HA   ALA   9           HA       ALA   9 -11.640 -12.546   5.028
   55    HB1  ALA   9           3HB      ALA   9  -9.921 -10.803   3.224
   56    HB2  ALA   9           1HB      ALA   9  -9.416 -12.317   3.973
   57    HB3  ALA   9           2HB      ALA   9  -9.778 -10.914   4.980
   58    H    ASN  10           H        ASN  10 -12.342 -10.826   6.316
   59    HA   ASN  10           HA       ASN  10 -14.538  -9.292   5.367
   60    HB2  ASN  10           1HB      ASN  10 -14.289 -10.001   7.728
   61    HB3  ASN  10           2HB      ASN  10 -12.892  -8.945   7.904
   62   HD21  ASN  10          2HD2      ASN  10 -16.344  -8.722   6.847
   63   HD22  ASN  10          1HD2      ASN  10 -16.614  -7.206   7.562
   64    H    THR  11           H        THR  11 -11.131  -8.487   5.962
   65    HA   THR  11           HA       THR  11 -11.339  -5.680   5.518
   66    HB   THR  11           HB       THR  11  -8.879  -5.773   5.238
   67    HG1  THR  11           HG1      THR  11  -8.327  -8.260   5.672
   68   HG21  THR  11          3HG2      THR  11  -8.329  -6.848   7.406
   69   HG22  THR  11          1HG2      THR  11  -9.910  -7.627   7.421
   70   HG23  THR  11          2HG2      THR  11  -9.793  -5.869   7.531
   71    H    LEU  12           H        LEU  12 -10.676  -4.483   3.685
   72    HA   LEU  12           HA       LEU  12 -11.543  -5.625   1.134
   73    HB2  LEU  12           1HB      LEU  12 -10.466  -2.829   1.704
   74    HB3  LEU  12           2HB      LEU  12 -11.435  -3.337   0.321
   75    HG   LEU  12           HG       LEU  12 -12.366  -3.262   3.228
   76   HD11  LEU  12          1HD1      LEU  12 -13.826  -1.415   2.476
   77   HD12  LEU  12          2HD1      LEU  12 -13.137  -1.524   0.856
   78   HD13  LEU  12          3HD1      LEU  12 -12.127  -1.020   2.210
   79   HD21  LEU  12          3HD2      LEU  12 -13.797  -4.155   0.683
   80   HD22  LEU  12          1HD2      LEU  12 -14.678  -3.667   2.135
   81   HD23  LEU  12          2HD2      LEU  12 -13.603  -5.049   2.194
   82    H    PHE  13           H        PHE  13  -8.631  -5.439   2.801
   83    HA   PHE  13           HA       PHE  13  -6.930  -5.364   0.359
   84    HB2  PHE  13           1HB      PHE  13  -6.225  -5.232   3.316
   85    HB3  PHE  13           2HB      PHE  13  -5.079  -5.088   1.982
   86    HD1  PHE  13           HD2      PHE  13  -8.000  -3.469   3.657
   87    HD2  PHE  13           HD1      PHE  13  -4.947  -3.014   0.641
   88    HE1  PHE  13           HE2      PHE  13  -8.564  -1.066   3.439
   89    HE2  PHE  13           HE1      PHE  13  -5.529  -0.612   0.430
   90    HZ   PHE  13           HZ       PHE  13  -7.328   0.362   1.829
   91    H    VAL  14           H        VAL  14  -6.006  -7.146  -0.396
   92    HA   VAL  14           HA       VAL  14  -5.996  -9.677   1.226
   93    HB   VAL  14           HB       VAL  14  -6.440  -9.404  -1.774
   94   HG11  VAL  14          1HG1      VAL  14  -7.055 -11.827  -1.614
   95   HG12  VAL  14          2HG1      VAL  14  -6.587 -11.812   0.086
   96   HG13  VAL  14          3HG1      VAL  14  -5.375 -11.551  -1.164
   97   HG21  VAL  14          3HG2      VAL  14  -8.421 -10.028   0.458
   98   HG22  VAL  14          1HG2      VAL  14  -8.782 -10.079  -1.268
   99   HG23  VAL  14          2HG2      VAL  14  -8.388  -8.546  -0.498
  100    H    ASP  15           H        ASP  15  -4.155 -10.873   1.175
  101    HA   ASP  15           HA       ASP  15  -1.683  -9.665   0.572
  102    HB2  ASP  15           1HB      ASP  15  -0.717 -11.915   1.017
  103    HB3  ASP  15           2HB      ASP  15  -1.899 -11.453   2.239
  104    H    GLY  16           H        GLY  16  -0.290  -9.818  -1.123
  105    HA2  GLY  16           1HA      GLY  16   0.630 -10.571  -3.144
  106    HA3  GLY  16           2HA      GLY  16  -0.779 -11.582  -3.427
  107    H    GLU  17           H        GLU  17  -2.089  -8.774  -2.510
  108    HA   GLU  17           HA       GLU  17  -2.669  -7.917  -5.261
  109    HB2  GLU  17           1HB      GLU  17  -4.486  -8.209  -3.574
  110    HB3  GLU  17           2HB      GLU  17  -3.790  -6.905  -2.620
  111    HG2  GLU  17           1HG      GLU  17  -4.169  -5.304  -4.438
  112    HG3  GLU  17           2HG      GLU  17  -4.746  -6.585  -5.493
  113    H    ARG  18           H        ARG  18  -2.285  -5.901  -6.075
  114    HA   ARG  18           HA       ARG  18   0.067  -4.508  -5.186
  115    HB2  ARG  18           1HB      ARG  18  -2.005  -4.046  -7.364
  116    HB3  ARG  18           2HB      ARG  18  -0.857  -2.764  -6.994
  117    HG2  ARG  18           1HG      ARG  18   0.061  -4.048  -8.824
  118    HG3  ARG  18           2HG      ARG  18   1.026  -4.417  -7.410
  119    HD2  ARG  18           1HD      ARG  18  -0.221  -6.524  -7.094
  120    HD3  ARG  18           2HD      ARG  18  -1.246  -6.135  -8.476
  121    HE   ARG  18           HE       ARG  18   1.386  -6.053  -9.397
  122   HH11  ARG  18          1HH2      ARG  18  -0.790  -8.371  -7.986
  123   HH12  ARG  18          2HH2      ARG  18  -0.062  -9.731  -8.773
  124   HH21  ARG  18          1HH1      ARG  18   2.334  -7.837 -10.421
  125   HH22  ARG  18          2HH1      ARG  18   1.705  -9.428 -10.151
  126    H    VAL  19           H        VAL  19   0.213  -2.449  -4.293
  127    HA   VAL  19           HA       VAL  19  -2.161  -0.977  -3.480
  128    HB   VAL  19           HB       VAL  19  -1.799  -2.872  -1.785
  129   HG11  VAL  19          1HG1      VAL  19   0.450  -1.107  -0.754
  130   HG12  VAL  19          2HG1      VAL  19   0.687  -2.622  -1.601
  131   HG13  VAL  19          3HG1      VAL  19  -0.118  -2.608  -0.049
  132   HG21  VAL  19          3HG2      VAL  19  -1.850  -0.062  -0.666
  133   HG22  VAL  19          1HG2      VAL  19  -2.433  -1.522   0.141
  134   HG23  VAL  19          2HG2      VAL  19  -3.247  -0.939  -1.303
  135    H    LEU  20           H        LEU  20  -1.728   1.102  -2.788
  136    HA   LEU  20           HA       LEU  20   1.008   2.097  -3.422
  137    HB2  LEU  20           1HB      LEU  20  -1.644   3.587  -3.314
  138    HB3  LEU  20           2HB      LEU  20  -0.104   4.211  -3.898
  139    HG   LEU  20           HG       LEU  20  -1.666   1.910  -5.147
  140   HD11  LEU  20          1HD1      LEU  20  -2.070   3.489  -7.013
  141   HD12  LEU  20          2HD1      LEU  20  -1.253   4.761  -6.102
  142   HD13  LEU  20          3HD1      LEU  20  -2.757   4.070  -5.498
  143   HD21  LEU  20          3HD2      LEU  20   0.607   1.450  -5.689
  144   HD22  LEU  20          1HD2      LEU  20   1.024   3.157  -5.857
  145   HD23  LEU  20          2HD2      LEU  20   0.047   2.350  -7.087
  146    H    CYS  21           H        CYS  21   2.179   3.103  -1.936
  147    HA   CYS  21           HA       CYS  21   1.007   3.677   0.761
  148    HB2  CYS  21           1HB      CYS  21   2.497   1.697   0.735
  149    HB3  CYS  21           2HB      CYS  21   3.800   2.689   0.075
  150    HG   CYS  21           HG       CYS  21   3.269   4.189   2.400
  151    H    PHE  22           H        PHE  22   0.878   5.821   0.962
  152    HA   PHE  22           HA       PHE  22   2.904   7.612  -0.269
  153    HB2  PHE  22           1HB      PHE  22   1.298   9.408   0.237
  154    HB3  PHE  22           2HB      PHE  22   0.542   8.137  -0.719
  155    HD1  PHE  22           HD2      PHE  22   0.715   9.698   2.654
  156    HD2  PHE  22           HD1      PHE  22  -1.186   6.644   0.276
  157    HE1  PHE  22           HE2      PHE  22  -1.023   9.412   4.398
  158    HE2  PHE  22           HE1      PHE  22  -2.920   6.368   2.028
  159    HZ   PHE  22           HZ       PHE  22  -2.842   7.755   4.084
  160    H    HIS  23           H        HIS  23   3.914   9.225   0.987
  161    HA   HIS  23           HA       HIS  23   3.711   9.324   3.864
  162    HB2  HIS  23           1HB      HIS  23   6.024   8.479   4.321
  163    HB3  HIS  23           2HB      HIS  23   4.966   7.215   3.694
  164    HD1  HIS  23           HD1      HIS  23   7.505   9.723   2.332
  165    HD2  HIS  23           HD2      HIS  23   6.012   5.921   1.493
  166    HE1  HIS  23           HE1      HIS  23   8.843   8.844   0.369
  167    HE2  HIS  23           HE2      HIS  23   7.944   6.528  -0.154
  168    H    GLY  24           H        GLY  24   3.851  10.955   1.318
  169    HA2  GLY  24           1HA      GLY  24   5.121  13.254   2.382
  170    HA3  GLY  24           2HA      GLY  24   6.203  12.469   1.242
  171    HA   PRO  25           HA       PRO  25   3.345  15.160  -1.245
  172    HB2  PRO  25           1HB      PRO  25   5.122  16.466  -2.811
  173    HB3  PRO  25           2HB      PRO  25   4.952  16.882  -1.089
  174    HG2  PRO  25           1HG      PRO  25   7.030  15.124  -2.395
  175    HG3  PRO  25           2HG      PRO  25   7.265  16.430  -1.210
  176    HD2  PRO  25           1HD      PRO  25   7.147  13.746  -0.493
  177    HD3  PRO  25           2HD      PRO  25   6.663  15.048   0.620
  178    H    LEU  26           H        LEU  26   5.038  12.411  -1.855
  179    HA   LEU  26           HA       LEU  26   3.818  12.064  -4.553
  180    HB2  LEU  26           1HB      LEU  26   6.684  11.521  -3.741
  181    HB3  LEU  26           2HB      LEU  26   5.971  10.655  -5.096
  182    HG   LEU  26           HG       LEU  26   5.940  13.723  -5.005
  183   HD11  LEU  26          1HD1      LEU  26   8.301  13.013  -4.812
  184   HD12  LEU  26          2HD1      LEU  26   7.993  13.697  -6.405
  185   HD13  LEU  26          3HD1      LEU  26   8.103  11.945  -6.203
  186   HD21  LEU  26          3HD2      LEU  26   5.782  13.461  -7.498
  187   HD22  LEU  26          1HD2      LEU  26   4.450  12.635  -6.708
  188   HD23  LEU  26          2HD2      LEU  26   5.814  11.710  -7.313
  189    H    ILE  27           H        ILE  27   3.304   9.998  -5.136
  190    HA   ILE  27           HA       ILE  27   2.781   8.126  -2.885
  191    HB   ILE  27           HB       ILE  27   1.587   8.231  -5.691
  192   HG12  ILE  27          1HG1      ILE  27   0.353   9.084  -3.026
  193   HG13  ILE  27          2HG1      ILE  27   1.005  10.217  -4.202
  194   HG21  ILE  27          1HG2      ILE  27   0.808   6.619  -3.225
  195   HG22  ILE  27          2HG2      ILE  27   1.511   5.954  -4.698
  196   HG23  ILE  27          3HG2      ILE  27  -0.098   6.646  -4.735
  197   HD11  ILE  27          3HD1      ILE  27  -1.402  10.078  -4.491
  198   HD12  ILE  27          1HD1      ILE  27  -1.325   8.325  -4.648
  199   HD13  ILE  27          2HD1      ILE  27  -0.621   9.356  -5.895
  200    H    TYR  28           H        TYR  28   3.868   6.273  -2.757
  201    HA   TYR  28           HA       TYR  28   5.624   5.355  -4.998
  202    HB2  TYR  28           1HB      TYR  28   5.747   4.838  -1.999
  203    HB3  TYR  28           2HB      TYR  28   6.916   4.263  -3.193
  204    HD1  TYR  28           HD1      TYR  28   5.556   7.287  -1.483
  205    HD2  TYR  28           HD2      TYR  28   8.518   5.832  -4.264
  206    HE1  TYR  28           HE1      TYR  28   6.727   9.471  -1.396
  207    HE2  TYR  28           HE2      TYR  28   9.680   8.021  -4.156
  208    HH   TYR  28           HH       TYR  28   8.440  10.721  -3.250
  209    H    GLU  29           H        GLU  29   5.722   3.144  -5.468
  210    HA   GLU  29           HA       GLU  29   3.193   1.702  -5.173
  211    HB2  GLU  29           1HB      GLU  29   4.430   1.825  -7.335
  212    HB3  GLU  29           2HB      GLU  29   5.751   0.903  -6.626
  213    HG2  GLU  29           1HG      GLU  29   4.230  -1.019  -6.242
  214    HG3  GLU  29           2HG      GLU  29   2.875  -0.088  -6.870
  215    H    ALA  30           H        ALA  30   2.898  -0.242  -4.134
  216    HA   ALA  30           HA       ALA  30   5.069  -1.657  -2.778
  217    HB1  ALA  30           3HB      ALA  30   2.793  -0.372  -1.218
  218    HB2  ALA  30           1HB      ALA  30   4.484   0.127  -1.160
  219    HB3  ALA  30           2HB      ALA  30   4.013  -1.460  -0.552
  220    H    LYS  31           H        LYS  31   3.956  -3.503  -1.424
  221    HA   LYS  31           HA       LYS  31   1.475  -4.538  -2.661
  222    HB2  LYS  31           1HB      LYS  31   3.256  -5.256  -4.189
  223    HB3  LYS  31           2HB      LYS  31   4.128  -5.955  -2.849
  224    HG2  LYS  31           1HG      LYS  31   2.350  -7.614  -2.469
  225    HG3  LYS  31           2HG      LYS  31   1.328  -6.818  -3.658
  226    HD2  LYS  31           1HD      LYS  31   2.267  -8.786  -4.717
  227    HD3  LYS  31           2HD      LYS  31   3.053  -7.385  -5.433
  228    HE2  LYS  31           1HE      LYS  31   5.067  -7.780  -4.106
  229    HE3  LYS  31           2HE      LYS  31   4.252  -9.027  -3.157
  230    HZ1  LYS  31           3HZ      LYS  31   3.918  -9.736  -5.796
  231    HZ2  LYS  31           1HZ      LYS  31   4.950 -10.467  -4.665
  232    HZ3  LYS  31           2HZ      LYS  31   5.536  -9.232  -5.674
  233    H    VAL  32           H        VAL  32   0.388  -5.914  -1.400
  234    HA   VAL  32           HA       VAL  32   1.190  -6.103   1.410
  235    HB   VAL  32           HB       VAL  32  -1.343  -7.212   0.107
  236   HG11  VAL  32          1HG1      VAL  32  -0.868  -8.073   2.392
  237   HG12  VAL  32          2HG1      VAL  32  -2.263  -7.000   2.413
  238   HG13  VAL  32          3HG1      VAL  32  -0.698  -6.420   2.985
  239   HG21  VAL  32          3HG2      VAL  32  -1.154  -4.794  -0.369
  240   HG22  VAL  32          1HG2      VAL  32  -0.873  -4.471   1.343
  241   HG23  VAL  32          2HG2      VAL  32  -2.431  -5.095   0.803
  242    H    LEU  33           H        LEU  33   2.287  -7.833   2.179
  243    HA   LEU  33           HA       LEU  33   2.370 -10.348   0.624
  244    HB2  LEU  33           1HB      LEU  33   4.528  -9.381   1.359
  245    HB3  LEU  33           2HB      LEU  33   4.010  -9.468   3.021
  246    HG   LEU  33           HG       LEU  33   3.956 -11.938   2.920
  247   HD11  LEU  33          1HD1      LEU  33   4.609 -11.532  -0.023
  248   HD12  LEU  33          2HD1      LEU  33   3.342 -12.527   0.700
  249   HD13  LEU  33          3HD1      LEU  33   5.015 -13.038   0.805
  250   HD21  LEU  33          3HD2      LEU  33   6.385 -12.325   2.661
  251   HD22  LEU  33          1HD2      LEU  33   6.077 -10.813   3.514
  252   HD23  LEU  33          2HD2      LEU  33   6.544 -10.787   1.811
  253    H    LYS  34           H        LYS  34   1.277  -9.029   3.682
  254    HA   LYS  34           HA       LYS  34  -0.313 -11.447   4.175
  255    HB2  LYS  34           1HB      LYS  34   1.907 -11.958   5.169
  256    HB3  LYS  34           2HB      LYS  34   1.784 -10.543   6.190
  257    HG2  LYS  34           1HG      LYS  34  -0.355 -11.532   7.174
  258    HG3  LYS  34           2HG      LYS  34  -0.035 -12.991   6.245
  259    HD2  LYS  34           1HD      LYS  34   1.773 -11.795   8.389
  260    HD3  LYS  34           2HD      LYS  34   0.763 -13.223   8.578
  261    HE2  LYS  34           1HE      LYS  34   2.127 -14.207   6.563
  262    HE3  LYS  34           2HE      LYS  34   3.290 -12.926   6.923
  263    HZ1  LYS  34           3HZ      LYS  34   2.273 -14.683   9.058
  264    HZ2  LYS  34           1HZ      LYS  34   3.707 -13.775   9.005
  265    HZ3  LYS  34           2HZ      LYS  34   3.556 -15.178   8.058
  266    H    THR  35           H        THR  35  -2.046 -11.086   5.481
  267    HA   THR  35           HA       THR  35  -2.468  -8.353   6.625
  268    HB   THR  35           HB       THR  35  -3.600  -8.350   4.473
  269    HG1  THR  35           HG1      THR  35  -5.283  -8.820   6.699
  270   HG21  THR  35          3HG2      THR  35  -5.317 -10.041   3.910
  271   HG22  THR  35          1HG2      THR  35  -4.935 -10.938   5.375
  272   HG23  THR  35          2HG2      THR  35  -3.736 -10.798   4.090
  273    H    LYS  36           H        LYS  36  -3.735  -8.254   8.425
  274    HA   LYS  36           HA       LYS  36  -4.459 -10.886   9.694
  275    HB2  LYS  36           1HB      LYS  36  -2.680  -9.586  10.838
  276    HB3  LYS  36           2HB      LYS  36  -3.816  -8.281  11.082
  277    HG2  LYS  36           1HG      LYS  36  -5.282  -9.752  12.429
  278    HG3  LYS  36           2HG      LYS  36  -4.206 -11.112  12.119
  279    HD2  LYS  36           1HD      LYS  36  -2.369  -9.923  13.304
  280    HD3  LYS  36           2HD      LYS  36  -3.464  -8.585  13.645
  281    HE2  LYS  36           1HE      LYS  36  -4.932 -10.110  14.936
  282    HE3  LYS  36           2HE      LYS  36  -3.849 -11.457  14.582
  283    HZ1  LYS  36           3HZ      LYS  36  -3.668  -9.767  16.707
  284    HZ2  LYS  36           1HZ      LYS  36  -2.470  -9.197  15.649
  285    HZ3  LYS  36           2HZ      LYS  36  -2.450 -10.818  16.157
  286    HA   PRO  37           HA       PRO  37  -8.500  -8.627   9.192
  287    HB2  PRO  37           1HB      PRO  37 -10.019 -10.512   8.058
  288    HB3  PRO  37           2HB      PRO  37  -8.672  -9.811   7.121
  289    HG2  PRO  37           1HG      PRO  37  -8.694 -12.391   8.702
  290    HG3  PRO  37           2HG      PRO  37  -8.213 -12.142   7.006
  291    HD2  PRO  37           1HD      PRO  37  -6.375 -12.159   9.085
  292    HD3  PRO  37           2HD      PRO  37  -6.118 -11.204   7.608
  293    H    ASP  38           H        ASP  38  -7.324 -10.628  11.388
  294    HA   ASP  38           HA       ASP  38  -9.693 -11.760  12.617
  295    HB2  ASP  38           1HB      ASP  38  -6.851 -11.389  13.619
  296    HB3  ASP  38           2HB      ASP  38  -8.091 -12.342  14.436
  297    H    ALA  39           H        ALA  39  -9.036  -8.663  12.241
  298    HA   ALA  39           HA       ALA  39 -10.519  -7.829  14.594
  299    HB1  ALA  39           3HB      ALA  39  -8.751  -6.359  15.525
  300    HB2  ALA  39           1HB      ALA  39  -7.609  -6.990  14.338
  301    HB3  ALA  39           2HB      ALA  39  -8.263  -8.054  15.575
  302    H    THR  40           H        THR  40 -11.104  -5.606  14.550
  303    HA   THR  40           HA       THR  40 -10.586  -4.099  12.050
  304    HB   THR  40           HB       THR  40 -12.980  -3.677  11.725
  305    HG1  THR  40           HG1      THR  40 -13.258  -5.463  13.911
  306   HG21  THR  40          3HG2      THR  40 -13.634  -5.883  10.932
  307   HG22  THR  40          1HG2      THR  40 -12.517  -6.672  12.038
  308   HG23  THR  40          2HG2      THR  40 -11.894  -5.735  10.678
  309    HA   PRO  41           HA       PRO  41  -9.779  -2.052  11.606
  310    HB2  PRO  41           1HB      PRO  41  -7.930  -0.239  12.440
  311    HB3  PRO  41           2HB      PRO  41  -9.613   0.251  12.132
  312    HG2  PRO  41           1HG      PRO  41  -8.368  -0.543  14.778
  313    HG3  PRO  41           2HG      PRO  41  -9.246   0.957  14.381
  314    HD2  PRO  41           1HD      PRO  41 -10.580  -1.066  15.559
  315    HD3  PRO  41           2HD      PRO  41 -11.357  -0.176  14.224
  316    H    VAL  42           H        VAL  42  -7.241  -2.143  11.321
  317    HA   VAL  42           HA       VAL  42  -5.722  -3.602  13.289
  318    HB   VAL  42           HB       VAL  42  -7.337  -5.364  12.508
  319   HG11  VAL  42          1HG1      VAL  42  -7.516  -4.448  10.141
  320   HG12  VAL  42          2HG1      VAL  42  -7.327  -6.191  10.236
  321   HG13  VAL  42          3HG1      VAL  42  -5.947  -5.187   9.806
  322   HG21  VAL  42          3HG2      VAL  42  -4.856  -5.853  13.240
  323   HG22  VAL  42          1HG2      VAL  42  -4.570  -6.136  11.528
  324   HG23  VAL  42          2HG2      VAL  42  -5.724  -7.125  12.408
  325    H    GLU  43           H        GLU  43  -3.686  -4.600  12.155
  326    HA   GLU  43           HA       GLU  43  -2.543  -2.537  10.364
  327    HB2  GLU  43           1HB      GLU  43  -0.360  -3.546  11.084
  328    HB3  GLU  43           2HB      GLU  43  -1.297  -2.903  12.433
  329    HG2  GLU  43           1HG      GLU  43  -2.117  -5.189  12.960
  330    HG3  GLU  43           2HG      GLU  43  -1.189  -5.844  11.617
  331    H    TYR  44           H        TYR  44  -1.075  -3.274   8.697
  332    HA   TYR  44           HA       TYR  44  -1.655  -5.941   7.505
  333    HB2  TYR  44           1HB      TYR  44  -1.739  -3.239   6.113
  334    HB3  TYR  44           2HB      TYR  44  -1.869  -4.799   5.301
  335    HD1  TYR  44           HD2      TYR  44  -3.521  -2.547   7.805
  336    HD2  TYR  44           HD1      TYR  44  -3.981  -6.067   5.356
  337    HE1  TYR  44           HE2      TYR  44  -5.938  -2.637   8.352
  338    HE2  TYR  44           HE1      TYR  44  -6.394  -6.133   5.923
  339    HH   TYR  44           HH       TYR  44  -8.094  -3.723   7.001
  340    H    TYR  45           H        TYR  45  -0.057  -6.794   6.281
  341    HA   TYR  45           HA       TYR  45   2.653  -5.808   6.872
  342    HB2  TYR  45           1HB      TYR  45   1.867  -8.266   6.962
  343    HB3  TYR  45           2HB      TYR  45   2.023  -8.268   5.220
  344    HD1  TYR  45           HD1      TYR  45   4.326  -7.403   4.210
  345    HD2  TYR  45           HD2      TYR  45   3.851  -8.724   8.284
  346    HE1  TYR  45           HE1      TYR  45   6.755  -7.833   4.364
  347    HE2  TYR  45           HE2      TYR  45   6.288  -9.136   8.420
  348    HH   TYR  45           HH       TYR  45   8.468  -8.114   5.925
  349    H    ILE  46           H        ILE  46   3.127  -4.093   5.660
  350    HA   ILE  46           HA       ILE  46   2.837  -4.170   2.689
  351    HB   ILE  46           HB       ILE  46   2.872  -1.986   4.805
  352   HG12  ILE  46          1HG1      ILE  46   0.950  -1.100   3.598
  353   HG13  ILE  46          2HG1      ILE  46   1.261  -2.131   2.204
  354   HG21  ILE  46          1HG2      ILE  46   3.807  -1.571   1.934
  355   HG22  ILE  46          2HG2      ILE  46   4.670  -1.126   3.410
  356   HG23  ILE  46          3HG2      ILE  46   3.222  -0.245   2.940
  357   HD11  ILE  46          3HD1      ILE  46  -0.634  -2.821   3.762
  358   HD12  ILE  46          1HD1      ILE  46   0.606  -3.282   4.925
  359   HD13  ILE  46          2HD1      ILE  46   0.532  -4.071   3.345
  360    H    HIS  47           H        HIS  47   4.571  -4.031   1.413
  361    HA   HIS  47           HA       HIS  47   7.271  -3.516   2.515
  362    HB2  HIS  47           1HB      HIS  47   8.195  -5.531   1.517
  363    HB3  HIS  47           2HB      HIS  47   6.860  -6.006   2.563
  364    HD1  HIS  47           HD1      HIS  47   5.050  -7.405   1.482
  365    HD2  HIS  47           HD2      HIS  47   7.354  -5.399  -1.337
  366    HE1  HIS  47           HE1      HIS  47   4.357  -8.286  -0.795
  367    HE2  HIS  47           HE2      HIS  47   5.827  -7.141  -2.500
  368    H    TYR  48           H        TYR  48   8.650  -2.584   1.033
  369    HA   TYR  48           HA       TYR  48   7.441  -1.380  -1.331
  370    HB2  TYR  48           1HB      TYR  48  10.299  -1.285  -0.274
  371    HB3  TYR  48           2HB      TYR  48   9.645  -0.269  -1.559
  372    HD1  TYR  48           HD2      TYR  48   7.715   1.324  -1.065
  373    HD2  TYR  48           HD1      TYR  48   9.830  -0.732   2.085
  374    HE1  TYR  48           HE2      TYR  48   6.790   2.905   0.607
  375    HE2  TYR  48           HE1      TYR  48   8.891   0.860   3.739
  376    HH   TYR  48           HH       TYR  48   6.401   3.149   2.882
  377    H    ALA  49           H        ALA  49   7.642  -2.043  -3.395
  378    HA   ALA  49           HA       ALA  49   8.549  -4.654  -4.045
  379    HB1  ALA  49           3HB      ALA  49   7.969  -2.303  -5.888
  380    HB2  ALA  49           1HB      ALA  49   6.782  -3.470  -5.305
  381    HB3  ALA  49           2HB      ALA  49   8.077  -3.995  -6.381
  382    H    GLY  50           H        GLY  50  10.486  -5.398  -4.740
  383    HA2  GLY  50           1HA      GLY  50  12.617  -5.426  -5.675
  384    HA3  GLY  50           2HA      GLY  50  12.534  -3.688  -5.934
  385    H    TRP  51           H        TRP  51  11.804  -5.018  -2.800
  386    HA   TRP  51           HA       TRP  51  14.518  -4.443  -1.730
  387    HB2  TRP  51           1HB      TRP  51  11.947  -3.173  -0.700
  388    HB3  TRP  51           2HB      TRP  51  13.529  -3.044   0.073
  389    HD1  TRP  51           HD1      TRP  51  11.462  -1.505  -2.653
  390    HE1  TRP  51           HE1      TRP  51  12.820   0.316  -3.867
  391    HE3  TRP  51           HE3      TRP  51  16.091  -2.447  -0.728
  392    HZ2  TRP  51           HZ2      TRP  51  15.517   1.250  -4.004
  393    HZ3  TRP  51           HZ3      TRP  51  18.042  -1.077  -1.417
  394    HH2  TRP  51           HH2      TRP  51  17.761   0.769  -3.051
  395    H    SER  52           H        SER  52  14.782  -5.159   0.472
  396    HA   SER  52           HA       SER  52  13.889  -7.834   0.846
  397    HB2  SER  52           1HB      SER  52  15.223  -5.923   2.792
  398    HB3  SER  52           2HB      SER  52  15.072  -7.667   3.022
  399    HG   SER  52           HG       SER  52  16.268  -6.480   0.740
  400    H    LYS  53           H        LYS  53  12.326  -8.682   2.162
  401    HA   LYS  53           HA       LYS  53  10.188  -6.929   3.105
  402    HB2  LYS  53           1HB      LYS  53   8.943  -9.029   3.483
  403    HB3  LYS  53           2HB      LYS  53   9.585  -8.938   1.842
  404    HG2  LYS  53           1HG      LYS  53  11.489 -10.395   2.512
  405    HG3  LYS  53           2HG      LYS  53  10.822 -10.514   4.142
  406    HD2  LYS  53           1HD      LYS  53   8.751 -11.542   3.229
  407    HD3  LYS  53           2HD      LYS  53   9.414 -11.426   1.596
  408    HE2  LYS  53           1HE      LYS  53  10.631 -13.032   3.875
  409    HE3  LYS  53           2HE      LYS  53   9.729 -13.704   2.516
  410    HZ1  LYS  53           3HZ      LYS  53  12.411 -12.537   2.576
  411    HZ2  LYS  53           1HZ      LYS  53  11.488 -12.321   1.170
  412    HZ3  LYS  53           2HZ      LYS  53  11.834 -13.889   1.725
  413    H    ASN  54           H        ASN  54  13.015  -8.077   4.458
  414    HA   ASN  54           HA       ASN  54  12.161  -8.873   7.055
  415    HB2  ASN  54           1HB      ASN  54  14.417  -9.352   6.103
  416    HB3  ASN  54           2HB      ASN  54  14.826  -7.646   6.234
  417   HD21  ASN  54          2HD2      ASN  54  16.456  -7.860   7.891
  418   HD22  ASN  54          1HD2      ASN  54  16.104  -8.418   9.455
  419    H    TRP  55           H        TRP  55  12.088  -5.871   5.529
  420    HA   TRP  55           HA       TRP  55  12.594  -4.127   7.770
  421    HB2  TRP  55           1HB      TRP  55  11.178  -3.722   5.102
  422    HB3  TRP  55           2HB      TRP  55  11.416  -2.420   6.266
  423    HD1  TRP  55           HD1      TRP  55  13.678  -5.098   4.576
  424    HE1  TRP  55           HE1      TRP  55  15.909  -3.974   3.954
  425    HE3  TRP  55           HE3      TRP  55  12.827  -0.383   6.360
  426    HZ2  TRP  55           HZ2      TRP  55  17.171  -1.423   4.178
  427    HZ3  TRP  55           HZ3      TRP  55  14.564   1.373   6.143
  428    HH2  TRP  55           HH2      TRP  55  16.735   0.860   5.055
  429    H    ASP  56           H        ASP  56   9.875  -5.944   6.626
  430    HA   ASP  56           HA       ASP  56   7.641  -6.049   7.242
  431    HB2  ASP  56           1HB      ASP  56   8.994  -5.895   9.957
  432    HB3  ASP  56           2HB      ASP  56   7.400  -6.581   9.640
  433    H    GLU  57           H        GLU  57   7.218  -3.786   6.387
  434    HA   GLU  57           HA       GLU  57   6.946  -1.660   8.386
  435    HB2  GLU  57           1HB      GLU  57   7.679  -1.232   6.011
  436    HB3  GLU  57           2HB      GLU  57   6.062  -1.654   5.476
  437    HG2  GLU  57           1HG      GLU  57   5.119   0.180   6.860
  438    HG3  GLU  57           2HG      GLU  57   6.741   0.605   7.396
  439    H    TRP  58           H        TRP  58   5.415  -2.668   9.785
  440    HA   TRP  58           HA       TRP  58   2.735  -3.335   8.856
  441    HB2  TRP  58           1HB      TRP  58   4.199  -3.342  11.508
  442    HB3  TRP  58           2HB      TRP  58   2.442  -3.338  11.549
  443    HD1  TRP  58           HD1      TRP  58   1.432  -5.320   9.646
  444    HE1  TRP  58           HE1      TRP  58   2.079  -7.812   9.661
  445    HE3  TRP  58           HE3      TRP  58   5.866  -5.064  12.167
  446    HZ2  TRP  58           HZ2      TRP  58   4.188  -9.489  10.610
  447    HZ3  TRP  58           HZ3      TRP  58   7.174  -7.125  12.620
  448    HH2  TRP  58           HH2      TRP  58   6.341  -9.333  11.846
  449    H    VAL  59           H        VAL  59   1.165  -1.844   8.550
  450    HA   VAL  59           HA       VAL  59   1.148   0.599  10.222
  451    HB   VAL  59           HB       VAL  59   0.649   1.966   8.064
  452   HG11  VAL  59          1HG1      VAL  59   3.437   0.863   8.522
  453   HG12  VAL  59          2HG1      VAL  59   2.741   2.273   9.307
  454   HG13  VAL  59          3HG1      VAL  59   3.070   2.301   7.573
  455   HG21  VAL  59          3HG2      VAL  59   2.038  -0.441   6.803
  456   HG22  VAL  59          1HG2      VAL  59   1.584   1.048   5.979
  457   HG23  VAL  59          2HG2      VAL  59   0.336  -0.034   6.590
  458    HA   PRO  60           HA       PRO  60  -3.243   0.054  10.209
  459    HB2  PRO  60           1HB      PRO  60  -3.721   3.013  10.309
  460    HB3  PRO  60           2HB      PRO  60  -4.011   1.801  11.577
  461    HG2  PRO  60           1HG      PRO  60  -2.018   3.583  11.830
  462    HG3  PRO  60           2HG      PRO  60  -1.792   1.893  12.347
  463    HD2  PRO  60           1HD      PRO  60  -0.971   3.134   9.686
  464    HD3  PRO  60           2HD      PRO  60   0.035   2.257  10.852
  465    H    GLU  61           H        GLU  61  -5.188   0.347   8.991
  466    HA   GLU  61           HA       GLU  61  -4.932   0.384   6.222
  467    HB2  GLU  61           1HB      GLU  61  -6.864  -0.547   7.457
  468    HB3  GLU  61           2HB      GLU  61  -7.417   1.075   7.835
  469    HG2  GLU  61           1HG      GLU  61  -7.019   0.184   4.933
  470    HG3  GLU  61           2HG      GLU  61  -8.520  -0.146   5.782
  471    H    ASN  62           H        ASN  62  -5.366   3.070   8.400
  472    HA   ASN  62           HA       ASN  62  -6.309   5.045   6.624
  473    HB2  ASN  62           1HB      ASN  62  -4.486   5.391   9.036
  474    HB3  ASN  62           2HB      ASN  62  -5.460   6.660   8.289
  475   HD21  ASN  62          2HD2      ASN  62  -7.826   4.974   7.803
  476   HD22  ASN  62          1HD2      ASN  62  -8.505   4.640   9.322
  477    H    ARG  63           H        ARG  63  -2.954   4.075   7.374
  478    HA   ARG  63           HA       ARG  63  -1.813   6.084   5.588
  479    HB2  ARG  63           1HB      ARG  63  -0.812   5.036   7.824
  480    HB3  ARG  63           2HB      ARG  63  -0.257   3.766   6.756
  481    HG2  ARG  63           1HG      ARG  63   1.623   5.214   6.707
  482    HG3  ARG  63           2HG      ARG  63   0.738   5.794   5.302
  483    HD2  ARG  63           1HD      ARG  63  -0.309   7.565   6.762
  484    HD3  ARG  63           2HD      ARG  63   0.694   7.011   8.095
  485    HE   ARG  63           HE       ARG  63   2.358   7.580   5.876
  486   HH11  ARG  63          1HH2      ARG  63   0.340   9.161   8.229
  487   HH12  ARG  63          2HH2      ARG  63   1.188  10.669   8.143
  488   HH21  ARG  63          1HH1      ARG  63   3.461   9.570   5.764
  489   HH22  ARG  63          2HH1      ARG  63   2.949  10.898   6.750
  490    H    VAL  64           H        VAL  64  -3.371   3.252   4.979
  491    HA   VAL  64           HA       VAL  64  -1.688   2.500   2.620
  492    HB   VAL  64           HB       VAL  64  -3.838   0.901   4.066
  493   HG11  VAL  64          1HG1      VAL  64  -2.939  -1.004   2.721
  494   HG12  VAL  64          2HG1      VAL  64  -1.867   0.118   1.881
  495   HG13  VAL  64          3HG1      VAL  64  -3.609   0.250   1.685
  496   HG21  VAL  64          3HG2      VAL  64  -1.795   1.234   5.451
  497   HG22  VAL  64          1HG2      VAL  64  -0.800   0.645   4.127
  498   HG23  VAL  64          2HG2      VAL  64  -1.936  -0.439   4.933
  499    H    LEU  65           H        LEU  65  -2.547   2.528   0.606
  500    HA   LEU  65           HA       LEU  65  -5.364   3.459   0.261
  501    HB2  LEU  65           1HB      LEU  65  -3.749   5.289  -0.155
  502    HB3  LEU  65           2HB      LEU  65  -2.938   4.294  -1.352
  503    HG   LEU  65           HG       LEU  65  -4.990   4.280  -2.762
  504   HD11  LEU  65          1HD1      LEU  65  -6.835   6.019  -2.085
  505   HD12  LEU  65          2HD1      LEU  65  -6.198   5.846  -0.450
  506   HD13  LEU  65          3HD1      LEU  65  -6.856   4.447  -1.301
  507   HD21  LEU  65          3HD2      LEU  65  -3.313   6.076  -3.083
  508   HD22  LEU  65          1HD2      LEU  65  -4.156   7.077  -1.898
  509   HD23  LEU  65          2HD2      LEU  65  -4.938   6.666  -3.425
  510    H    LYS  66           H        LYS  66  -6.578   2.375  -1.146
  511    HA   LYS  66           HA       LYS  66  -5.765  -0.157  -2.133
  512    HB2  LYS  66           1HB      LYS  66  -8.105   0.469  -1.524
  513    HB3  LYS  66           2HB      LYS  66  -8.181   1.506  -2.945
  514    HG2  LYS  66           1HG      LYS  66  -7.879  -0.438  -4.430
  515    HG3  LYS  66           2HG      LYS  66  -7.625  -1.494  -3.044
  516    HD2  LYS  66           1HD      LYS  66  -9.914  -1.777  -3.868
  517    HD3  LYS  66           2HD      LYS  66  -9.956  -1.034  -2.274
  518    HE2  LYS  66           1HE      LYS  66 -10.551   1.116  -3.195
  519    HE3  LYS  66           2HE      LYS  66 -10.076   0.633  -4.827
  520    HZ1  LYS  66           3HZ      LYS  66 -11.875  -1.116  -4.610
  521    HZ2  LYS  66           1HZ      LYS  66 -12.385   0.493  -4.785
  522    HZ3  LYS  66           2HZ      LYS  66 -12.418  -0.245  -3.257
  523    H    TYR  67           H        TYR  67  -5.473  -0.878  -4.262
  524    HA   TYR  67           HA       TYR  67  -4.127   1.026  -6.041
  525    HB2  TYR  67           1HB      TYR  67  -3.225  -1.254  -5.666
  526    HB3  TYR  67           2HB      TYR  67  -4.686  -1.961  -6.335
  527    HD1  TYR  67           HD1      TYR  67  -1.915   0.461  -7.165
  528    HD2  TYR  67           HD2      TYR  67  -4.778  -2.358  -8.742
  529    HE1  TYR  67           HE1      TYR  67  -0.925   0.695  -9.425
  530    HE2  TYR  67           HE2      TYR  67  -3.765  -2.114 -10.989
  531    HH   TYR  67           HH       TYR  67  -0.922  -1.088 -11.626
  532    H    ASN  68           H        ASN  68  -5.258   2.191  -7.452
  533    HA   ASN  68           HA       ASN  68  -7.343   0.959  -9.110
  534    HB2  ASN  68           1HB      ASN  68  -8.554   1.795  -7.097
  535    HB3  ASN  68           2HB      ASN  68  -7.937   3.413  -7.405
  536   HD21  ASN  68          2HD2      ASN  68  -9.609   0.815  -9.286
  537   HD22  ASN  68          1HD2      ASN  68 -10.680   1.875 -10.068
  538    H    ASP  69           H        ASP  69  -7.463   1.863 -11.081
  539    HA   ASP  69           HA       ASP  69  -5.415   3.282 -12.214
  540    HB2  ASP  69           1HB      ASP  69  -7.001   3.778 -14.062
  541    HB3  ASP  69           2HB      ASP  69  -7.143   2.113 -13.498
  542    H    ASP  70           H        ASP  70  -8.116   4.600 -10.397
  543    HA   ASP  70           HA       ASP  70  -7.808   7.335 -11.218
  544    HB2  ASP  70           1HB      ASP  70  -9.912   6.404 -10.232
  545    HB3  ASP  70           2HB      ASP  70  -9.093   6.229  -8.684
  546    H    ASN  71           H        ASN  71  -6.701   5.476  -8.367
  547    HA   ASN  71           HA       ASN  71  -5.372   7.658  -7.085
  548    HB2  ASN  71           1HB      ASN  71  -4.775   4.679  -6.848
  549    HB3  ASN  71           2HB      ASN  71  -4.283   5.944  -5.718
  550   HD21  ASN  71          2HD2      ASN  71  -6.191   3.540  -5.424
  551   HD22  ASN  71          1HD2      ASN  71  -7.604   4.226  -4.785
  552    H    VAL  72           H        VAL  72  -4.439   5.295  -9.498
  553    HA   VAL  72           HA       VAL  72  -1.631   5.898  -9.577
  554    HB   VAL  72           HB       VAL  72  -3.473   4.767 -11.732
  555   HG11  VAL  72          1HG1      VAL  72  -0.427   4.819 -11.574
  556   HG12  VAL  72          2HG1      VAL  72  -1.414   5.640 -12.782
  557   HG13  VAL  72          3HG1      VAL  72  -1.346   3.885 -12.754
  558   HG21  VAL  72          3HG2      VAL  72  -1.589   3.385  -9.773
  559   HG22  VAL  72          1HG2      VAL  72  -2.550   2.576 -11.011
  560   HG23  VAL  72          2HG2      VAL  72  -3.346   3.384  -9.664
  561    H    LYS  73           H        LYS  73  -4.468   7.093 -11.320
  562    HA   LYS  73           HA       LYS  73  -3.243   8.861 -13.104
  563    HB2  LYS  73           1HB      LYS  73  -5.732   8.216 -12.930
  564    HB3  LYS  73           2HB      LYS  73  -5.878   9.432 -11.684
  565    HG2  LYS  73           1HG      LYS  73  -6.484  10.734 -13.563
  566    HG3  LYS  73           2HG      LYS  73  -4.761  11.053 -13.506
  567    HD2  LYS  73           1HD      LYS  73  -5.050  10.511 -15.792
  568    HD3  LYS  73           2HD      LYS  73  -4.579   8.950 -15.139
  569    HE2  LYS  73           1HE      LYS  73  -7.012   8.335 -14.966
  570    HE3  LYS  73           2HE      LYS  73  -7.427   9.879 -15.702
  571    HZ1  LYS  73           3HZ      LYS  73  -6.827   7.539 -16.999
  572    HZ2  LYS  73           1HZ      LYS  73  -5.445   8.499 -17.206
  573    HZ3  LYS  73           2HZ      LYS  73  -6.964   9.080 -17.701
  574    H    ARG  74           H        ARG  74  -4.160   9.326  -9.729
  575    HA   ARG  74           HA       ARG  74  -3.517  12.093  -9.556
  576    HB2  ARG  74           1HB      ARG  74  -3.644   9.927  -7.422
  577    HB3  ARG  74           2HB      ARG  74  -3.397  11.632  -7.049
  578    HG2  ARG  74           1HG      ARG  74  -5.557  12.192  -8.128
  579    HG3  ARG  74           2HG      ARG  74  -5.808  10.493  -8.528
  580    HD2  ARG  74           1HD      ARG  74  -7.065  11.083  -6.490
  581    HD3  ARG  74           2HD      ARG  74  -5.785   9.931  -6.102
  582    HE   ARG  74           HE       ARG  74  -4.809  12.578  -5.775
  583   HH11  ARG  74          1HH2      ARG  74  -7.044  10.329  -4.343
  584   HH12  ARG  74          2HH2      ARG  74  -6.865  10.969  -2.744
  585   HH21  ARG  74          1HH1      ARG  74  -4.580  13.406  -3.678
  586   HH22  ARG  74          2HH1      ARG  74  -5.473  12.707  -2.369
  587    H    ARG  75           H        ARG  75  -1.609   9.133  -9.076
  588    HA   ARG  75           HA       ARG  75   0.769  10.411  -8.117
  589    HB2  ARG  75           1HB      ARG  75   0.352   7.961  -7.887
  590    HB3  ARG  75           2HB      ARG  75   0.517   7.771  -9.628
  591    HG2  ARG  75           1HG      ARG  75   2.857   8.579  -9.519
  592    HG3  ARG  75           2HG      ARG  75   2.700   8.850  -7.788
  593    HD2  ARG  75           1HD      ARG  75   2.299   6.426  -7.452
  594    HD3  ARG  75           2HD      ARG  75   2.453   6.154  -9.186
  595    HE   ARG  75           HE       ARG  75   4.601   6.501  -7.301
  596   HH11  ARG  75          1HH2      ARG  75   3.650   7.059 -10.600
  597   HH12  ARG  75          2HH2      ARG  75   5.274   7.106 -11.197
  598   HH21  ARG  75          1HH1      ARG  75   6.719   6.557  -8.096
  599   HH22  ARG  75          2HH1      ARG  75   7.007   6.823  -9.782
  600    H    GLN  76           H        GLN  76  -0.438   9.543 -11.317
  601    HA   GLN  76           HA       GLN  76   1.848  10.397 -12.815
  602    HB2  GLN  76           1HB      GLN  76  -1.078  10.049 -13.582
  603    HB3  GLN  76           2HB      GLN  76   0.192  10.423 -14.751
  604    HG2  GLN  76           1HG      GLN  76   1.384   8.338 -14.140
  605    HG3  GLN  76           2HG      GLN  76   0.141   7.961 -12.952
  606   HE21  GLN  76          2HE2      GLN  76   1.059   7.320 -16.128
  607   HE22  GLN  76          1HE2      GLN  76  -0.446   6.824 -16.733
  608    H    GLU  77           H        GLU  77  -1.089  11.951 -11.642
  609    HA   GLU  77           HA       GLU  77  -0.770  14.449 -13.001
  610    HB2  GLU  77           1HB      GLU  77  -2.892  13.616 -11.858
  611    HB3  GLU  77           2HB      GLU  77  -2.136  13.977 -10.314
  612    HG2  GLU  77           1HG      GLU  77  -3.523  15.886 -10.879
  613    HG3  GLU  77           2HG      GLU  77  -1.857  16.392 -11.108
  614    H    LEU  78           H        LEU  78   0.074  13.367  -9.727
  615    HA   LEU  78           HA       LEU  78   1.412  15.709  -8.873
  616    HB2  LEU  78           1HB      LEU  78   1.637  12.799  -8.045
  617    HB3  LEU  78           2HB      LEU  78   2.480  14.079  -7.183
  618    HG   LEU  78           HG       LEU  78  -0.563  14.171  -7.560
  619   HD11  LEU  78          1HD1      LEU  78   0.952  12.909  -5.236
  620   HD12  LEU  78          2HD1      LEU  78  -0.042  12.044  -6.408
  621   HD13  LEU  78          3HD1      LEU  78  -0.792  13.179  -5.291
  622   HD21  LEU  78          3HD2      LEU  78   1.317  15.455  -5.515
  623   HD22  LEU  78          1HD2      LEU  78  -0.439  15.597  -5.483
  624   HD23  LEU  78          2HD2      LEU  78   0.471  16.302  -6.806
  625    H    ALA  79           H        ALA  79   2.525  12.808 -10.552
  626    HA   ALA  79           HA       ALA  79   5.294  13.289 -10.462
  627    HB1  ALA  79           3HB      ALA  79   5.456  11.782 -12.382
  628    HB2  ALA  79           1HB      ALA  79   3.729  11.961 -12.691
  629    HB3  ALA  79           2HB      ALA  79   4.282  11.164 -11.218
  630    H    ARG  80           H        ARG  80   2.847  14.367 -12.800
  631    HA   ARG  80           HA       ARG  80   4.653  15.833 -14.491
  632    HB2  ARG  80           1HB      ARG  80   1.631  15.908 -14.111
  633    HB3  ARG  80           2HB      ARG  80   2.462  16.887 -15.322
  634    HG2  ARG  80           1HG      ARG  80   3.356  14.848 -16.393
  635    HG3  ARG  80           2HG      ARG  80   2.593  13.843 -15.171
  636    HD2  ARG  80           1HD      ARG  80   0.362  14.644 -15.895
  637    HD3  ARG  80           2HD      ARG  80   1.127  15.655 -17.123
  638    HE   ARG  80           HE       ARG  80   2.029  13.023 -17.519
  639   HH11  ARG  80          1HH2      ARG  80  -0.931  14.843 -17.647
  640   HH12  ARG  80          2HH2      ARG  80  -1.649  13.846 -18.869
  641   HH21  ARG  80          1HH1      ARG  80   1.078  11.720 -19.123
  642   HH22  ARG  80          2HH1      ARG  80  -0.513  12.084 -19.702
  643    H    GLN  81           H        GLN  81   2.664  16.593 -11.677
  644    HA   GLN  81           HA       GLN  81   2.911  19.401 -11.714
  645    HB2  GLN  81           1HB      GLN  81   1.397  17.829 -10.240
  646    HB3  GLN  81           2HB      GLN  81   2.753  17.782  -9.126
  647    HG2  GLN  81           1HG      GLN  81   1.335  20.313 -10.070
  648    HG3  GLN  81           2HG      GLN  81   1.114  19.549  -8.501
  649   HE21  GLN  81          2HE2      GLN  81   3.027  19.528  -7.022
  650   HE22  GLN  81          1HE2      GLN  81   4.226  20.715  -7.196
  651    H    CYS  82           H        CYS  82   4.830  16.997  -9.885
  652    HA   CYS  82           HA       CYS  82   6.730  18.874  -8.882
  653    HB2  CYS  82           1HB      CYS  82   8.025  16.908  -8.215
  654    HB3  CYS  82           2HB      CYS  82   6.320  16.627  -7.875
  655    HG   CYS  82           HG       CYS  82   7.401  14.541  -9.138
  656    H    GLY  83           H        GLY  83   6.377  17.252 -11.917
  657    HA2  GLY  83           1HA      GLY  83   9.034  17.218 -12.854
  658    HA3  GLY  83           2HA      GLY  83   7.592  17.265 -13.859
  659    H    GLU  84           H        GLU  84   6.531  19.736 -13.006
  660    HA   GLU  84           HA       GLU  84   7.901  21.561 -14.668
  661    HB2  GLU  84           1HB      GLU  84   5.822  22.042 -12.500
  662    HB3  GLU  84           2HB      GLU  84   6.297  23.229 -13.715
  663    HG2  GLU  84           1HG      GLU  84   5.546  21.695 -15.513
  664    HG3  GLU  84           2HG      GLU  84   5.079  20.502 -14.307
  665    H    ARG  85           H        ARG  85   9.297  23.188 -14.244
  666    HA   ARG  85           HA       ARG  85   9.984  24.178 -11.645
  667    HB2  ARG  85           1HB      ARG  85  11.086  21.931 -11.536
  668    HB3  ARG  85           2HB      ARG  85  12.030  22.340 -12.962
  669    HG2  ARG  85           1HG      ARG  85  13.078  24.232 -11.744
  670    HG3  ARG  85           2HG      ARG  85  12.088  23.873 -10.327
  671    HD2  ARG  85           1HD      ARG  85  14.343  22.925 -10.051
  672    HD3  ARG  85           2HD      ARG  85  13.156  21.625 -10.181
  673    HE   ARG  85           HE       ARG  85  14.172  22.252 -12.760
  674   HH11  ARG  85          1HH2      ARG  85  15.119  20.801  -9.747
  675   HH12  ARG  85          2HH2      ARG  85  16.276  19.735 -10.472
  676   HH21  ARG  85          1HH1      ARG  85  15.684  20.858 -13.702
  677   HH22  ARG  85          2HH1      ARG  85  16.595  19.769 -12.711
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1 -29.156 -12.898  15.429
    2    H2   MET   1           2H       MET   1 -28.532 -11.728  16.494
    3    H3   MET   1           3H       MET   1 -28.405 -13.380  16.872
    4    HA   MET   1           HA       MET   1 -26.868 -11.770  14.974
    5    HB2  MET   1           1HB      MET   1 -26.038 -12.445  17.264
    6    HB3  MET   1           2HB      MET   1 -26.163 -14.133  16.780
    7    HG2  MET   1           1HG      MET   1 -23.844 -13.460  16.490
    8    HG3  MET   1           2HG      MET   1 -24.529 -13.599  14.877
    9    HE1  MET   1           3HE      MET   1 -21.871 -11.952  15.952
   10    HE2  MET   1           1HE      MET   1 -21.945 -10.653  14.751
   11    HE3  MET   1           2HE      MET   1 -22.312 -12.311  14.283
   12    H    ASN   2           H        ASN   2 -28.099 -12.449  13.095
   13    HA   ASN   2           HA       ASN   2 -28.469 -15.151  12.308
   14    HB2  ASN   2           1HB      ASN   2 -28.910 -14.188  10.064
   15    HB3  ASN   2           2HB      ASN   2 -29.752 -13.294  11.328
   16   HD21  ASN   2          2HD2      ASN   2 -29.339 -11.055  11.445
   17   HD22  ASN   2          1HD2      ASN   2 -28.114 -10.270  10.572
   18    H    TYR   3           H        TYR   3 -25.813 -12.884  11.848
   19    HA   TYR   3           HA       TYR   3 -24.348 -14.377   9.912
   20    HB2  TYR   3           1HB      TYR   3 -23.360 -12.382  11.995
   21    HB3  TYR   3           2HB      TYR   3 -22.455 -12.918  10.581
   22    HD1  TYR   3           HD2      TYR   3 -23.228 -12.305   8.259
   23    HD2  TYR   3           HD1      TYR   3 -25.217 -10.759  11.764
   24    HE1  TYR   3           HE2      TYR   3 -24.345 -10.574   6.877
   25    HE2  TYR   3           HE1      TYR   3 -26.320  -9.035  10.365
   26    HH   TYR   3           HH       TYR   3 -26.103  -9.081   6.865
   27    H    SER   4           H        SER   4 -22.769 -15.911  10.151
   28    HA   SER   4           HA       SER   4 -21.626 -16.682  12.703
   29    HB2  SER   4           1HB      SER   4 -23.573 -18.589  11.355
   30    HB3  SER   4           2HB      SER   4 -22.568 -18.967  12.754
   31    HG   SER   4           HG       SER   4 -23.689 -16.896  13.564
   32    H    THR   5           H        THR   5 -22.413 -18.461   9.713
   33    HA   THR   5           HA       THR   5 -19.811 -19.588   9.447
   34    HB   THR   5           HB       THR   5 -20.617 -20.367   7.253
   35    HG1  THR   5           HG1      THR   5 -22.998 -18.941   7.676
   36   HG21  THR   5          3HG2      THR   5 -22.653 -21.551   7.995
   37   HG22  THR   5          1HG2      THR   5 -22.828 -20.431   9.344
   38   HG23  THR   5          2HG2      THR   5 -21.453 -21.534   9.287
   39    H    GLY   6           H        GLY   6 -18.074 -18.931   8.290
   40    HA2  GLY   6           1HA      GLY   6 -17.999 -17.096   6.164
   41    HA3  GLY   6           2HA      GLY   6 -17.697 -16.189   7.644
   42    H    THR   7           H        THR   7 -15.798 -16.573   8.813
   43    HA   THR   7           HA       THR   7 -13.541 -16.916   9.029
   44    HB   THR   7           HB       THR   7 -14.168 -19.599   7.716
   45    HG1  THR   7           HG1      THR   7 -15.104 -20.089   9.512
   46   HG21  THR   7          3HG2      THR   7 -12.246 -20.393   9.077
   47   HG22  THR   7          1HG2      THR   7 -11.960 -18.746   9.634
   48   HG23  THR   7          2HG2      THR   7 -11.736 -19.156   7.932
   49    H    ASP   8           H        ASP   8 -13.227 -15.209   7.451
   50    HA   ASP   8           HA       ASP   8 -11.432 -15.983   5.340
   51    HB2  ASP   8           1HB      ASP   8 -12.768 -15.067   3.456
   52    HB3  ASP   8           2HB      ASP   8 -13.554 -16.465   4.186
   53    H    ALA   9           H        ALA   9 -10.709 -14.063   4.078
   54    HA   ALA   9           HA       ALA   9  -9.943 -11.956   5.835
   55    HB1  ALA   9           3HB      ALA   9  -8.921 -10.960   3.814
   56    HB2  ALA   9           1HB      ALA   9  -9.811 -12.098   2.799
   57    HB3  ALA   9           2HB      ALA   9  -8.574 -12.689   3.907
   58    H    ASN  10           H        ASN  10 -12.013 -11.191   6.624
   59    HA   ASN  10           HA       ASN  10 -14.032 -10.048   4.971
   60    HB2  ASN  10           1HB      ASN  10 -14.828  -8.991   7.083
   61    HB3  ASN  10           2HB      ASN  10 -14.479 -10.705   7.292
   62   HD21  ASN  10          2HD2      ASN  10 -13.640  -7.514   8.384
   63   HD22  ASN  10          1HD2      ASN  10 -12.406  -7.987   9.449
   64    H    THR  11           H        THR  11 -10.939  -8.915   5.998
   65    HA   THR  11           HA       THR  11 -11.349  -6.109   5.836
   66    HB   THR  11           HB       THR  11  -8.846  -6.039   5.554
   67    HG1  THR  11           HG1      THR  11  -8.116  -8.445   5.944
   68   HG21  THR  11          3HG2      THR  11  -9.798  -6.192   7.821
   69   HG22  THR  11          1HG2      THR  11  -8.313  -7.140   7.721
   70   HG23  THR  11          2HG2      THR  11  -9.880  -7.950   7.691
   71    H    LEU  12           H        LEU  12 -11.044  -4.677   4.148
   72    HA   LEU  12           HA       LEU  12 -11.804  -5.513   1.546
   73    HB2  LEU  12           1HB      LEU  12 -12.060  -3.169   2.689
   74    HB3  LEU  12           2HB      LEU  12 -10.425  -2.864   2.139
   75    HG   LEU  12           HG       LEU  12 -11.404  -3.634  -0.260
   76   HD11  LEU  12          1HD1      LEU  12 -13.645  -4.303   0.601
   77   HD12  LEU  12          2HD1      LEU  12 -13.779  -3.014  -0.580
   78   HD13  LEU  12          3HD1      LEU  12 -13.930  -2.654   1.141
   79   HD21  LEU  12          3HD2      LEU  12 -10.539  -1.368   0.188
   80   HD22  LEU  12          1HD2      LEU  12 -12.065  -0.920   0.953
   81   HD23  LEU  12          2HD2      LEU  12 -12.009  -1.274  -0.777
   82    H    PHE  13           H        PHE  13  -8.737  -5.367   3.087
   83    HA   PHE  13           HA       PHE  13  -7.193  -5.454   0.553
   84    HB2  PHE  13           1HB      PHE  13  -6.292  -5.353   3.464
   85    HB3  PHE  13           2HB      PHE  13  -5.240  -5.227   2.051
   86    HD1  PHE  13           HD2      PHE  13  -5.335  -3.217   0.558
   87    HD2  PHE  13           HD1      PHE  13  -7.789  -3.469   4.098
   88    HE1  PHE  13           HE2      PHE  13  -5.835  -0.795   0.396
   89    HE2  PHE  13           HE1      PHE  13  -8.285  -1.049   3.914
   90    HZ   PHE  13           HZ       PHE  13  -7.305   0.289   2.072
   91    H    VAL  14           H        VAL  14  -6.460  -7.294  -0.257
   92    HA   VAL  14           HA       VAL  14  -6.483  -9.820   1.359
   93    HB   VAL  14           HB       VAL  14  -6.900  -9.493  -1.645
   94   HG11  VAL  14          1HG1      VAL  14  -7.174 -11.913   0.195
   95   HG12  VAL  14          2HG1      VAL  14  -5.928 -11.690  -1.031
   96   HG13  VAL  14          3HG1      VAL  14  -7.605 -11.890  -1.514
   97   HG21  VAL  14          3HG2      VAL  14  -8.916 -10.049   0.579
   98   HG22  VAL  14          1HG2      VAL  14  -9.275 -10.073  -1.149
   99   HG23  VAL  14          2HG2      VAL  14  -8.814  -8.564  -0.370
  100    H    ASP  15           H        ASP  15  -4.744 -11.168   1.211
  101    HA   ASP  15           HA       ASP  15  -2.185 -10.088   0.779
  102    HB2  ASP  15           1HB      ASP  15  -2.654 -12.019   2.260
  103    HB3  ASP  15           2HB      ASP  15  -3.023 -13.010   0.857
  104    H    GLY  16           H        GLY  16  -0.798 -10.106  -0.918
  105    HA2  GLY  16           1HA      GLY  16   0.138 -10.689  -2.983
  106    HA3  GLY  16           2HA      GLY  16  -1.244 -11.720  -3.335
  107    H    GLU  17           H        GLU  17  -2.458  -8.866  -2.224
  108    HA   GLU  17           HA       GLU  17  -3.246  -7.964  -4.891
  109    HB2  GLU  17           1HB      GLU  17  -4.842  -8.061  -2.963
  110    HB3  GLU  17           2HB      GLU  17  -3.925  -6.790  -2.158
  111    HG2  GLU  17           1HG      GLU  17  -4.404  -5.238  -4.031
  112    HG3  GLU  17           2HG      GLU  17  -5.267  -6.515  -4.884
  113    H    ARG  18           H        ARG  18  -2.438  -6.256  -5.951
  114    HA   ARG  18           HA       ARG  18  -0.072  -4.875  -4.961
  115    HB2  ARG  18           1HB      ARG  18  -0.330  -5.581  -7.338
  116    HB3  ARG  18           2HB      ARG  18  -1.663  -4.445  -7.525
  117    HG2  ARG  18           1HG      ARG  18  -0.156  -2.545  -7.042
  118    HG3  ARG  18           2HG      ARG  18   1.180  -3.657  -6.732
  119    HD2  ARG  18           1HD      ARG  18  -0.269  -3.399  -9.400
  120    HD3  ARG  18           2HD      ARG  18   1.286  -2.657  -9.021
  121    HE   ARG  18           HE       ARG  18   1.503  -5.401  -8.459
  122   HH11  ARG  18          1HH2      ARG  18   1.041  -3.297 -11.188
  123   HH12  ARG  18          2HH2      ARG  18   1.805  -4.369 -12.310
  124   HH21  ARG  18          1HH1      ARG  18   2.501  -6.791  -9.936
  125   HH22  ARG  18          2HH1      ARG  18   2.630  -6.344 -11.602
  126    H    VAL  19           H        VAL  19  -0.096  -2.967  -3.892
  127    HA   VAL  19           HA       VAL  19  -2.416  -1.101  -4.128
  128    HB   VAL  19           HB       VAL  19  -2.365  -0.706  -1.695
  129   HG11  VAL  19          1HG1      VAL  19  -2.658  -3.657  -2.391
  130   HG12  VAL  19          2HG1      VAL  19  -3.909  -2.428  -2.584
  131   HG13  VAL  19          3HG1      VAL  19  -3.342  -2.865  -0.972
  132   HG21  VAL  19          3HG2      VAL  19  -1.053  -2.292  -0.219
  133   HG22  VAL  19          1HG2      VAL  19  -0.019  -1.234  -1.171
  134   HG23  VAL  19          2HG2      VAL  19  -0.254  -2.903  -1.659
  135    H    LEU  20           H        LEU  20  -1.871   1.019  -3.066
  136    HA   LEU  20           HA       LEU  20   0.906   1.849  -3.818
  137    HB2  LEU  20           1HB      LEU  20  -1.643   3.498  -3.788
  138    HB3  LEU  20           2HB      LEU  20  -0.060   4.022  -4.366
  139    HG   LEU  20           HG       LEU  20  -1.737   1.776  -5.581
  140   HD11  LEU  20          1HD1      LEU  20  -2.703   3.979  -5.998
  141   HD12  LEU  20          2HD1      LEU  20  -2.028   3.332  -7.487
  142   HD13  LEU  20          3HD1      LEU  20  -1.156   4.581  -6.595
  143   HD21  LEU  20          3HD2      LEU  20   0.019   2.056  -7.508
  144   HD22  LEU  20          1HD2      LEU  20   0.523   1.181  -6.072
  145   HD23  LEU  20          2HD2      LEU  20   1.022   2.857  -6.302
  146    H    CYS  21           H        CYS  21   2.108   2.969  -2.415
  147    HA   CYS  21           HA       CYS  21   1.004   3.564   0.318
  148    HB2  CYS  21           1HB      CYS  21   2.591   1.663   0.270
  149    HB3  CYS  21           2HB      CYS  21   3.822   2.708  -0.436
  150    HG   CYS  21           HG       CYS  21   4.187   3.795   1.790
  151    H    PHE  22           H        PHE  22   0.754   5.704   0.453
  152    HA   PHE  22           HA       PHE  22   2.709   7.545  -0.815
  153    HB2  PHE  22           1HB      PHE  22   1.042   9.275  -0.506
  154    HB3  PHE  22           2HB      PHE  22   0.297   7.889  -1.296
  155    HD1  PHE  22           HD2      PHE  22  -1.337   6.444  -0.065
  156    HD2  PHE  22           HD1      PHE  22   0.482   9.860   1.843
  157    HE1  PHE  22           HE2      PHE  22  -3.012   6.331   1.759
  158    HE2  PHE  22           HE1      PHE  22  -1.200   9.732   3.656
  159    HZ   PHE  22           HZ       PHE  22  -2.944   7.972   3.616
  160    H    HIS  23           H        HIS  23   2.941   9.637   0.570
  161    HA   HIS  23           HA       HIS  23   3.254   9.106   3.455
  162    HB2  HIS  23           1HB      HIS  23   5.594   9.894   1.669
  163    HB3  HIS  23           2HB      HIS  23   5.637   9.750   3.428
  164    HD1  HIS  23           HD1      HIS  23   4.449   7.164   4.095
  165    HD2  HIS  23           HD2      HIS  23   6.698   7.598   0.614
  166    HE1  HIS  23           HE1      HIS  23   5.200   4.838   3.433
  167    HE2  HIS  23           HE2      HIS  23   6.581   5.086   1.318
  168    H    GLY  24           H        GLY  24   3.337  11.313   0.724
  169    HA2  GLY  24           1HA      GLY  24   1.869  13.375   1.643
  170    HA3  GLY  24           2HA      GLY  24   3.431  13.719   2.389
  171    HA   PRO  25           HA       PRO  25   4.989  15.578  -1.259
  172    HB2  PRO  25           1HB      PRO  25   7.380  14.303  -1.895
  173    HB3  PRO  25           2HB      PRO  25   7.192  15.380  -0.493
  174    HG2  PRO  25           1HG      PRO  25   6.949  12.365  -0.574
  175    HG3  PRO  25           2HG      PRO  25   7.942  13.366   0.520
  176    HD2  PRO  25           1HD      PRO  25   5.582  12.482   1.389
  177    HD3  PRO  25           2HD      PRO  25   6.015  14.177   1.706
  178    H    LEU  26           H        LEU  26   5.372  12.035  -1.797
  179    HA   LEU  26           HA       LEU  26   3.772  12.219  -4.284
  180    HB2  LEU  26           1HB      LEU  26   6.570  12.363  -4.504
  181    HB3  LEU  26           2HB      LEU  26   6.299  10.642  -4.669
  182    HG   LEU  26           HG       LEU  26   4.466  11.313  -6.471
  183   HD11  LEU  26          1HD1      LEU  26   6.169  13.836  -6.440
  184   HD12  LEU  26          2HD1      LEU  26   4.501  13.760  -5.920
  185   HD13  LEU  26          3HD1      LEU  26   4.899  13.471  -7.606
  186   HD21  LEU  26          3HD2      LEU  26   6.177  11.413  -8.276
  187   HD22  LEU  26          1HD2      LEU  26   6.595  10.192  -7.072
  188   HD23  LEU  26          2HD2      LEU  26   7.423  11.749  -7.070
  189    H    ILE  27           H        ILE  27   3.352  10.103  -5.236
  190    HA   ILE  27           HA       ILE  27   2.720   8.134  -3.149
  191    HB   ILE  27           HB       ILE  27   1.854   8.286  -6.065
  192   HG12  ILE  27          1HG1      ILE  27   0.256   8.978  -3.540
  193   HG13  ILE  27          2HG1      ILE  27   1.042  10.188  -4.547
  194   HG21  ILE  27          1HG2      ILE  27   0.109   6.613  -5.340
  195   HG22  ILE  27          2HG2      ILE  27   0.881   6.530  -3.761
  196   HG23  ILE  27          3HG2      ILE  27   1.736   5.966  -5.191
  197   HD11  ILE  27          3HD1      ILE  27  -0.301   9.495  -6.481
  198   HD12  ILE  27          1HD1      ILE  27  -1.332   9.979  -5.136
  199   HD13  ILE  27          2HD1      ILE  27  -1.105   8.270  -5.500
  200    H    TYR  28           H        TYR  28   3.450   6.039  -3.179
  201    HA   TYR  28           HA       TYR  28   5.552   5.268  -5.172
  202    HB2  TYR  28           1HB      TYR  28   5.594   4.785  -2.165
  203    HB3  TYR  28           2HB      TYR  28   6.808   4.230  -3.317
  204    HD1  TYR  28           HD2      TYR  28   8.331   5.853  -4.455
  205    HD2  TYR  28           HD1      TYR  28   5.437   7.193  -1.545
  206    HE1  TYR  28           HE2      TYR  28   9.477   8.049  -4.309
  207    HE2  TYR  28           HE1      TYR  28   6.602   9.380  -1.413
  208    HH   TYR  28           HH       TYR  28   8.623  10.525  -3.617
  209    H    GLU  29           H        GLU  29   5.804   3.038  -5.513
  210    HA   GLU  29           HA       GLU  29   3.289   1.557  -5.403
  211    HB2  GLU  29           1HB      GLU  29   4.942   1.758  -7.416
  212    HB3  GLU  29           2HB      GLU  29   5.924   0.555  -6.587
  213    HG2  GLU  29           1HG      GLU  29   3.004   0.190  -7.408
  214    HG3  GLU  29           2HG      GLU  29   4.387  -0.484  -8.256
  215    H    ALA  30           H        ALA  30   2.861  -0.168  -4.161
  216    HA   ALA  30           HA       ALA  30   4.952  -1.612  -2.670
  217    HB1  ALA  30           3HB      ALA  30   2.619  -0.224  -1.297
  218    HB2  ALA  30           1HB      ALA  30   4.307   0.271  -1.187
  219    HB3  ALA  30           2HB      ALA  30   3.801  -1.281  -0.514
  220    H    LYS  31           H        LYS  31   3.817  -3.422  -1.360
  221    HA   LYS  31           HA       LYS  31   1.342  -4.416  -2.657
  222    HB2  LYS  31           1HB      LYS  31   3.286  -5.272  -3.966
  223    HB3  LYS  31           2HB      LYS  31   3.900  -6.051  -2.511
  224    HG2  LYS  31           1HG      LYS  31   1.927  -7.505  -2.375
  225    HG3  LYS  31           2HG      LYS  31   1.124  -6.624  -3.672
  226    HD2  LYS  31           1HD      LYS  31   2.042  -8.722  -4.546
  227    HD3  LYS  31           2HD      LYS  31   2.886  -7.354  -5.266
  228    HE2  LYS  31           1HE      LYS  31   4.063  -8.664  -2.790
  229    HE3  LYS  31           2HE      LYS  31   4.307  -9.395  -4.373
  230    HZ1  LYS  31           3HZ      LYS  31   5.940  -7.965  -4.674
  231    HZ2  LYS  31           1HZ      LYS  31   5.546  -7.084  -3.278
  232    HZ3  LYS  31           2HZ      LYS  31   4.788  -6.720  -4.755
  233    H    VAL  32           H        VAL  32   0.283  -6.062  -1.509
  234    HA   VAL  32           HA       VAL  32   0.740  -5.982   1.412
  235    HB   VAL  32           HB       VAL  32  -1.588  -7.193  -0.158
  236   HG11  VAL  32          1HG1      VAL  32  -2.775  -7.044   2.035
  237   HG12  VAL  32          2HG1      VAL  32  -1.291  -6.455   2.789
  238   HG13  VAL  32          3HG1      VAL  32  -1.365  -8.091   2.145
  239   HG21  VAL  32          3HG2      VAL  32  -1.408  -4.753  -0.557
  240   HG22  VAL  32          1HG2      VAL  32  -1.351  -4.456   1.179
  241   HG23  VAL  32          2HG2      VAL  32  -2.811  -5.114   0.435
  242    H    LEU  33           H        LEU  33   2.263  -7.435   1.972
  243    HA   LEU  33           HA       LEU  33   2.521 -10.007   0.665
  244    HB2  LEU  33           1HB      LEU  33   4.357  -8.486   1.908
  245    HB3  LEU  33           2HB      LEU  33   3.874  -9.408   3.301
  246    HG   LEU  33           HG       LEU  33   5.831 -10.445   2.279
  247   HD11  LEU  33          1HD1      LEU  33   5.143 -12.687   2.192
  248   HD12  LEU  33          2HD1      LEU  33   3.554 -12.306   1.554
  249   HD13  LEU  33          3HD1      LEU  33   3.950 -11.924   3.230
  250   HD21  LEU  33          3HD2      LEU  33   6.086 -11.016   0.052
  251   HD22  LEU  33          1HD2      LEU  33   5.143  -9.550  -0.127
  252   HD23  LEU  33          2HD2      LEU  33   4.371 -11.125  -0.279
  253    H    LYS  34           H        LYS  34   1.327  -8.864   3.783
  254    HA   LYS  34           HA       LYS  34  -0.338 -11.270   4.035
  255    HB2  LYS  34           1HB      LYS  34   1.906 -11.846   4.960
  256    HB3  LYS  34           2HB      LYS  34   1.717 -10.594   6.160
  257    HG2  LYS  34           1HG      LYS  34  -0.376 -11.733   6.972
  258    HG3  LYS  34           2HG      LYS  34  -0.067 -13.042   5.835
  259    HD2  LYS  34           1HD      LYS  34   1.762 -12.184   8.123
  260    HD3  LYS  34           2HD      LYS  34   0.720 -13.607   8.121
  261    HE2  LYS  34           1HE      LYS  34   3.215 -13.125   6.421
  262    HE3  LYS  34           2HE      LYS  34   2.922 -14.421   7.572
  263    HZ1  LYS  34           3HZ      LYS  34   2.576 -15.356   5.482
  264    HZ2  LYS  34           1HZ      LYS  34   1.676 -14.029   4.922
  265    HZ3  LYS  34           2HZ      LYS  34   1.015 -15.072   6.090
  266    H    THR  35           H        THR  35  -1.981 -11.056   5.532
  267    HA   THR  35           HA       THR  35  -2.438  -8.357   6.726
  268    HB   THR  35           HB       THR  35  -3.657  -8.339   4.617
  269    HG1  THR  35           HG1      THR  35  -5.680  -9.081   6.380
  270   HG21  THR  35          3HG2      THR  35  -3.734 -10.777   4.185
  271   HG22  THR  35          1HG2      THR  35  -5.340 -10.061   4.070
  272   HG23  THR  35          2HG2      THR  35  -4.886 -10.977   5.504
  273    H    LYS  36           H        LYS  36  -3.586  -8.323   8.587
  274    HA   LYS  36           HA       LYS  36  -4.211 -10.973   9.841
  275    HB2  LYS  36           1HB      LYS  36  -2.422  -9.698  10.942
  276    HB3  LYS  36           2HB      LYS  36  -3.531  -8.367  11.191
  277    HG2  LYS  36           1HG      LYS  36  -4.913  -9.657  12.727
  278    HG3  LYS  36           2HG      LYS  36  -4.150 -11.170  12.254
  279    HD2  LYS  36           1HD      LYS  36  -3.319 -10.474  14.455
  280    HD3  LYS  36           2HD      LYS  36  -2.011 -10.422  13.274
  281    HE2  LYS  36           1HE      LYS  36  -2.116  -8.006  13.153
  282    HE3  LYS  36           2HE      LYS  36  -3.652  -7.965  14.024
  283    HZ1  LYS  36           3HZ      LYS  36  -2.094  -7.451  15.626
  284    HZ2  LYS  36           1HZ      LYS  36  -0.966  -8.585  15.060
  285    HZ3  LYS  36           2HZ      LYS  36  -2.358  -9.112  15.878
  286    HA   PRO  37           HA       PRO  37  -8.319  -8.824   9.557
  287    HB2  PRO  37           1HB      PRO  37  -9.834 -10.735   8.485
  288    HB3  PRO  37           2HB      PRO  37  -8.531 -10.028   7.494
  289    HG2  PRO  37           1HG      PRO  37  -8.452 -12.584   9.112
  290    HG3  PRO  37           2HG      PRO  37  -8.049 -12.361   7.389
  291    HD2  PRO  37           1HD      PRO  37  -6.115 -12.305   9.369
  292    HD3  PRO  37           2HD      PRO  37  -5.964 -11.360   7.878
  293    H    ASP  38           H        ASP  38  -6.999 -10.878  11.660
  294    HA   ASP  38           HA       ASP  38  -9.232 -12.135  12.952
  295    HB2  ASP  38           1HB      ASP  38  -6.429 -11.485  13.926
  296    HB3  ASP  38           2HB      ASP  38  -7.562 -12.544  14.769
  297    H    ALA  39           H        ALA  39  -8.892  -8.990  12.554
  298    HA   ALA  39           HA       ALA  39 -10.432  -8.294  14.921
  299    HB1  ALA  39           3HB      ALA  39  -8.143  -8.225  15.852
  300    HB2  ALA  39           1HB      ALA  39  -8.861  -6.614  15.808
  301    HB3  ALA  39           2HB      ALA  39  -7.665  -7.087  14.603
  302    H    THR  40           H        THR  40 -11.183  -6.095  14.904
  303    HA   THR  40           HA       THR  40 -10.986  -4.632  12.335
  304    HB   THR  40           HB       THR  40 -13.432  -4.447  12.174
  305    HG1  THR  40           HG1      THR  40 -14.373  -6.267  13.660
  306   HG21  THR  40          3HG2      THR  40 -12.638  -7.375  12.439
  307   HG22  THR  40          1HG2      THR  40 -12.187  -6.378  11.053
  308   HG23  THR  40          2HG2      THR  40 -13.886  -6.706  11.395
  309    HA   PRO  41           HA       PRO  41 -10.228  -2.562  11.875
  310    HB2  PRO  41           1HB      PRO  41  -8.449  -0.665  12.684
  311    HB3  PRO  41           2HB      PRO  41 -10.152  -0.256  12.350
  312    HG2  PRO  41           1HG      PRO  41  -8.882  -0.910  15.021
  313    HG3  PRO  41           2HG      PRO  41  -9.848   0.524  14.578
  314    HD2  PRO  41           1HD      PRO  41 -11.053  -1.550  15.811
  315    HD3  PRO  41           2HD      PRO  41 -11.884  -0.728  14.468
  316    H    VAL  42           H        VAL  42  -7.619  -2.437  11.676
  317    HA   VAL  42           HA       VAL  42  -6.129  -3.930  13.639
  318    HB   VAL  42           HB       VAL  42  -7.637  -5.688  12.596
  319   HG11  VAL  42          1HG1      VAL  42  -7.317  -6.439  10.320
  320   HG12  VAL  42          2HG1      VAL  42  -5.915  -5.396  10.109
  321   HG13  VAL  42          3HG1      VAL  42  -7.525  -4.692  10.256
  322   HG21  VAL  42          3HG2      VAL  42  -6.023  -7.400  12.788
  323   HG22  VAL  42          1HG2      VAL  42  -5.166  -6.096  13.582
  324   HG23  VAL  42          2HG2      VAL  42  -4.804  -6.500  11.916
  325    H    GLU  43           H        GLU  43  -4.057  -4.941  12.275
  326    HA   GLU  43           HA       GLU  43  -2.915  -2.684  10.723
  327    HB2  GLU  43           1HB      GLU  43  -0.702  -3.567  11.544
  328    HB3  GLU  43           2HB      GLU  43  -1.733  -2.964  12.838
  329    HG2  GLU  43           1HG      GLU  43  -2.465  -5.295  13.337
  330    HG3  GLU  43           2HG      GLU  43  -1.403  -5.890  12.065
  331    H    TYR  44           H        TYR  44  -1.364  -3.278   9.133
  332    HA   TYR  44           HA       TYR  44  -1.710  -5.967   7.878
  333    HB2  TYR  44           1HB      TYR  44  -1.907  -3.254   6.503
  334    HB3  TYR  44           2HB      TYR  44  -1.957  -4.815   5.695
  335    HD1  TYR  44           HD2      TYR  44  -3.733  -2.663   8.216
  336    HD2  TYR  44           HD1      TYR  44  -4.043  -6.116   5.650
  337    HE1  TYR  44           HE2      TYR  44  -6.155  -2.835   8.720
  338    HE2  TYR  44           HE1      TYR  44  -6.462  -6.262   6.156
  339    HH   TYR  44           HH       TYR  44  -8.091  -3.812   8.139
  340    H    TYR  45           H        TYR  45   0.027  -6.713   6.729
  341    HA   TYR  45           HA       TYR  45   2.598  -5.352   7.305
  342    HB2  TYR  45           1HB      TYR  45   2.660  -7.691   7.938
  343    HB3  TYR  45           2HB      TYR  45   2.017  -8.172   6.376
  344    HD1  TYR  45           HD1      TYR  45   4.736  -5.536   6.688
  345    HD2  TYR  45           HD2      TYR  45   3.909  -9.685   5.811
  346    HE1  TYR  45           HE1      TYR  45   6.976  -5.798   5.735
  347    HE2  TYR  45           HE2      TYR  45   6.182  -9.920   4.895
  348    HH   TYR  45           HH       TYR  45   8.615  -7.935   5.474
  349    H    ILE  46           H        ILE  46   3.185  -3.939   5.815
  350    HA   ILE  46           HA       ILE  46   2.854  -4.505   2.911
  351    HB   ILE  46           HB       ILE  46   3.298  -1.839   4.335
  352   HG12  ILE  46          1HG1      ILE  46   1.129  -2.724   5.045
  353   HG13  ILE  46          2HG1      ILE  46   0.864  -1.430   3.900
  354   HG21  ILE  46          1HG2      ILE  46   2.451  -2.491   1.482
  355   HG22  ILE  46          2HG2      ILE  46   4.012  -1.839   1.969
  356   HG23  ILE  46          3HG2      ILE  46   2.558  -0.871   2.167
  357   HD11  ILE  46          3HD1      ILE  46   0.461  -4.389   3.542
  358   HD12  ILE  46          1HD1      ILE  46   0.691  -3.369   2.122
  359   HD13  ILE  46          2HD1      ILE  46  -0.655  -3.072   3.211
  360    H    HIS  47           H        HIS  47   4.575  -4.212   1.577
  361    HA   HIS  47           HA       HIS  47   7.243  -3.516   2.654
  362    HB2  HIS  47           1HB      HIS  47   8.302  -5.541   1.928
  363    HB3  HIS  47           2HB      HIS  47   6.851  -6.077   2.772
  364    HD1  HIS  47           HD1      HIS  47   8.649  -6.646  -0.255
  365    HD2  HIS  47           HD2      HIS  47   4.611  -6.389   0.691
  366    HE1  HIS  47           HE1      HIS  47   7.395  -7.687  -2.194
  367    HE2  HIS  47           HE2      HIS  47   4.926  -7.523  -1.629
  368    H    TYR  48           H        TYR  48   8.604  -2.634   1.133
  369    HA   TYR  48           HA       TYR  48   7.370  -1.520  -1.236
  370    HB2  TYR  48           1HB      TYR  48  10.253  -1.435  -0.268
  371    HB3  TYR  48           2HB      TYR  48   9.584  -0.450  -1.565
  372    HD1  TYR  48           HD1      TYR  48   7.632   1.140  -1.070
  373    HD2  TYR  48           HD2      TYR  48   9.915  -0.746   2.069
  374    HE1  TYR  48           HE1      TYR  48   6.777   2.802   0.562
  375    HE2  TYR  48           HE2      TYR  48   9.055   0.926   3.682
  376    HH   TYR  48           HH       TYR  48   6.568   3.263   2.772
  377    H    ALA  49           H        ALA  49   7.598  -2.149  -3.325
  378    HA   ALA  49           HA       ALA  49   8.398  -4.823  -3.930
  379    HB1  ALA  49           3HB      ALA  49   7.818  -2.494  -5.804
  380    HB2  ALA  49           1HB      ALA  49   6.623  -3.632  -5.179
  381    HB3  ALA  49           2HB      ALA  49   7.891  -4.196  -6.269
  382    H    GLY  50           H        GLY  50  10.383  -5.585  -4.419
  383    HA2  GLY  50           1HA      GLY  50  12.483  -5.683  -5.449
  384    HA3  GLY  50           2HA      GLY  50  12.403  -3.966  -5.814
  385    H    TRP  51           H        TRP  51  11.746  -5.167  -2.598
  386    HA   TRP  51           HA       TRP  51  14.460  -4.409  -1.620
  387    HB2  TRP  51           1HB      TRP  51  11.829  -3.360  -0.496
  388    HB3  TRP  51           2HB      TRP  51  13.427  -3.083   0.202
  389    HD1  TRP  51           HD1      TRP  51  11.188  -1.976  -2.656
  390    HE1  TRP  51           HE1      TRP  51  12.275   0.025  -3.863
  391    HE3  TRP  51           HE3      TRP  51  15.760  -1.974  -0.393
  392    HZ2  TRP  51           HZ2      TRP  51  14.760   1.441  -3.867
  393    HZ3  TRP  51           HZ3      TRP  51  17.474  -0.288  -1.015
  394    HH2  TRP  51           HH2      TRP  51  16.979   1.418  -2.748
  395    H    SER  52           H        SER  52  14.836  -5.066   0.590
  396    HA   SER  52           HA       SER  52  14.151  -7.814   0.997
  397    HB2  SER  52           1HB      SER  52  15.501  -5.836   2.868
  398    HB3  SER  52           2HB      SER  52  15.469  -7.588   3.075
  399    HG   SER  52           HG       SER  52  16.737  -7.828   1.332
  400    H    LYS  53           H        LYS  53  13.014  -8.731   2.752
  401    HA   LYS  53           HA       LYS  53  10.622  -7.269   3.587
  402    HB2  LYS  53           1HB      LYS  53  11.467 -10.172   3.935
  403    HB3  LYS  53           2HB      LYS  53   9.892  -9.516   4.378
  404    HG2  LYS  53           1HG      LYS  53   9.532  -8.813   2.002
  405    HG3  LYS  53           2HG      LYS  53  11.086  -9.543   1.574
  406    HD2  LYS  53           1HD      LYS  53  10.233 -11.762   2.341
  407    HD3  LYS  53           2HD      LYS  53   8.680 -11.019   2.728
  408    HE2  LYS  53           1HE      LYS  53   8.439 -10.329   0.333
  409    HE3  LYS  53           2HE      LYS  53   9.952 -11.157  -0.035
  410    HZ1  LYS  53           3HZ      LYS  53   7.642 -12.513   1.235
  411    HZ2  LYS  53           1HZ      LYS  53   9.015 -13.227   0.537
  412    HZ3  LYS  53           2HZ      LYS  53   7.867 -12.453  -0.447
  413    H    ASN  54           H        ASN  54  13.698  -7.646   4.854
  414    HA   ASN  54           HA       ASN  54  13.118  -8.129   7.619
  415    HB2  ASN  54           1HB      ASN  54  15.435  -7.359   8.009
  416    HB3  ASN  54           2HB      ASN  54  15.363  -8.500   6.670
  417   HD21  ASN  54          2HD2      ASN  54  16.894  -7.801   5.147
  418   HD22  ASN  54          1HD2      ASN  54  17.066  -6.196   4.623
  419    H    TRP  55           H        TRP  55  12.587  -5.451   5.621
  420    HA   TRP  55           HA       TRP  55  12.973  -3.295   7.467
  421    HB2  TRP  55           1HB      TRP  55  11.248  -3.581   4.972
  422    HB3  TRP  55           2HB      TRP  55  11.411  -2.064   5.858
  423    HD1  TRP  55           HD1      TRP  55  13.846  -4.702   4.361
  424    HE1  TRP  55           HE1      TRP  55  15.809  -3.443   3.275
  425    HE3  TRP  55           HE3      TRP  55  12.503   0.114   5.422
  426    HZ2  TRP  55           HZ2      TRP  55  16.701  -0.755   2.902
  427    HZ3  TRP  55           HZ3      TRP  55  13.931   2.006   4.689
  428    HH2  TRP  55           HH2      TRP  55  16.027   1.578   3.430
  429    H    ASP  56           H        ASP  56  10.379  -5.553   6.865
  430    HA   ASP  56           HA       ASP  56   8.262  -5.809   7.752
  431    HB2  ASP  56           1HB      ASP  56   8.309  -6.041  10.209
  432    HB3  ASP  56           2HB      ASP  56   9.739  -6.758   9.466
  433    H    GLU  57           H        GLU  57   7.491  -3.730   6.658
  434    HA   GLU  57           HA       GLU  57   7.050  -1.457   8.511
  435    HB2  GLU  57           1HB      GLU  57   7.865  -1.059   6.183
  436    HB3  GLU  57           2HB      GLU  57   6.357  -1.711   5.558
  437    HG2  GLU  57           1HG      GLU  57   5.093   0.068   6.737
  438    HG3  GLU  57           2HG      GLU  57   6.594   0.711   7.396
  439    H    TRP  58           H        TRP  58   5.511  -2.331   9.910
  440    HA   TRP  58           HA       TRP  58   2.906  -3.268   8.862
  441    HB2  TRP  58           1HB      TRP  58   4.132  -3.130  11.655
  442    HB3  TRP  58           2HB      TRP  58   2.460  -3.611  11.373
  443    HD1  TRP  58           HD1      TRP  58   5.986  -4.679  10.151
  444    HE1  TRP  58           HE1      TRP  58   5.992  -7.243   9.875
  445    HE3  TRP  58           HE3      TRP  58   1.126  -5.703  11.332
  446    HZ2  TRP  58           HZ2      TRP  58   4.171  -9.449  10.124
  447    HZ3  TRP  58           HZ3      TRP  58   0.285  -8.036  11.306
  448    HH2  TRP  58           HH2      TRP  58   1.800  -9.908  10.707
  449    H    VAL  59           H        VAL  59   1.267  -1.834   8.604
  450    HA   VAL  59           HA       VAL  59   1.082   0.526  10.371
  451    HB   VAL  59           HB       VAL  59   0.714   2.066   8.400
  452   HG11  VAL  59          1HG1      VAL  59   3.082   2.351   7.835
  453   HG12  VAL  59          2HG1      VAL  59   3.451   0.737   8.413
  454   HG13  VAL  59          3HG1      VAL  59   2.929   1.971   9.549
  455   HG21  VAL  59          3HG2      VAL  59   1.507   1.290   6.170
  456   HG22  VAL  59          1HG2      VAL  59   0.142   0.326   6.721
  457   HG23  VAL  59          2HG2      VAL  59   1.775  -0.324   6.826
  458    HA   PRO  60           HA       PRO  60  -3.305  -0.308  10.190
  459    HB2  PRO  60           1HB      PRO  60  -3.762   2.687  10.173
  460    HB3  PRO  60           2HB      PRO  60  -4.430   1.462  11.279
  461    HG2  PRO  60           1HG      PRO  60  -2.500   3.045  12.141
  462    HG3  PRO  60           2HG      PRO  60  -2.414   1.300  12.495
  463    HD2  PRO  60           1HD      PRO  60  -0.959   2.820  10.291
  464    HD3  PRO  60           2HD      PRO  60  -0.307   1.680  11.489
  465    H    GLU  61           H        GLU  61  -5.173  -0.119   8.827
  466    HA   GLU  61           HA       GLU  61  -4.727  -0.139   6.075
  467    HB2  GLU  61           1HB      GLU  61  -7.246   0.053   5.875
  468    HB3  GLU  61           2HB      GLU  61  -6.718  -1.183   7.010
  469    HG2  GLU  61           1HG      GLU  61  -7.078   0.391   8.902
  470    HG3  GLU  61           2HG      GLU  61  -7.610   1.627   7.769
  471    H    ASN  62           H        ASN  62  -5.169   2.571   8.154
  472    HA   ASN  62           HA       ASN  62  -6.187   4.499   6.355
  473    HB2  ASN  62           1HB      ASN  62  -4.322   4.897   8.721
  474    HB3  ASN  62           2HB      ASN  62  -5.311   6.149   7.965
  475   HD21  ASN  62          2HD2      ASN  62  -5.305   4.351  10.682
  476   HD22  ASN  62          1HD2      ASN  62  -6.969   4.097  10.893
  477    H    ARG  63           H        ARG  63  -2.823   3.544   7.060
  478    HA   ARG  63           HA       ARG  63  -1.709   5.523   5.257
  479    HB2  ARG  63           1HB      ARG  63  -0.663   4.425   7.439
  480    HB3  ARG  63           2HB      ARG  63  -0.161   3.146   6.352
  481    HG2  ARG  63           1HG      ARG  63   1.739   4.571   6.269
  482    HG3  ARG  63           2HG      ARG  63   0.835   5.165   4.884
  483    HD2  ARG  63           1HD      ARG  63  -0.153   6.958   6.377
  484    HD3  ARG  63           2HD      ARG  63   0.891   6.398   7.674
  485    HE   ARG  63           HE       ARG  63   1.635   8.051   5.442
  486   HH11  ARG  63          1HH2      ARG  63   2.818   5.573   7.582
  487   HH12  ARG  63          2HH2      ARG  63   4.475   6.051   7.425
  488   HH21  ARG  63          1HH1      ARG  63   3.791   8.677   5.262
  489   HH22  ARG  63          2HH1      ARG  63   5.026   7.811   6.111
  490    H    VAL  64           H        VAL  64  -3.323   2.698   4.685
  491    HA   VAL  64           HA       VAL  64  -1.716   1.935   2.291
  492    HB   VAL  64           HB       VAL  64  -4.063   0.440   3.558
  493   HG11  VAL  64          1HG1      VAL  64  -1.890  -0.434   1.598
  494   HG12  VAL  64          2HG1      VAL  64  -3.577  -0.150   1.186
  495   HG13  VAL  64          3HG1      VAL  64  -3.149  -1.476   2.260
  496   HG21  VAL  64          3HG2      VAL  64  -2.272  -1.030   4.550
  497   HG22  VAL  64          1HG2      VAL  64  -2.232   0.606   5.205
  498   HG23  VAL  64          2HG2      VAL  64  -1.056   0.114   3.987
  499    H    LEU  65           H        LEU  65  -2.423   2.414   0.313
  500    HA   LEU  65           HA       LEU  65  -5.206   3.449  -0.065
  501    HB2  LEU  65           1HB      LEU  65  -3.420   5.146  -0.399
  502    HB3  LEU  65           2HB      LEU  65  -2.710   4.141  -1.651
  503    HG   LEU  65           HG       LEU  65  -4.821   4.365  -3.001
  504   HD11  LEU  65          1HD1      LEU  65  -6.610   4.730  -1.511
  505   HD12  LEU  65          2HD1      LEU  65  -6.402   6.323  -2.205
  506   HD13  LEU  65          3HD1      LEU  65  -5.756   5.973  -0.601
  507   HD21  LEU  65          3HD2      LEU  65  -3.614   7.015  -2.115
  508   HD22  LEU  65          1HD2      LEU  65  -4.497   6.746  -3.619
  509   HD23  LEU  65          2HD2      LEU  65  -2.951   5.945  -3.352
  510    H    LYS  66           H        LYS  66  -6.477   2.500  -1.520
  511    HA   LYS  66           HA       LYS  66  -5.763  -0.040  -2.642
  512    HB2  LYS  66           1HB      LYS  66  -8.039   0.054  -3.655
  513    HB3  LYS  66           2HB      LYS  66  -8.054   0.426  -1.930
  514    HG2  LYS  66           1HG      LYS  66  -8.099   2.861  -2.457
  515    HG3  LYS  66           2HG      LYS  66  -8.121   2.485  -4.179
  516    HD2  LYS  66           1HD      LYS  66 -10.270   1.275  -3.896
  517    HD3  LYS  66           2HD      LYS  66 -10.252   1.645  -2.172
  518    HE2  LYS  66           1HE      LYS  66 -10.329   4.066  -2.681
  519    HE3  LYS  66           2HE      LYS  66 -10.319   3.709  -4.410
  520    HZ1  LYS  66           3HZ      LYS  66 -12.501   3.457  -4.331
  521    HZ2  LYS  66           1HZ      LYS  66 -12.514   3.779  -2.665
  522    HZ3  LYS  66           2HZ      LYS  66 -12.335   2.182  -3.221
  523    H    TYR  67           H        TYR  67  -5.694  -0.625  -4.860
  524    HA   TYR  67           HA       TYR  67  -4.349   1.366  -6.549
  525    HB2  TYR  67           1HB      TYR  67  -3.530  -0.995  -6.340
  526    HB3  TYR  67           2HB      TYR  67  -5.003  -1.565  -7.116
  527    HD1  TYR  67           HD2      TYR  67  -1.819   0.290  -7.622
  528    HD2  TYR  67           HD1      TYR  67  -5.405  -1.136  -9.546
  529    HE1  TYR  67           HE2      TYR  67  -0.815   0.749  -9.843
  530    HE2  TYR  67           HE1      TYR  67  -4.389  -0.668 -11.762
  531    HH   TYR  67           HH       TYR  67  -1.160   0.815 -12.038
  532    H    ASN  68           H        ASN  68  -5.435   2.605  -7.921
  533    HA   ASN  68           HA       ASN  68  -7.700   1.575  -9.472
  534    HB2  ASN  68           1HB      ASN  68  -8.720   2.394  -7.343
  535    HB3  ASN  68           2HB      ASN  68  -8.038   3.989  -7.641
  536   HD21  ASN  68          2HD2      ASN  68 -10.124   5.022  -7.902
  537   HD22  ASN  68          1HD2      ASN  68 -11.128   4.702  -9.231
  538    H    ASP  69           H        ASP  69  -7.915   2.584 -11.398
  539    HA   ASP  69           HA       ASP  69  -5.868   3.900 -12.636
  540    HB2  ASP  69           1HB      ASP  69  -7.847   2.959 -13.790
  541    HB3  ASP  69           2HB      ASP  69  -8.827   4.297 -13.202
  542    H    ASP  70           H        ASP  70  -8.294   5.351 -10.547
  543    HA   ASP  70           HA       ASP  70  -7.782   8.091 -11.231
  544    HB2  ASP  70           1HB      ASP  70  -8.981   6.885  -8.705
  545    HB3  ASP  70           2HB      ASP  70  -9.071   8.583  -9.181
  546    H    ASN  71           H        ASN  71  -6.664   5.976  -8.570
  547    HA   ASN  71           HA       ASN  71  -5.028   7.942  -7.298
  548    HB2  ASN  71           1HB      ASN  71  -4.702   4.912  -7.267
  549    HB3  ASN  71           2HB      ASN  71  -3.995   6.054  -6.121
  550   HD21  ASN  71          2HD2      ASN  71  -6.230   7.778  -5.714
  551   HD22  ASN  71          1HD2      ASN  71  -7.456   6.889  -4.950
  552    H    VAL  72           H        VAL  72  -4.490   5.633  -9.888
  553    HA   VAL  72           HA       VAL  72  -1.662   6.026 -10.179
  554    HB   VAL  72           HB       VAL  72  -3.751   5.165 -12.231
  555   HG11  VAL  72          1HG1      VAL  72  -1.685   5.900 -13.377
  556   HG12  VAL  72          2HG1      VAL  72  -1.784   4.147 -13.434
  557   HG13  VAL  72          3HG1      VAL  72  -0.707   4.927 -12.277
  558   HG21  VAL  72          3HG2      VAL  72  -1.882   3.512 -10.472
  559   HG22  VAL  72          1HG2      VAL  72  -2.997   2.864 -11.676
  560   HG23  VAL  72          2HG2      VAL  72  -3.622   3.670 -10.240
  561    H    LYS  73           H        LYS  73  -4.526   7.479 -11.685
  562    HA   LYS  73           HA       LYS  73  -3.255   9.287 -13.425
  563    HB2  LYS  73           1HB      LYS  73  -5.683   8.713 -13.459
  564    HB3  LYS  73           2HB      LYS  73  -5.910   9.630 -11.980
  565    HG2  LYS  73           1HG      LYS  73  -5.163  11.705 -13.132
  566    HG3  LYS  73           2HG      LYS  73  -4.917  10.779 -14.615
  567    HD2  LYS  73           1HD      LYS  73  -7.339  10.187 -14.641
  568    HD3  LYS  73           2HD      LYS  73  -7.578  11.122 -13.161
  569    HE2  LYS  73           1HE      LYS  73  -6.630  12.237 -15.831
  570    HE3  LYS  73           2HE      LYS  73  -8.239  12.448 -15.135
  571    HZ1  LYS  73           3HZ      LYS  73  -5.761  13.775 -14.485
  572    HZ2  LYS  73           1HZ      LYS  73  -6.641  13.255 -13.130
  573    HZ3  LYS  73           2HZ      LYS  73  -7.364  14.290 -14.266
  574    H    ARG  74           H        ARG  74  -4.142   9.583  -9.999
  575    HA   ARG  74           HA       ARG  74  -3.423  12.321  -9.670
  576    HB2  ARG  74           1HB      ARG  74  -3.631  10.021  -7.690
  577    HB3  ARG  74           2HB      ARG  74  -3.197  11.654  -7.180
  578    HG2  ARG  74           1HG      ARG  74  -5.321  12.529  -8.104
  579    HG3  ARG  74           2HG      ARG  74  -5.767  10.919  -8.647
  580    HD2  ARG  74           1HD      ARG  74  -5.769  10.123  -6.307
  581    HD3  ARG  74           2HD      ARG  74  -5.294  11.729  -5.751
  582    HE   ARG  74           HE       ARG  74  -7.943  10.883  -6.515
  583   HH11  ARG  74          1HH2      ARG  74  -5.778  13.603  -6.399
  584   HH12  ARG  74          2HH2      ARG  74  -7.047  14.780  -6.426
  585   HH21  ARG  74          1HH1      ARG  74  -9.591  12.434  -6.553
  586   HH22  ARG  74          2HH1      ARG  74  -9.199  14.119  -6.513
  587    H    ARG  75           H        ARG  75  -1.560   9.310  -9.430
  588    HA   ARG  75           HA       ARG  75   0.859  10.485  -8.454
  589    HB2  ARG  75           1HB      ARG  75   0.395   8.038  -8.384
  590    HB3  ARG  75           2HB      ARG  75   0.525   7.967 -10.137
  591    HG2  ARG  75           1HG      ARG  75   2.886   8.702 -10.022
  592    HG3  ARG  75           2HG      ARG  75   2.765   8.881  -8.277
  593    HD2  ARG  75           1HD      ARG  75   2.305   6.447  -8.066
  594    HD3  ARG  75           2HD      ARG  75   2.455   6.275  -9.815
  595    HE   ARG  75           HE       ARG  75   4.807   7.499  -8.881
  596   HH11  ARG  75          1HH2      ARG  75   3.125   4.467  -8.590
  597   HH12  ARG  75          2HH2      ARG  75   4.566   3.547  -8.328
  598   HH21  ARG  75          1HH1      ARG  75   6.677   6.283  -8.532
  599   HH22  ARG  75          2HH1      ARG  75   6.571   4.573  -8.294
  600    H    GLN  76           H        GLN  76  -0.427   9.859 -11.685
  601    HA   GLN  76           HA       GLN  76   1.838  10.797 -13.174
  602    HB2  GLN  76           1HB      GLN  76  -1.109  10.581 -13.900
  603    HB3  GLN  76           2HB      GLN  76   0.148  10.994 -15.064
  604    HG2  GLN  76           1HG      GLN  76   0.115   8.402 -13.447
  605    HG3  GLN  76           2HG      GLN  76  -0.495   8.541 -15.091
  606   HE21  GLN  76          2HE2      GLN  76   1.071   8.803 -16.829
  607   HE22  GLN  76          1HE2      GLN  76   2.729   8.546 -16.573
  608    H    GLU  77           H        GLU  77  -1.067  12.307 -11.856
  609    HA   GLU  77           HA       GLU  77  -0.721  14.900 -13.027
  610    HB2  GLU  77           1HB      GLU  77  -2.852  14.055 -11.964
  611    HB3  GLU  77           2HB      GLU  77  -2.085  14.212 -10.387
  612    HG2  GLU  77           1HG      GLU  77  -1.768  16.649 -10.783
  613    HG3  GLU  77           2HG      GLU  77  -2.543  16.487 -12.356
  614    H    LEU  78           H        LEU  78   0.015  13.644  -9.783
  615    HA   LEU  78           HA       LEU  78   1.387  15.875  -8.759
  616    HB2  LEU  78           1HB      LEU  78   1.630  12.909  -8.191
  617    HB3  LEU  78           2HB      LEU  78   2.454  14.108  -7.214
  618    HG   LEU  78           HG       LEU  78  -0.574  14.303  -7.605
  619   HD11  LEU  78          1HD1      LEU  78   0.840  12.646  -5.476
  620   HD12  LEU  78          2HD1      LEU  78  -0.167  12.013  -6.776
  621   HD13  LEU  78          3HD1      LEU  78  -0.891  12.997  -5.510
  622   HD21  LEU  78          3HD2      LEU  78   1.284  15.146  -5.325
  623   HD22  LEU  78          1HD2      LEU  78  -0.454  15.441  -5.386
  624   HD23  LEU  78          2HD2      LEU  78   0.611  16.229  -6.536
  625    H    ALA  79           H        ALA  79   2.515  13.123 -10.660
  626    HA   ALA  79           HA       ALA  79   5.307  13.726 -10.517
  627    HB1  ALA  79           3HB      ALA  79   5.539  12.150 -12.390
  628    HB2  ALA  79           1HB      ALA  79   3.794  12.176 -12.640
  629    HB3  ALA  79           2HB      ALA  79   4.458  11.499 -11.152
  630    H    ARG  80           H        ARG  80   2.694  14.747 -12.615
  631    HA   ARG  80           HA       ARG  80   4.232  15.995 -14.634
  632    HB2  ARG  80           1HB      ARG  80   1.675  15.444 -14.542
  633    HB3  ARG  80           2HB      ARG  80   1.497  16.967 -13.716
  634    HG2  ARG  80           1HG      ARG  80   1.259  17.854 -15.850
  635    HG3  ARG  80           2HG      ARG  80   3.013  17.796 -15.887
  636    HD2  ARG  80           1HD      ARG  80   1.184  15.587 -16.894
  637    HD3  ARG  80           2HD      ARG  80   1.990  16.774 -17.918
  638    HE   ARG  80           HE       ARG  80   3.982  15.534 -16.402
  639   HH11  ARG  80          1HH2      ARG  80   1.657  14.718 -18.847
  640   HH12  ARG  80          2HH2      ARG  80   2.563  13.370 -19.443
  641   HH21  ARG  80          1HH1      ARG  80   5.156  13.766 -17.179
  642   HH22  ARG  80          2HH1      ARG  80   4.540  12.829 -18.496
  643    H    GLN  81           H        GLN  81   2.852  17.188 -11.598
  644    HA   GLN  81           HA       GLN  81   3.641  19.893 -11.802
  645    HB2  GLN  81           1HB      GLN  81   3.165  18.112  -9.376
  646    HB3  GLN  81           2HB      GLN  81   3.342  19.870  -9.290
  647    HG2  GLN  81           1HG      GLN  81   1.375  20.145 -10.775
  648    HG3  GLN  81           2HG      GLN  81   1.199  18.395 -10.877
  649   HE21  GLN  81          2HE2      GLN  81  -0.074  21.020  -9.294
  650   HE22  GLN  81          1HE2      GLN  81  -0.597  20.261  -7.868
  651    H    CYS  82           H        CYS  82   5.299  17.030 -10.521
  652    HA   CYS  82           HA       CYS  82   7.544  18.333  -9.398
  653    HB2  CYS  82           1HB      CYS  82   7.253  15.535 -10.530
  654    HB3  CYS  82           2HB      CYS  82   8.597  16.085  -9.524
  655    HG   CYS  82           HG       CYS  82   7.166  15.930  -7.511
  656    H    GLY  83           H        GLY  83   6.837  17.204 -12.667
  657    HA2  GLY  83           1HA      GLY  83   9.430  17.487 -13.773
  658    HA3  GLY  83           2HA      GLY  83   7.914  17.487 -14.669
  659    H    GLU  84           H        GLU  84  10.014  19.114 -15.411
  660    HA   GLU  84           HA       GLU  84  10.025  21.730 -14.366
  661    HB2  GLU  84           1HB      GLU  84  10.567  20.767 -17.200
  662    HB3  GLU  84           2HB      GLU  84  11.021  22.352 -16.567
  663    HG2  GLU  84           1HG      GLU  84  12.440  21.259 -14.845
  664    HG3  GLU  84           2HG      GLU  84  11.988  19.675 -15.471
  665    H    ARG  85           H        ARG  85   8.731  23.445 -14.634
  666    HA   ARG  85           HA       ARG  85   6.852  24.696 -15.109
  667    HB2  ARG  85           1HB      ARG  85   7.259  23.448 -17.854
  668    HB3  ARG  85           2HB      ARG  85   6.274  24.874 -17.517
  669    HG2  ARG  85           1HG      ARG  85   8.283  26.064 -16.664
  670    HG3  ARG  85           2HG      ARG  85   9.271  24.641 -17.000
  671    HD2  ARG  85           1HD      ARG  85   8.702  24.820 -19.411
  672    HD3  ARG  85           2HD      ARG  85   7.744  26.265 -19.071
  673    HE   ARG  85           HE       ARG  85  10.334  26.660 -18.030
  674   HH11  ARG  85          1HH2      ARG  85   8.733  26.290 -21.093
  675   HH12  ARG  85          2HH2      ARG  85   9.893  27.236 -21.961
  676   HH21  ARG  85          1HH1      ARG  85  11.841  27.889 -19.167
  677   HH22  ARG  85          2HH1      ARG  85  11.656  28.142 -20.869
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1 -21.960 -24.513  10.712
    2    H2   MET   1           2H       MET   1 -20.872 -23.742   9.659
    3    H3   MET   1           3H       MET   1 -21.769 -25.085   9.126
    4    HA   MET   1           HA       MET   1 -23.670 -23.919   8.842
    5    HB2  MET   1           1HB      MET   1 -23.662 -23.227  11.269
    6    HB3  MET   1           2HB      MET   1 -22.622 -21.873  10.853
    7    HG2  MET   1           1HG      MET   1 -24.892 -21.018  10.943
    8    HG3  MET   1           2HG      MET   1 -24.467 -21.100   9.241
    9    HE1  MET   1           3HE      MET   1 -27.496 -23.662  11.548
   10    HE2  MET   1           1HE      MET   1 -27.211 -21.929  11.749
   11    HE3  MET   1           2HE      MET   1 -25.964 -23.089  12.199
   12    H    ASN   2           H        ASN   2 -23.951 -22.581   7.082
   13    HA   ASN   2           HA       ASN   2 -22.270 -20.333   6.463
   14    HB2  ASN   2           1HB      ASN   2 -20.701 -22.197   5.924
   15    HB3  ASN   2           2HB      ASN   2 -21.874 -22.850   4.788
   16   HD21  ASN   2          2HD2      ASN   2 -20.070 -19.791   5.452
   17   HD22  ASN   2          1HD2      ASN   2 -19.895 -19.371   3.817
   18    H    TYR   3           H        TYR   3 -23.714 -19.011   5.541
   19    HA   TYR   3           HA       TYR   3 -26.214 -19.777   4.460
   20    HB2  TYR   3           1HB      TYR   3 -24.631 -17.216   3.989
   21    HB3  TYR   3           2HB      TYR   3 -26.355 -17.426   3.677
   22    HD1  TYR   3           HD2      TYR   3 -27.979 -17.635   5.562
   23    HD2  TYR   3           HD1      TYR   3 -23.768 -17.098   6.329
   24    HE1  TYR   3           HE2      TYR   3 -28.468 -17.097   7.934
   25    HE2  TYR   3           HE1      TYR   3 -24.279 -16.566   8.697
   26    HH   TYR   3           HH       TYR   3 -25.863 -16.551  10.277
   27    H    SER   4           H        SER   4 -23.191 -18.821   2.840
   28    HA   SER   4           HA       SER   4 -23.633 -20.569   0.594
   29    HB2  SER   4           1HB      SER   4 -23.904 -18.846  -1.139
   30    HB3  SER   4           2HB      SER   4 -25.223 -18.735   0.023
   31    HG   SER   4           HG       SER   4 -23.405 -16.892  -0.646
   32    H    THR   5           H        THR   5 -21.893 -20.425  -0.975
   33    HA   THR   5           HA       THR   5 -19.347 -20.111   0.240
   34    HB   THR   5           HB       THR   5 -20.001 -20.330  -2.731
   35    HG1  THR   5           HG1      THR   5 -20.847 -22.112  -1.993
   36   HG21  THR   5          3HG2      THR   5 -17.630 -19.763  -2.300
   37   HG22  THR   5          1HG2      THR   5 -17.773 -21.434  -2.839
   38   HG23  THR   5          2HG2      THR   5 -17.518 -21.081  -1.134
   39    H    GLY   6           H        GLY   6 -17.985 -18.415   0.310
   40    HA2  GLY   6           1HA      GLY   6 -17.724 -16.332  -1.561
   41    HA3  GLY   6           2HA      GLY   6 -18.809 -15.768  -0.292
   42    H    THR   7           H        THR   7 -16.690 -14.318  -0.453
   43    HA   THR   7           HA       THR   7 -14.340 -15.209   0.905
   44    HB   THR   7           HB       THR   7 -14.199 -13.261  -0.542
   45    HG1  THR   7           HG1      THR   7 -13.750 -11.693   1.440
   46   HG21  THR   7          3HG2      THR   7 -15.371 -11.153  -0.006
   47   HG22  THR   7          1HG2      THR   7 -16.184 -11.931   1.348
   48   HG23  THR   7          2HG2      THR   7 -16.530 -12.445  -0.300
   49    H    ASP   8           H        ASP   8 -13.592 -14.473   2.972
   50    HA   ASP   8           HA       ASP   8 -15.587 -13.620   4.977
   51    HB2  ASP   8           1HB      ASP   8 -14.044 -16.237   5.208
   52    HB3  ASP   8           2HB      ASP   8 -15.087 -15.542   6.451
   53    H    ALA   9           H        ALA   9 -12.768 -13.033   3.646
   54    HA   ALA   9           HA       ALA   9 -10.913 -12.957   5.823
   55    HB1  ALA   9           3HB      ALA   9 -10.968 -11.353   3.240
   56    HB2  ALA   9           1HB      ALA   9 -10.215 -12.933   3.449
   57    HB3  ALA   9           2HB      ALA   9  -9.576 -11.532   4.312
   58    H    ASN  10           H        ASN  10 -13.747 -11.353   5.547
   59    HA   ASN  10           HA       ASN  10 -14.676  -9.481   6.472
   60    HB2  ASN  10           1HB      ASN  10 -12.200  -9.470   8.234
   61    HB3  ASN  10           2HB      ASN  10 -13.719  -8.652   8.571
   62   HD21  ASN  10          2HD2      ASN  10 -15.565 -10.695   7.831
   63   HD22  ASN  10          1HD2      ASN  10 -15.358 -12.014   8.879
   64    H    THR  11           H        THR  11 -11.240  -8.559   6.772
   65    HA   THR  11           HA       THR  11 -11.597  -5.901   5.906
   66    HB   THR  11           HB       THR  11  -9.138  -5.851   5.633
   67    HG1  THR  11           HG1      THR  11  -9.208  -8.077   4.720
   68   HG21  THR  11          3HG2      THR  11 -10.051  -5.744   7.927
   69   HG22  THR  11          1HG2      THR  11  -8.514  -6.610   7.906
   70   HG23  THR  11          2HG2      THR  11 -10.028  -7.506   8.027
   71    H    LEU  12           H        LEU  12 -10.893  -4.912   3.934
   72    HA   LEU  12           HA       LEU  12 -11.694  -6.423   1.548
   73    HB2  LEU  12           1HB      LEU  12 -10.837  -3.502   1.745
   74    HB3  LEU  12           2HB      LEU  12 -11.768  -4.262   0.451
   75    HG   LEU  12           HG       LEU  12 -12.697  -3.869   3.337
   76   HD11  LEU  12          1HD1      LEU  12 -13.589  -2.540   0.754
   77   HD12  LEU  12          2HD1      LEU  12 -12.666  -1.778   2.051
   78   HD13  LEU  12          3HD1      LEU  12 -14.329  -2.288   2.339
   79   HD21  LEU  12          3HD2      LEU  12 -13.778  -5.881   2.576
   80   HD22  LEU  12          1HD2      LEU  12 -14.055  -5.224   0.962
   81   HD23  LEU  12          2HD2      LEU  12 -14.969  -4.617   2.344
   82    H    PHE  13           H        PHE  13  -8.865  -6.141   3.188
   83    HA   PHE  13           HA       PHE  13  -7.100  -6.056   0.783
   84    HB2  PHE  13           1HB      PHE  13  -6.439  -5.865   3.750
   85    HB3  PHE  13           2HB      PHE  13  -5.291  -5.693   2.419
   86    HD1  PHE  13           HD2      PHE  13  -5.449  -3.744   0.834
   87    HD2  PHE  13           HD1      PHE  13  -8.030  -4.041   4.279
   88    HE1  PHE  13           HE2      PHE  13  -6.085  -1.361   0.577
   89    HE2  PHE  13           HE1      PHE  13  -8.657  -1.664   4.005
   90    HZ   PHE  13           HZ       PHE  13  -7.686  -0.319   2.161
   91    H    VAL  14           H        VAL  14  -6.045  -7.807   0.126
   92    HA   VAL  14           HA       VAL  14  -5.903 -10.274   1.809
   93    HB   VAL  14           HB       VAL  14  -6.680 -10.165  -1.143
   94   HG11  VAL  14          1HG1      VAL  14  -7.172 -12.608  -0.794
   95   HG12  VAL  14          2HG1      VAL  14  -6.489 -12.490   0.826
   96   HG13  VAL  14          3HG1      VAL  14  -5.463 -12.241  -0.586
   97   HG21  VAL  14          3HG2      VAL  14  -8.365 -10.746   1.334
   98   HG22  VAL  14          1HG2      VAL  14  -8.915 -10.936  -0.331
   99   HG23  VAL  14          2HG2      VAL  14  -8.519  -9.338   0.282
  100    H    ASP  15           H        ASP  15  -4.163 -11.624   1.366
  101    HA   ASP  15           HA       ASP  15  -1.709 -10.429   0.735
  102    HB2  ASP  15           1HB      ASP  15  -1.976 -12.460   2.132
  103    HB3  ASP  15           2HB      ASP  15  -2.453 -13.377   0.711
  104    H    GLY  16           H        GLY  16  -0.467 -10.348  -1.083
  105    HA2  GLY  16           1HA      GLY  16   0.264 -10.788  -3.261
  106    HA3  GLY  16           2HA      GLY  16  -1.141 -11.805  -3.544
  107    H    GLU  17           H        GLU  17  -2.380  -9.130  -2.178
  108    HA   GLU  17           HA       GLU  17  -3.403  -8.063  -4.674
  109    HB2  GLU  17           1HB      GLU  17  -4.767  -8.243  -2.598
  110    HB3  GLU  17           2HB      GLU  17  -3.746  -7.032  -1.825
  111    HG2  GLU  17           1HG      GLU  17  -4.413  -5.361  -3.533
  112    HG3  GLU  17           2HG      GLU  17  -5.378  -6.577  -4.361
  113    H    ARG  18           H        ARG  18  -2.595  -6.411  -5.812
  114    HA   ARG  18           HA       ARG  18  -0.189  -4.997  -4.984
  115    HB2  ARG  18           1HB      ARG  18  -0.596  -5.731  -7.332
  116    HB3  ARG  18           2HB      ARG  18  -1.947  -4.604  -7.443
  117    HG2  ARG  18           1HG      ARG  18  -0.405  -2.698  -7.036
  118    HG3  ARG  18           2HG      ARG  18   0.945  -3.822  -6.872
  119    HD2  ARG  18           1HD      ARG  18   0.907  -2.840  -9.135
  120    HD3  ARG  18           2HD      ARG  18   0.589  -4.575  -9.214
  121    HE   ARG  18           HE       ARG  18  -1.865  -3.155  -9.001
  122   HH11  ARG  18          1HH2      ARG  18   0.731  -3.758 -11.237
  123   HH12  ARG  18          2HH2      ARG  18  -0.268  -3.588 -12.641
  124   HH21  ARG  18          1HH1      ARG  18  -3.157  -2.937 -10.842
  125   HH22  ARG  18          2HH1      ARG  18  -2.462  -3.124 -12.417
  126    H    VAL  19           H        VAL  19  -0.154  -3.074  -3.952
  127    HA   VAL  19           HA       VAL  19  -2.461  -1.188  -4.091
  128    HB   VAL  19           HB       VAL  19  -2.402  -0.842  -1.652
  129   HG11  VAL  19          1HG1      VAL  19  -3.962  -2.543  -2.588
  130   HG12  VAL  19          2HG1      VAL  19  -3.443  -2.958  -0.954
  131   HG13  VAL  19          3HG1      VAL  19  -2.742  -3.793  -2.334
  132   HG21  VAL  19          3HG2      VAL  19  -0.259  -3.027  -1.705
  133   HG22  VAL  19          1HG2      VAL  19  -1.106  -2.559  -0.229
  134   HG23  VAL  19          2HG2      VAL  19  -0.099  -1.389  -1.076
  135    H    LEU  20           H        LEU  20  -1.892   0.930  -3.097
  136    HA   LEU  20           HA       LEU  20   0.921   1.690  -3.763
  137    HB2  LEU  20           1HB      LEU  20  -1.555   3.464  -3.674
  138    HB3  LEU  20           2HB      LEU  20   0.035   3.879  -4.314
  139    HG   LEU  20           HG       LEU  20  -1.882   1.788  -5.457
  140   HD11  LEU  20          1HD1      LEU  20  -0.971   4.477  -6.549
  141   HD12  LEU  20          2HD1      LEU  20  -2.573   4.111  -5.908
  142   HD13  LEU  20          3HD1      LEU  20  -2.024   3.336  -7.389
  143   HD21  LEU  20          3HD2      LEU  20   0.302   0.938  -5.957
  144   HD22  LEU  20          1HD2      LEU  20   0.961   2.545  -6.274
  145   HD23  LEU  20          2HD2      LEU  20  -0.161   1.799  -7.413
  146    H    CYS  21           H        CYS  21   2.137   2.752  -2.308
  147    HA   CYS  21           HA       CYS  21   0.983   3.423   0.378
  148    HB2  CYS  21           1HB      CYS  21   2.308   1.319   0.414
  149    HB3  CYS  21           2HB      CYS  21   3.705   2.191  -0.216
  150    HG   CYS  21           HG       CYS  21   2.588   2.405   2.656
  151    H    PHE  22           H        PHE  22   1.184   5.524   0.775
  152    HA   PHE  22           HA       PHE  22   3.292   7.156  -0.561
  153    HB2  PHE  22           1HB      PHE  22   1.886   9.081  -0.001
  154    HB3  PHE  22           2HB      PHE  22   0.956   7.882  -0.890
  155    HD1  PHE  22           HD1      PHE  22   1.471   9.460   2.434
  156    HD2  PHE  22           HD2      PHE  22  -0.851   6.576   0.222
  157    HE1  PHE  22           HE1      PHE  22  -0.191   9.379   4.270
  158    HE2  PHE  22           HE2      PHE  22  -2.506   6.505   2.068
  159    HZ   PHE  22           HZ       PHE  22  -2.179   7.908   4.087
  160    H    HIS  23           H        HIS  23   4.259   8.877   0.754
  161    HA   HIS  23           HA       HIS  23   4.268   8.716   3.627
  162    HB2  HIS  23           1HB      HIS  23   5.620   6.678   3.013
  163    HB3  HIS  23           2HB      HIS  23   6.778   7.721   2.197
  164    HD1  HIS  23           HD1      HIS  23   5.214   7.341   5.665
  165    HD2  HIS  23           HD2      HIS  23   8.760   8.655   3.909
  166    HE1  HIS  23           HE1      HIS  23   6.794   7.887   7.566
  167    HE2  HIS  23           HE2      HIS  23   8.959   8.691   6.513
  168    H    GLY  24           H        GLY  24   4.308  10.475   1.066
  169    HA2  GLY  24           1HA      GLY  24   5.313  12.827   2.249
  170    HA3  GLY  24           2HA      GLY  24   6.550  12.191   1.164
  171    HA   PRO  25           HA       PRO  25   3.608  15.010  -1.222
  172    HB2  PRO  25           1HB      PRO  25   6.297  15.582  -2.522
  173    HB3  PRO  25           2HB      PRO  25   4.979  16.722  -2.146
  174    HG2  PRO  25           1HG      PRO  25   7.085  16.692  -0.569
  175    HG3  PRO  25           2HG      PRO  25   5.470  16.669   0.183
  176    HD2  PRO  25           1HD      PRO  25   7.334  14.306  -0.283
  177    HD3  PRO  25           2HD      PRO  25   6.468  14.760   1.207
  178    H    LEU  26           H        LEU  26   5.321  12.216  -1.804
  179    HA   LEU  26           HA       LEU  26   4.171  11.873  -4.538
  180    HB2  LEU  26           1HB      LEU  26   6.973  11.263  -3.572
  181    HB3  LEU  26           2HB      LEU  26   6.312  10.396  -4.950
  182    HG   LEU  26           HG       LEU  26   6.309  13.462  -4.923
  183   HD11  LEU  26          1HD1      LEU  26   8.569  11.668  -5.881
  184   HD12  LEU  26          2HD1      LEU  26   8.641  12.787  -4.520
  185   HD13  LEU  26          3HD1      LEU  26   8.465  13.410  -6.158
  186   HD21  LEU  26          3HD2      LEU  26   4.963  12.323  -6.702
  187   HD22  LEU  26          1HD2      LEU  26   6.381  11.399  -7.186
  188   HD23  LEU  26          2HD2      LEU  26   6.340  13.148  -7.407
  189    H    ILE  27           H        ILE  27   3.702   9.795  -5.155
  190    HA   ILE  27           HA       ILE  27   3.064   7.916  -2.924
  191    HB   ILE  27           HB       ILE  27   1.844   8.097  -5.710
  192   HG12  ILE  27          1HG1      ILE  27   0.673   9.032  -3.048
  193   HG13  ILE  27          2HG1      ILE  27   1.351  10.118  -4.249
  194   HG21  ILE  27          1HG2      ILE  27   1.680   5.832  -4.681
  195   HG22  ILE  27          2HG2      ILE  27   0.100   6.586  -4.744
  196   HG23  ILE  27          3HG2      ILE  27   0.993   6.547  -3.227
  197   HD11  ILE  27          3HD1      ILE  27  -1.051  10.088  -4.523
  198   HD12  ILE  27          1HD1      ILE  27  -1.070   8.328  -4.604
  199   HD13  ILE  27          2HD1      ILE  27  -0.337   9.265  -5.907
  200    H    TYR  28           H        TYR  28   4.065   6.006  -2.882
  201    HA   TYR  28           HA       TYR  28   5.729   5.087  -5.200
  202    HB2  TYR  28           1HB      TYR  28   6.017   4.533  -2.215
  203    HB3  TYR  28           2HB      TYR  28   7.105   3.965  -3.484
  204    HD1  TYR  28           HD1      TYR  28   8.576   5.565  -4.722
  205    HD2  TYR  28           HD2      TYR  28   5.990   6.932  -1.549
  206    HE1  TYR  28           HE1      TYR  28   9.779   7.731  -4.661
  207    HE2  TYR  28           HE2      TYR  28   7.214   9.089  -1.499
  208    HH   TYR  28           HH       TYR  28   9.651   9.836  -2.174
  209    H    GLU  29           H        GLU  29   5.774   2.863  -5.664
  210    HA   GLU  29           HA       GLU  29   3.230   1.500  -5.324
  211    HB2  GLU  29           1HB      GLU  29   4.511   1.509  -7.469
  212    HB3  GLU  29           2HB      GLU  29   5.777   0.554  -6.705
  213    HG2  GLU  29           1HG      GLU  29   4.157  -1.282  -6.286
  214    HG3  GLU  29           2HG      GLU  29   2.865  -0.312  -6.988
  215    H    ALA  30           H        ALA  30   2.869  -0.424  -4.275
  216    HA   ALA  30           HA       ALA  30   4.974  -1.830  -2.804
  217    HB1  ALA  30           3HB      ALA  30   2.666  -0.458  -1.368
  218    HB2  ALA  30           1HB      ALA  30   4.361   0.008  -1.260
  219    HB3  ALA  30           2HB      ALA  30   3.835  -1.550  -0.622
  220    H    LYS  31           H        LYS  31   3.876  -3.675  -1.524
  221    HA   LYS  31           HA       LYS  31   1.374  -4.653  -2.778
  222    HB2  LYS  31           1HB      LYS  31   3.288  -5.479  -4.173
  223    HB3  LYS  31           2HB      LYS  31   3.951  -6.277  -2.752
  224    HG2  LYS  31           1HG      LYS  31   1.966  -7.727  -2.580
  225    HG3  LYS  31           2HG      LYS  31   1.161  -6.839  -3.869
  226    HD2  LYS  31           1HD      LYS  31   2.029  -8.913  -4.800
  227    HD3  LYS  31           2HD      LYS  31   2.967  -7.580  -5.460
  228    HE2  LYS  31           1HE      LYS  31   4.859  -8.116  -4.045
  229    HE3  LYS  31           2HE      LYS  31   3.888  -9.198  -3.040
  230    HZ1  LYS  31           3HZ      LYS  31   5.251 -10.408  -4.622
  231    HZ2  LYS  31           1HZ      LYS  31   4.504  -9.603  -5.913
  232    HZ3  LYS  31           2HZ      LYS  31   3.599 -10.650  -4.931
  233    H    VAL  32           H        VAL  32   0.347  -6.289  -1.638
  234    HA   VAL  32           HA       VAL  32   0.863  -6.275   1.261
  235    HB   VAL  32           HB       VAL  32  -1.470  -7.458  -0.322
  236   HG11  VAL  32          1HG1      VAL  32  -1.184  -6.713   2.624
  237   HG12  VAL  32          2HG1      VAL  32  -1.241  -8.354   1.992
  238   HG13  VAL  32          3HG1      VAL  32  -2.654  -7.317   1.859
  239   HG21  VAL  32          3HG2      VAL  32  -1.289  -5.021  -0.721
  240   HG22  VAL  32          1HG2      VAL  32  -1.183  -4.729   1.016
  241   HG23  VAL  32          2HG2      VAL  32  -2.669  -5.366   0.309
  242    H    LEU  33           H        LEU  33   2.077  -7.870   2.102
  243    HA   LEU  33           HA       LEU  33   2.328 -10.486   0.713
  244    HB2  LEU  33           1HB      LEU  33   4.440  -9.363   1.276
  245    HB3  LEU  33           2HB      LEU  33   3.964  -9.277   2.958
  246    HG   LEU  33           HG       LEU  33   4.027 -11.761   3.129
  247   HD11  LEU  33          1HD1      LEU  33   3.451 -12.579   0.961
  248   HD12  LEU  33          2HD1      LEU  33   5.137 -13.019   1.148
  249   HD13  LEU  33          3HD1      LEU  33   4.699 -11.619   0.165
  250   HD21  LEU  33          3HD2      LEU  33   6.078 -10.468   3.603
  251   HD22  LEU  33          1HD2      LEU  33   6.542 -10.586   1.905
  252   HD23  LEU  33          2HD2      LEU  33   6.472 -12.037   2.904
  253    H    LYS  34           H        LYS  34   1.241  -9.035   3.740
  254    HA   LYS  34           HA       LYS  34  -0.221 -11.506   4.372
  255    HB2  LYS  34           1HB      LYS  34   2.027 -11.891   5.338
  256    HB3  LYS  34           2HB      LYS  34   1.882 -10.441   6.302
  257    HG2  LYS  34           1HG      LYS  34  -0.178 -11.426   7.396
  258    HG3  LYS  34           2HG      LYS  34   0.117 -12.914   6.507
  259    HD2  LYS  34           1HD      LYS  34   1.989 -11.625   8.546
  260    HD3  LYS  34           2HD      LYS  34   0.993 -13.052   8.821
  261    HE2  LYS  34           1HE      LYS  34   3.455 -12.805   7.044
  262    HE3  LYS  34           2HE      LYS  34   3.162 -13.947   8.347
  263    HZ1  LYS  34           3HZ      LYS  34   2.760 -15.224   6.511
  264    HZ2  LYS  34           1HZ      LYS  34   2.100 -13.947   5.609
  265    HZ3  LYS  34           2HZ      LYS  34   1.189 -14.669   6.848
  266    H    THR  35           H        THR  35  -1.938 -11.177   5.706
  267    HA   THR  35           HA       THR  35  -2.509  -8.406   6.682
  268    HB   THR  35           HB       THR  35  -4.802  -8.608   5.832
  269    HG1  THR  35           HG1      THR  35  -4.416 -10.788   4.279
  270   HG21  THR  35          3HG2      THR  35  -3.068  -7.720   4.277
  271   HG22  THR  35          1HG2      THR  35  -4.367  -8.553   3.420
  272   HG23  THR  35          2HG2      THR  35  -2.814  -9.350   3.659
  273    H    LYS  36           H        LYS  36  -3.652  -8.274   8.546
  274    HA   LYS  36           HA       LYS  36  -4.301 -10.846   9.961
  275    HB2  LYS  36           1HB      LYS  36  -2.397  -9.604  10.939
  276    HB3  LYS  36           2HB      LYS  36  -3.438  -8.224  11.197
  277    HG2  LYS  36           1HG      LYS  36  -4.887  -9.554  12.711
  278    HG3  LYS  36           2HG      LYS  36  -3.922 -10.993  12.382
  279    HD2  LYS  36           1HD      LYS  36  -1.933  -9.874  13.383
  280    HD3  LYS  36           2HD      LYS  36  -2.921  -8.460  13.745
  281    HE2  LYS  36           1HE      LYS  36  -4.386  -9.856  15.190
  282    HE3  LYS  36           2HE      LYS  36  -3.387 -11.267  14.829
  283    HZ1  LYS  36           3HZ      LYS  36  -2.747 -10.259  16.921
  284    HZ2  LYS  36           1HZ      LYS  36  -2.462  -8.774  16.152
  285    HZ3  LYS  36           2HZ      LYS  36  -1.488 -10.119  15.788
  286    HA   PRO  37           HA       PRO  37  -8.273  -8.408   9.608
  287    HB2  PRO  37           1HB      PRO  37  -9.874 -10.219   8.467
  288    HB3  PRO  37           2HB      PRO  37  -8.581  -9.475   7.498
  289    HG2  PRO  37           1HG      PRO  37  -8.544 -12.137   8.933
  290    HG3  PRO  37           2HG      PRO  37  -8.161 -11.799   7.224
  291    HD2  PRO  37           1HD      PRO  37  -6.198 -11.953   9.141
  292    HD3  PRO  37           2HD      PRO  37  -6.041 -10.868   7.753
  293    H    ASP  38           H        ASP  38  -7.077 -10.533  11.659
  294    HA   ASP  38           HA       ASP  38  -9.358 -11.775  12.883
  295    HB2  ASP  38           1HB      ASP  38  -6.557 -11.178  13.887
  296    HB3  ASP  38           2HB      ASP  38  -7.713 -12.212  14.728
  297    H    ALA  39           H        ALA  39  -8.950  -8.625  12.534
  298    HA   ALA  39           HA       ALA  39 -10.564  -7.915  14.825
  299    HB1  ALA  39           3HB      ALA  39  -8.947  -6.367  15.877
  300    HB2  ALA  39           1HB      ALA  39  -7.707  -6.876  14.729
  301    HB3  ALA  39           2HB      ALA  39  -8.338  -8.023  15.906
  302    H    THR  40           H        THR  40 -11.161  -5.649  14.835
  303    HA   THR  40           HA       THR  40 -10.665  -4.127  12.337
  304    HB   THR  40           HB       THR  40 -13.057  -3.726  12.006
  305    HG1  THR  40           HG1      THR  40 -14.178  -3.967  13.750
  306   HG21  THR  40          3HG2      THR  40 -12.581  -6.713  12.332
  307   HG22  THR  40          1HG2      THR  40 -11.964  -5.780  10.966
  308   HG23  THR  40          2HG2      THR  40 -13.703  -5.938  11.223
  309    HA   PRO  41           HA       PRO  41  -9.841  -2.062  11.917
  310    HB2  PRO  41           1HB      PRO  41  -7.971  -0.289  12.812
  311    HB3  PRO  41           2HB      PRO  41  -9.644   0.229  12.484
  312    HG2  PRO  41           1HG      PRO  41  -8.455  -0.630  15.136
  313    HG3  PRO  41           2HG      PRO  41  -9.301   0.892  14.751
  314    HD2  PRO  41           1HD      PRO  41 -10.694  -1.114  15.871
  315    HD3  PRO  41           2HD      PRO  41 -11.424  -0.205  14.523
  316    H    VAL  42           H        VAL  42  -7.257  -2.119  11.710
  317    HA   VAL  42           HA       VAL  42  -5.820  -3.674  13.660
  318    HB   VAL  42           HB       VAL  42  -7.457  -5.357  12.659
  319   HG11  VAL  42          1HG1      VAL  42  -7.157  -6.193  10.406
  320   HG12  VAL  42          2HG1      VAL  42  -5.736  -5.185  10.167
  321   HG13  VAL  42          3HG1      VAL  42  -7.330  -4.442  10.312
  322   HG21  VAL  42          3HG2      VAL  42  -4.747  -6.430  11.938
  323   HG22  VAL  42          1HG2      VAL  42  -5.980  -7.141  12.959
  324   HG23  VAL  42          2HG2      VAL  42  -4.943  -5.881  13.589
  325    H    GLU  43           H        GLU  43  -3.906  -4.893  12.089
  326    HA   GLU  43           HA       GLU  43  -2.621  -2.655  10.602
  327    HB2  GLU  43           1HB      GLU  43  -0.467  -3.659  11.373
  328    HB3  GLU  43           2HB      GLU  43  -1.463  -3.092  12.715
  329    HG2  GLU  43           1HG      GLU  43  -2.273  -5.421  13.089
  330    HG3  GLU  43           2HG      GLU  43  -1.245  -5.985  11.775
  331    H    TYR  44           H        TYR  44  -1.220  -3.280   8.896
  332    HA   TYR  44           HA       TYR  44  -1.729  -5.942   7.644
  333    HB2  TYR  44           1HB      TYR  44  -1.777  -3.236   6.246
  334    HB3  TYR  44           2HB      TYR  44  -2.003  -4.806   5.482
  335    HD1  TYR  44           HD1      TYR  44  -3.556  -2.287   7.751
  336    HD2  TYR  44           HD2      TYR  44  -4.097  -6.114   5.842
  337    HE1  TYR  44           HE1      TYR  44  -5.968  -2.257   8.341
  338    HE2  TYR  44           HE2      TYR  44  -6.504  -6.061   6.437
  339    HH   TYR  44           HH       TYR  44  -7.917  -3.290   8.170
  340    H    TYR  45           H        TYR  45  -0.123  -6.711   6.323
  341    HA   TYR  45           HA       TYR  45   2.590  -5.667   6.930
  342    HB2  TYR  45           1HB      TYR  45   1.872  -8.153   7.135
  343    HB3  TYR  45           2HB      TYR  45   2.018  -8.219   5.388
  344    HD1  TYR  45           HD2      TYR  45   4.280  -7.345   4.333
  345    HD2  TYR  45           HD1      TYR  45   3.889  -8.443   8.481
  346    HE1  TYR  45           HE2      TYR  45   6.727  -7.654   4.486
  347    HE2  TYR  45           HE1      TYR  45   6.346  -8.734   8.620
  348    HH   TYR  45           HH       TYR  45   8.385  -8.639   5.784
  349    H    ILE  46           H        ILE  46   3.049  -4.025   5.619
  350    HA   ILE  46           HA       ILE  46   2.717  -4.310   2.665
  351    HB   ILE  46           HB       ILE  46   3.159  -1.782   4.323
  352   HG12  ILE  46          1HG1      ILE  46   0.987  -2.744   4.953
  353   HG13  ILE  46          2HG1      ILE  46   0.722  -1.333   3.949
  354   HG21  ILE  46          1HG2      ILE  46   3.856  -1.572   1.959
  355   HG22  ILE  46          2HG2      ILE  46   2.396  -0.631   2.249
  356   HG23  ILE  46          3HG2      ILE  46   2.291  -2.189   1.433
  357   HD11  ILE  46          3HD1      ILE  46   0.534  -3.058   1.967
  358   HD12  ILE  46          1HD1      ILE  46  -0.802  -2.914   3.101
  359   HD13  ILE  46          2HD1      ILE  46   0.333  -4.246   3.253
  360    H    HIS  47           H        HIS  47   4.463  -4.200   1.389
  361    HA   HIS  47           HA       HIS  47   7.118  -3.417   2.469
  362    HB2  HIS  47           1HB      HIS  47   8.162  -5.439   1.503
  363    HB3  HIS  47           2HB      HIS  47   6.990  -5.869   2.748
  364    HD1  HIS  47           HD1      HIS  47   7.892  -6.625  -0.664
  365    HD2  HIS  47           HD2      HIS  47   4.341  -6.576   1.511
  366    HE1  HIS  47           HE1      HIS  47   6.225  -7.989  -1.992
  367    HE2  HIS  47           HE2      HIS  47   4.040  -7.941  -0.697
  368    H    TYR  48           H        TYR  48   8.306  -2.311   1.024
  369    HA   TYR  48           HA       TYR  48   7.098  -1.464  -1.466
  370    HB2  TYR  48           1HB      TYR  48   9.874  -0.936  -0.320
  371    HB3  TYR  48           2HB      TYR  48   9.139  -0.081  -1.675
  372    HD1  TYR  48           HD2      TYR  48   7.222   1.482  -1.321
  373    HD2  TYR  48           HD1      TYR  48   9.040  -0.567   2.010
  374    HE1  TYR  48           HE2      TYR  48   6.057   2.996   0.261
  375    HE2  TYR  48           HE1      TYR  48   7.861   0.955   3.575
  376    HH   TYR  48           HH       TYR  48   5.641   3.471   2.381
  377    H    ALA  49           H        ALA  49   7.492  -2.194  -3.479
  378    HA   ALA  49           HA       ALA  49   8.814  -4.700  -3.914
  379    HB1  ALA  49           3HB      ALA  49   7.795  -2.640  -5.911
  380    HB2  ALA  49           1HB      ALA  49   6.855  -3.967  -5.231
  381    HB3  ALA  49           2HB      ALA  49   8.224  -4.311  -6.289
  382    H    GLY  50           H        GLY  50  10.824  -5.135  -4.722
  383    HA2  GLY  50           1HA      GLY  50  12.883  -4.807  -5.759
  384    HA3  GLY  50           2HA      GLY  50  12.519  -3.099  -5.964
  385    H    TRP  51           H        TRP  51  11.893  -4.109  -2.803
  386    HA   TRP  51           HA       TRP  51  14.607  -3.334  -1.794
  387    HB2  TRP  51           1HB      TRP  51  11.905  -2.386  -0.750
  388    HB3  TRP  51           2HB      TRP  51  13.472  -2.021  -0.024
  389    HD1  TRP  51           HD1      TRP  51  11.173  -0.905  -2.787
  390    HE1  TRP  51           HE1      TRP  51  12.238   1.055  -4.071
  391    HE3  TRP  51           HE3      TRP  51  15.887  -1.053  -0.844
  392    HZ2  TRP  51           HZ2      TRP  51  14.761   2.386  -4.254
  393    HZ3  TRP  51           HZ3      TRP  51  17.609   0.572  -1.590
  394    HH2  TRP  51           HH2      TRP  51  17.050   2.292  -3.291
  395    H    SER  52           H        SER  52  14.892  -3.887   0.495
  396    HA   SER  52           HA       SER  52  14.490  -6.662   0.927
  397    HB2  SER  52           1HB      SER  52  16.383  -5.439   1.909
  398    HB3  SER  52           2HB      SER  52  15.279  -4.476   2.888
  399    HG   SER  52           HG       SER  52  16.248  -6.967   3.311
  400    H    LYS  53           H        LYS  53  12.898  -7.756   1.945
  401    HA   LYS  53           HA       LYS  53  10.470  -6.376   2.814
  402    HB2  LYS  53           1HB      LYS  53  11.182  -9.329   2.630
  403    HB3  LYS  53           2HB      LYS  53   9.575  -8.690   2.991
  404    HG2  LYS  53           1HG      LYS  53   9.553  -7.510   0.798
  405    HG3  LYS  53           2HG      LYS  53  11.147  -8.174   0.428
  406    HD2  LYS  53           1HD      LYS  53  10.231 -10.471   0.537
  407    HD3  LYS  53           2HD      LYS  53   8.645  -9.825   0.947
  408    HE2  LYS  53           1HE      LYS  53   8.746 -10.363  -1.459
  409    HE3  LYS  53           2HE      LYS  53   8.578  -8.620  -1.231
  410    HZ1  LYS  53           3HZ      LYS  53  11.187  -9.984  -1.588
  411    HZ2  LYS  53           1HZ      LYS  53  10.885  -8.315  -1.613
  412    HZ3  LYS  53           2HZ      LYS  53  10.303  -9.303  -2.868
  413    H    ASN  54           H        ASN  54  13.332  -7.414   4.314
  414    HA   ASN  54           HA       ASN  54  12.324  -8.312   6.832
  415    HB2  ASN  54           1HB      ASN  54  14.630  -8.769   6.012
  416    HB3  ASN  54           2HB      ASN  54  15.022  -7.062   6.177
  417   HD21  ASN  54          2HD2      ASN  54  13.655  -9.735   8.200
  418   HD22  ASN  54          1HD2      ASN  54  14.469  -9.269   9.615
  419    H    TRP  55           H        TRP  55  12.297  -5.283   5.375
  420    HA   TRP  55           HA       TRP  55  12.732  -3.562   7.620
  421    HB2  TRP  55           1HB      TRP  55  12.818  -2.844   5.213
  422    HB3  TRP  55           2HB      TRP  55  11.073  -3.036   5.109
  423    HD1  TRP  55           HD1      TRP  55   9.635  -1.450   6.905
  424    HE1  TRP  55           HE1      TRP  55  10.113   0.971   7.642
  425    HE3  TRP  55           HE3      TRP  55  14.568  -1.105   5.635
  426    HZ2  TRP  55           HZ2      TRP  55  12.297   2.813   7.687
  427    HZ3  TRP  55           HZ3      TRP  55  15.826   0.996   6.034
  428    HH2  TRP  55           HH2      TRP  55  14.697   2.955   7.058
  429    H    ASP  56           H        ASP  56  10.053  -5.438   6.488
  430    HA   ASP  56           HA       ASP  56   7.847  -5.664   7.140
  431    HB2  ASP  56           1HB      ASP  56   9.188  -5.333   9.845
  432    HB3  ASP  56           2HB      ASP  56   7.632  -6.111   9.559
  433    H    GLU  57           H        GLU  57   7.292  -3.455   6.203
  434    HA   GLU  57           HA       GLU  57   6.932  -1.270   8.113
  435    HB2  GLU  57           1HB      GLU  57   7.566  -0.938   5.668
  436    HB3  GLU  57           2HB      GLU  57   5.947  -1.434   5.240
  437    HG2  GLU  57           1HG      GLU  57   5.992   0.994   5.277
  438    HG3  GLU  57           2HG      GLU  57   5.040   0.450   6.645
  439    H    TRP  58           H        TRP  58   5.518  -2.290   9.603
  440    HA   TRP  58           HA       TRP  58   2.847  -3.165   8.827
  441    HB2  TRP  58           1HB      TRP  58   4.452  -2.983  11.384
  442    HB3  TRP  58           2HB      TRP  58   2.705  -2.941  11.570
  443    HD1  TRP  58           HD1      TRP  58   1.493  -5.028   9.933
  444    HE1  TRP  58           HE1      TRP  58   2.110  -7.527  10.050
  445    HE3  TRP  58           HE3      TRP  58   6.171  -4.695  11.965
  446    HZ2  TRP  58           HZ2      TRP  58   4.283  -9.174  10.883
  447    HZ3  TRP  58           HZ3      TRP  58   7.493  -6.748  12.417
  448    HH2  TRP  58           HH2      TRP  58   6.555  -8.985  11.880
  449    H    VAL  59           H        VAL  59   1.250  -1.759   8.388
  450    HA   VAL  59           HA       VAL  59   1.006   0.731   9.971
  451    HB   VAL  59           HB       VAL  59   0.557   2.010   7.760
  452   HG11  VAL  59          1HG1      VAL  59   2.588   2.422   9.086
  453   HG12  VAL  59          2HG1      VAL  59   2.958   2.468   7.362
  454   HG13  VAL  59          3HG1      VAL  59   3.375   1.054   8.313
  455   HG21  VAL  59          3HG2      VAL  59   1.606   1.095   5.733
  456   HG22  VAL  59          1HG2      VAL  59   0.382  -0.028   6.325
  457   HG23  VAL  59          2HG2      VAL  59   2.094  -0.353   6.608
  458    HA   PRO  60           HA       PRO  60  -3.329  -0.257   9.677
  459    HB2  PRO  60           1HB      PRO  60  -4.515   2.094  10.362
  460    HB3  PRO  60           2HB      PRO  60  -3.487   1.227  11.529
  461    HG2  PRO  60           1HG      PRO  60  -2.690   3.483   9.676
  462    HG3  PRO  60           2HG      PRO  60  -2.496   3.395  11.444
  463    HD2  PRO  60           1HD      PRO  60  -0.440   2.725   9.820
  464    HD3  PRO  60           2HD      PRO  60  -0.751   1.780  11.295
  465    H    GLU  61           H        GLU  61  -5.329   0.352   8.526
  466    HA   GLU  61           HA       GLU  61  -5.070   0.495   5.775
  467    HB2  GLU  61           1HB      GLU  61  -7.103  -0.235   6.996
  468    HB3  GLU  61           2HB      GLU  61  -7.442   1.438   7.427
  469    HG2  GLU  61           1HG      GLU  61  -7.693   2.015   5.023
  470    HG3  GLU  61           2HG      GLU  61  -7.295   0.359   4.581
  471    H    ASN  62           H        ASN  62  -5.142   3.141   8.043
  472    HA   ASN  62           HA       ASN  62  -5.876   5.283   6.405
  473    HB2  ASN  62           1HB      ASN  62  -5.551   5.397   8.879
  474    HB3  ASN  62           2HB      ASN  62  -3.811   5.374   8.630
  475   HD21  ASN  62          2HD2      ASN  62  -6.672   7.383   8.500
  476   HD22  ASN  62          1HD2      ASN  62  -5.878   8.822   8.077
  477    H    ARG  63           H        ARG  63  -2.711   3.696   6.644
  478    HA   ARG  63           HA       ARG  63  -1.446   5.653   4.828
  479    HB2  ARG  63           1HB      ARG  63  -0.344   4.414   6.901
  480    HB3  ARG  63           2HB      ARG  63  -0.126   3.094   5.769
  481    HG2  ARG  63           1HG      ARG  63   1.920   4.227   5.418
  482    HG3  ARG  63           2HG      ARG  63   0.942   5.035   4.198
  483    HD2  ARG  63           1HD      ARG  63   2.129   6.751   5.448
  484    HD3  ARG  63           2HD      ARG  63   0.438   6.829   5.943
  485    HE   ARG  63           HE       ARG  63   1.068   6.146   8.070
  486   HH11  ARG  63          1HH2      ARG  63   3.631   5.484   5.813
  487   HH12  ARG  63          2HH2      ARG  63   4.735   4.930   7.027
  488   HH21  ARG  63          1HH1      ARG  63   2.516   5.398   9.648
  489   HH22  ARG  63          2HH1      ARG  63   4.104   4.882   9.192
  490    H    VAL  64           H        VAL  64  -3.360   2.938   4.447
  491    HA   VAL  64           HA       VAL  64  -2.148   2.207   1.801
  492    HB   VAL  64           HB       VAL  64  -3.943   0.501   3.581
  493   HG11  VAL  64          1HG1      VAL  64  -2.300  -0.180   1.105
  494   HG12  VAL  64          2HG1      VAL  64  -4.056  -0.084   1.171
  495   HG13  VAL  64          3HG1      VAL  64  -3.214  -1.340   2.069
  496   HG21  VAL  64          3HG2      VAL  64  -1.867  -0.779   4.091
  497   HG22  VAL  64          1HG2      VAL  64  -1.749   0.880   4.670
  498   HG23  VAL  64          2HG2      VAL  64  -0.922   0.405   3.189
  499    H    LEU  65           H        LEU  65  -3.433   2.200   0.019
  500    HA   LEU  65           HA       LEU  65  -6.324   2.884   0.272
  501    HB2  LEU  65           1HB      LEU  65  -6.117   4.504  -1.562
  502    HB3  LEU  65           2HB      LEU  65  -5.177   4.997  -0.169
  503    HG   LEU  65           HG       LEU  65  -3.528   3.385  -2.089
  504   HD11  LEU  65          1HD1      LEU  65  -4.708   6.010  -3.068
  505   HD12  LEU  65          2HD1      LEU  65  -4.961   4.422  -3.789
  506   HD13  LEU  65          3HD1      LEU  65  -3.362   5.162  -3.830
  507   HD21  LEU  65          3HD2      LEU  65  -3.195   6.227  -1.018
  508   HD22  LEU  65          1HD2      LEU  65  -1.942   5.240  -1.779
  509   HD23  LEU  65          2HD2      LEU  65  -2.605   4.770  -0.215
  510    H    LYS  66           H        LYS  66  -7.566   2.407  -1.600
  511    HA   LYS  66           HA       LYS  66  -7.029  -0.151  -2.728
  512    HB2  LYS  66           1HB      LYS  66  -9.104   1.984  -3.337
  513    HB3  LYS  66           2HB      LYS  66  -9.185   0.330  -3.937
  514    HG2  LYS  66           1HG      LYS  66  -9.817  -0.564  -1.848
  515    HG3  LYS  66           2HG      LYS  66  -8.862   0.590  -0.929
  516    HD2  LYS  66           1HD      LYS  66 -10.549   2.358  -1.379
  517    HD3  LYS  66           2HD      LYS  66 -11.517   1.200  -2.291
  518    HE2  LYS  66           1HE      LYS  66 -10.773   0.906   0.648
  519    HE3  LYS  66           2HE      LYS  66 -12.335   1.475   0.057
  520    HZ1  LYS  66           3HZ      LYS  66 -11.128  -1.205  -0.240
  521    HZ2  LYS  66           1HZ      LYS  66 -12.388  -0.683  -1.250
  522    HZ3  LYS  66           2HZ      LYS  66 -12.633  -0.784   0.427
  523    H    TYR  67           H        TYR  67  -6.358  -0.698  -4.792
  524    HA   TYR  67           HA       TYR  67  -4.931   1.303  -6.354
  525    HB2  TYR  67           1HB      TYR  67  -4.048  -1.001  -6.055
  526    HB3  TYR  67           2HB      TYR  67  -5.437  -1.652  -6.916
  527    HD1  TYR  67           HD2      TYR  67  -5.743  -1.173  -9.380
  528    HD2  TYR  67           HD1      TYR  67  -2.210   0.130  -7.278
  529    HE1  TYR  67           HE2      TYR  67  -4.591  -0.771 -11.539
  530    HE2  TYR  67           HE1      TYR  67  -1.076   0.530  -9.447
  531    HH   TYR  67           HH       TYR  67  -1.554   0.885 -11.732
  532    H    ASN  68           H        ASN  68  -5.789   2.432  -7.983
  533    HA   ASN  68           HA       ASN  68  -7.951   1.347  -9.677
  534    HB2  ASN  68           1HB      ASN  68  -8.258   3.923  -8.078
  535    HB3  ASN  68           2HB      ASN  68  -9.394   3.328  -9.291
  536   HD21  ASN  68          2HD2      ASN  68  -8.756   3.306  -5.953
  537   HD22  ASN  68          1HD2      ASN  68  -9.713   1.971  -5.533
  538    H    ASP  69           H        ASP  69  -8.279   2.553 -11.595
  539    HA   ASP  69           HA       ASP  69  -5.915   3.522 -12.797
  540    HB2  ASP  69           1HB      ASP  69  -7.433   4.123 -14.691
  541    HB3  ASP  69           2HB      ASP  69  -7.684   2.478 -14.114
  542    H    ASP  70           H        ASP  70  -8.320   5.105 -10.865
  543    HA   ASP  70           HA       ASP  70  -7.678   7.812 -11.834
  544    HB2  ASP  70           1HB      ASP  70 -10.032   7.142 -11.291
  545    HB3  ASP  70           2HB      ASP  70  -9.564   6.928  -9.609
  546    H    ASN  71           H        ASN  71  -6.920   5.669  -9.159
  547    HA   ASN  71           HA       ASN  71  -5.840   7.758  -7.421
  548    HB2  ASN  71           1HB      ASN  71  -5.554   4.732  -7.334
  549    HB3  ASN  71           2HB      ASN  71  -5.010   5.834  -6.069
  550   HD21  ASN  71          2HD2      ASN  71  -7.511   7.586  -6.579
  551   HD22  ASN  71          1HD2      ASN  71  -8.757   6.738  -5.802
  552    H    VAL  72           H        VAL  72  -4.495   5.206  -9.504
  553    HA   VAL  72           HA       VAL  72  -1.760   5.809  -9.094
  554    HB   VAL  72           HB       VAL  72  -2.612   3.725 -10.171
  555   HG11  VAL  72          1HG1      VAL  72  -3.371   3.690 -12.477
  556   HG12  VAL  72          2HG1      VAL  72  -3.013   5.404 -12.690
  557   HG13  VAL  72          3HG1      VAL  72  -4.324   4.904 -11.628
  558   HG21  VAL  72          3HG2      VAL  72  -0.819   3.537 -11.875
  559   HG22  VAL  72          1HG2      VAL  72  -0.233   4.379 -10.441
  560   HG23  VAL  72          2HG2      VAL  72  -0.642   5.291 -11.893
  561    H    LYS  73           H        LYS  73  -4.257   7.267 -10.971
  562    HA   LYS  73           HA       LYS  73  -2.701   8.860 -12.740
  563    HB2  LYS  73           1HB      LYS  73  -5.133   8.352 -12.990
  564    HB3  LYS  73           2HB      LYS  73  -5.475   9.418 -11.651
  565    HG2  LYS  73           1HG      LYS  73  -4.406  11.310 -12.920
  566    HG3  LYS  73           2HG      LYS  73  -4.232  10.233 -14.301
  567    HD2  LYS  73           1HD      LYS  73  -6.903  10.939 -12.987
  568    HD3  LYS  73           2HD      LYS  73  -6.276  11.718 -14.431
  569    HE2  LYS  73           1HE      LYS  73  -6.223   9.425 -15.548
  570    HE3  LYS  73           2HE      LYS  73  -7.114   8.804 -14.159
  571    HZ1  LYS  73           3HZ      LYS  73  -8.226  11.213 -15.241
  572    HZ2  LYS  73           1HZ      LYS  73  -8.981   9.751 -14.832
  573    HZ3  LYS  73           2HZ      LYS  73  -8.222   9.920 -16.342
  574    H    ARG  74           H        ARG  74  -3.856   9.333  -9.413
  575    HA   ARG  74           HA       ARG  74  -3.194  12.059  -9.108
  576    HB2  ARG  74           1HB      ARG  74  -3.081   9.871  -6.991
  577    HB3  ARG  74           2HB      ARG  74  -3.073  11.599  -6.667
  578    HG2  ARG  74           1HG      ARG  74  -5.306  11.832  -7.687
  579    HG3  ARG  74           2HG      ARG  74  -5.320  10.115  -8.079
  580    HD2  ARG  74           1HD      ARG  74  -6.614  10.486  -6.029
  581    HD3  ARG  74           2HD      ARG  74  -5.154   9.575  -5.639
  582    HE   ARG  74           HE       ARG  74  -4.645  12.355  -5.341
  583   HH11  ARG  74          1HH2      ARG  74  -6.477   9.778  -3.883
  584   HH12  ARG  74          2HH2      ARG  74  -6.393  10.446  -2.288
  585   HH21  ARG  74          1HH1      ARG  74  -4.548  13.216  -3.240
  586   HH22  ARG  74          2HH1      ARG  74  -5.305  12.381  -1.927
  587    H    ARG  75           H        ARG  75  -1.237   9.133  -8.954
  588    HA   ARG  75           HA       ARG  75   1.153  10.387  -7.951
  589    HB2  ARG  75           1HB      ARG  75   0.747   7.905  -7.879
  590    HB3  ARG  75           2HB      ARG  75   0.927   7.845  -9.622
  591    HG2  ARG  75           1HG      ARG  75   3.247   8.676  -9.459
  592    HG3  ARG  75           2HG      ARG  75   3.083   8.850  -7.712
  593    HD2  ARG  75           1HD      ARG  75   4.273   6.765  -8.237
  594    HD3  ARG  75           2HD      ARG  75   2.703   6.392  -7.524
  595    HE   ARG  75           HE       ARG  75   2.475   6.495 -10.356
  596   HH11  ARG  75          1HH2      ARG  75   3.829   4.541  -7.809
  597   HH12  ARG  75          2HH2      ARG  75   3.704   3.065  -8.704
  598   HH21  ARG  75          1HH1      ARG  75   2.323   4.561 -11.506
  599   HH22  ARG  75          2HH1      ARG  75   2.854   3.078 -10.790
  600    H    GLN  76           H        GLN  76  -0.175   9.703 -11.141
  601    HA   GLN  76           HA       GLN  76   2.059  10.614 -12.683
  602    HB2  GLN  76           1HB      GLN  76  -0.888  10.468 -13.431
  603    HB3  GLN  76           2HB      GLN  76   0.418  10.772 -14.567
  604    HG2  GLN  76           1HG      GLN  76   1.425   8.583 -14.035
  605    HG3  GLN  76           2HG      GLN  76   0.164   8.270 -12.850
  606   HE21  GLN  76          2HE2      GLN  76   0.016   6.291 -14.502
  607   HE22  GLN  76          1HE2      GLN  76  -1.098   6.493 -15.765
  608    H    GLU  77           H        GLU  77  -0.806  12.193 -11.335
  609    HA   GLU  77           HA       GLU  77  -0.410  14.776 -12.518
  610    HB2  GLU  77           1HB      GLU  77  -1.801  13.929  -9.943
  611    HB3  GLU  77           2HB      GLU  77  -1.824  15.591 -10.523
  612    HG2  GLU  77           1HG      GLU  77  -2.866  13.218 -12.132
  613    HG3  GLU  77           2HG      GLU  77  -3.884  14.272 -11.163
  614    H    LEU  78           H        LEU  78   0.514  13.442  -9.353
  615    HA   LEU  78           HA       LEU  78   1.985  15.681  -8.424
  616    HB2  LEU  78           1HB      LEU  78   2.129  12.722  -7.773
  617    HB3  LEU  78           2HB      LEU  78   3.048  13.919  -6.870
  618    HG   LEU  78           HG       LEU  78  -0.003  14.130  -7.135
  619   HD11  LEU  78          1HD1      LEU  78   1.548  12.698  -4.937
  620   HD12  LEU  78          2HD1      LEU  78   0.491  11.930  -6.121
  621   HD13  LEU  78          3HD1      LEU  78  -0.189  13.019  -4.919
  622   HD21  LEU  78          3HD2      LEU  78   1.128  16.183  -6.298
  623   HD22  LEU  78          1HD2      LEU  78   1.985  15.236  -5.086
  624   HD23  LEU  78          2HD2      LEU  78   0.237  15.437  -4.989
  625    H    ALA  79           H        ALA  79   2.842  12.947 -10.448
  626    HA   ALA  79           HA       ALA  79   5.672  13.282 -10.411
  627    HB1  ALA  79           3HB      ALA  79   5.685  11.880 -12.413
  628    HB2  ALA  79           1HB      ALA  79   3.961  12.151 -12.649
  629    HB3  ALA  79           2HB      ALA  79   4.523  11.243 -11.248
  630    H    ARG  80           H        ARG  80   3.127  14.701 -12.430
  631    HA   ARG  80           HA       ARG  80   4.873  16.110 -14.224
  632    HB2  ARG  80           1HB      ARG  80   1.951  16.485 -13.450
  633    HB3  ARG  80           2HB      ARG  80   2.737  17.491 -14.668
  634    HG2  ARG  80           1HG      ARG  80   3.247  15.497 -16.029
  635    HG3  ARG  80           2HG      ARG  80   2.538  14.449 -14.809
  636    HD2  ARG  80           1HD      ARG  80   0.338  15.527 -15.143
  637    HD3  ARG  80           2HD      ARG  80   1.038  16.607 -16.349
  638    HE   ARG  80           HE       ARG  80   0.251  13.855 -16.739
  639   HH11  ARG  80          1HH2      ARG  80   2.468  16.325 -17.776
  640   HH12  ARG  80          2HH2      ARG  80   2.726  15.624 -19.338
  641   HH21  ARG  80          1HH1      ARG  80   0.598  12.946 -18.788
  642   HH22  ARG  80          2HH1      ARG  80   1.668  13.716 -19.908
  643    H    GLN  81           H        GLN  81   3.182  17.008 -11.231
  644    HA   GLN  81           HA       GLN  81   4.048  19.719 -11.132
  645    HB2  GLN  81           1HB      GLN  81   3.194  17.803  -8.928
  646    HB3  GLN  81           2HB      GLN  81   3.425  19.539  -8.689
  647    HG2  GLN  81           1HG      GLN  81   1.674  20.021 -10.365
  648    HG3  GLN  81           2HG      GLN  81   1.454  18.301 -10.658
  649   HE21  GLN  81          2HE2      GLN  81  -0.443  20.406  -9.475
  650   HE22  GLN  81          1HE2      GLN  81  -0.950  19.724  -8.006
  651    H    CYS  82           H        CYS  82   5.408  16.710  -9.824
  652    HA   CYS  82           HA       CYS  82   7.527  17.857  -8.335
  653    HB2  CYS  82           1HB      CYS  82   6.751  15.520  -8.068
  654    HB3  CYS  82           2HB      CYS  82   7.385  15.128  -9.665
  655    HG   CYS  82           HG       CYS  82   9.806  15.774  -8.708
  656    H    GLY  83           H        GLY  83   7.332  16.734 -11.699
  657    HA2  GLY  83           1HA      GLY  83   9.235  18.569 -12.690
  658    HA3  GLY  83           2HA      GLY  83  10.037  17.022 -12.411
  659    H    GLU  84           H        GLU  84  10.247  17.443 -14.848
  660    HA   GLU  84           HA       GLU  84   8.563  15.580 -16.235
  661    HB2  GLU  84           1HB      GLU  84   7.591  17.199 -17.893
  662    HB3  GLU  84           2HB      GLU  84   6.950  17.418 -16.266
  663    HG2  GLU  84           1HG      GLU  84   8.553  19.287 -15.886
  664    HG3  GLU  84           2HG      GLU  84   9.166  19.089 -17.526
  665    H    ARG  85           H        ARG  85  11.345  17.223 -15.816
  666    HA   ARG  85           HA       ARG  85  13.340  17.404 -16.953
  667    HB2  ARG  85           1HB      ARG  85  12.190  15.035 -18.479
  668    HB3  ARG  85           2HB      ARG  85  13.887  15.516 -18.472
  669    HG2  ARG  85           1HG      ARG  85  13.988  15.148 -16.019
  670    HG3  ARG  85           2HG      ARG  85  12.290  14.679 -16.015
  671    HD2  ARG  85           1HD      ARG  85  12.811  12.779 -17.532
  672    HD3  ARG  85           2HD      ARG  85  14.510  13.245 -17.517
  673    HE   ARG  85           HE       ARG  85  14.724  12.286 -15.415
  674   HH11  ARG  85          1HH2      ARG  85  11.359  12.766 -16.146
  675   HH12  ARG  85          2HH2      ARG  85  10.798  11.916 -14.745
  676   HH21  ARG  85          1HH1      ARG  85  13.980  11.183 -13.586
  677   HH22  ARG  85          2HH1      ARG  85  12.280  11.023 -13.300
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1 -25.988  -8.293   5.709
    2    H2   MET   1           2H       MET   1 -26.802  -8.992   7.023
    3    H3   MET   1           3H       MET   1 -27.679  -8.226   5.787
    4    HA   MET   1           HA       MET   1 -26.444 -10.872   5.840
    5    HB2  MET   1           1HB      MET   1 -28.901  -9.643   4.521
    6    HB3  MET   1           2HB      MET   1 -28.481 -11.355   4.438
    7    HG2  MET   1           1HG      MET   1 -28.627 -11.510   6.910
    8    HG3  MET   1           2HG      MET   1 -29.061  -9.800   6.991
    9    HE1  MET   1           3HE      MET   1 -30.819 -11.720   8.416
   10    HE2  MET   1           1HE      MET   1 -32.448 -11.299   7.867
   11    HE3  MET   1           2HE      MET   1 -31.266 -10.032   8.184
   12    H    ASN   2           H        ASN   2 -24.819  -8.783   4.775
   13    HA   ASN   2           HA       ASN   2 -24.954  -8.558   1.946
   14    HB2  ASN   2           1HB      ASN   2 -22.580  -7.801   2.153
   15    HB3  ASN   2           2HB      ASN   2 -23.643  -7.000   3.307
   16   HD21  ASN   2          2HD2      ASN   2 -22.295  -6.684   5.115
   17   HD22  ASN   2          1HD2      ASN   2 -21.424  -7.920   5.884
   18    H    TYR   3           H        TYR   3 -23.672  -9.598   0.347
   19    HA   TYR   3           HA       TYR   3 -22.015 -11.881   0.882
   20    HB2  TYR   3           1HB      TYR   3 -24.262 -12.884   1.333
   21    HB3  TYR   3           2HB      TYR   3 -24.777 -12.441  -0.288
   22    HD1  TYR   3           HD2      TYR   3 -22.515 -14.654   1.682
   23    HD2  TYR   3           HD1      TYR   3 -23.920 -13.670  -2.274
   24    HE1  TYR   3           HE2      TYR   3 -21.476 -16.720   0.788
   25    HE2  TYR   3           HE1      TYR   3 -22.871 -15.740  -3.151
   26    HH   TYR   3           HH       TYR   3 -20.734 -17.687  -1.211
   27    H    SER   4           H        SER   4 -23.442  -9.560  -1.138
   28    HA   SER   4           HA       SER   4 -22.852 -10.518  -3.726
   29    HB2  SER   4           1HB      SER   4 -22.995  -8.163  -4.419
   30    HB3  SER   4           2HB      SER   4 -24.265  -8.527  -3.249
   31    HG   SER   4           HG       SER   4 -23.276  -7.327  -1.786
   32    H    THR   5           H        THR   5 -20.853  -8.966  -1.295
   33    HA   THR   5           HA       THR   5 -18.622  -8.271  -2.886
   34    HB   THR   5           HB       THR   5 -17.380  -8.218  -0.753
   35    HG1  THR   5           HG1      THR   5 -19.687  -9.561   0.204
   36   HG21  THR   5          3HG2      THR   5 -20.249  -7.256  -0.424
   37   HG22  THR   5          1HG2      THR   5 -18.960  -6.360  -1.229
   38   HG23  THR   5          2HG2      THR   5 -18.861  -6.690   0.503
   39    H    GLY   6           H        GLY   6 -19.323 -11.210  -1.012
   40    HA2  GLY   6           1HA      GLY   6 -18.455 -13.345  -1.086
   41    HA3  GLY   6           2HA      GLY   6 -18.127 -13.029  -2.786
   42    H    THR   7           H        THR   7 -16.838 -12.755   0.475
   43    HA   THR   7           HA       THR   7 -14.114 -13.200  -0.494
   44    HB   THR   7           HB       THR   7 -14.172 -10.784  -0.714
   45    HG1  THR   7           HG1      THR   7 -13.031 -11.279   1.821
   46   HG21  THR   7          3HG2      THR   7 -16.165 -10.323   0.688
   47   HG22  THR   7          1HG2      THR   7 -14.805  -9.314   1.172
   48   HG23  THR   7          2HG2      THR   7 -15.241 -10.718   2.136
   49    H    ASP   8           H        ASP   8 -12.819 -14.113   1.014
   50    HA   ASP   8           HA       ASP   8 -14.004 -15.331   3.311
   51    HB2  ASP   8           1HB      ASP   8 -11.083 -15.079   2.524
   52    HB3  ASP   8           2HB      ASP   8 -11.727 -16.200   3.724
   53    H    ALA   9           H        ALA   9 -11.162 -13.194   3.236
   54    HA   ALA   9           HA       ALA   9 -11.278 -12.544   5.998
   55    HB1  ALA   9           3HB      ALA   9  -9.219 -12.364   4.641
   56    HB2  ALA   9           1HB      ALA   9  -9.587 -10.831   5.434
   57    HB3  ALA   9           2HB      ALA   9  -9.936 -11.045   3.716
   58    H    ASN  10           H        ASN  10 -12.192 -10.845   7.079
   59    HA   ASN  10           HA       ASN  10 -14.486  -9.542   6.014
   60    HB2  ASN  10           1HB      ASN  10 -14.189 -10.009   8.430
   61    HB3  ASN  10           2HB      ASN  10 -12.861  -8.854   8.494
   62   HD21  ASN  10          2HD2      ASN  10 -16.268  -8.849   7.247
   63   HD22  ASN  10          1HD2      ASN  10 -16.649  -7.332   7.907
   64    H    THR  11           H        THR  11 -11.139  -8.468   6.524
   65    HA   THR  11           HA       THR  11 -11.546  -5.734   5.808
   66    HB   THR  11           HB       THR  11  -9.087  -5.655   5.598
   67    HG1  THR  11           HG1      THR  11  -8.219  -7.397   4.859
   68   HG21  THR  11          3HG2      THR  11 -10.063  -5.651   7.875
   69   HG22  THR  11          1HG2      THR  11  -8.505  -6.479   7.855
   70   HG23  THR  11          2HG2      THR  11  -9.999  -7.415   7.906
   71    H    LEU  12           H        LEU  12 -10.735  -4.702   3.871
   72    HA   LEU  12           HA       LEU  12 -11.499  -6.154   1.424
   73    HB2  LEU  12           1HB      LEU  12 -10.671  -3.236   1.730
   74    HB3  LEU  12           2HB      LEU  12 -11.547  -3.961   0.382
   75    HG   LEU  12           HG       LEU  12 -12.583  -3.668   3.241
   76   HD11  LEU  12          1HD1      LEU  12 -13.408  -2.253   0.681
   77   HD12  LEU  12          2HD1      LEU  12 -12.491  -1.533   2.007
   78   HD13  LEU  12          3HD1      LEU  12 -14.160  -2.041   2.264
   79   HD21  LEU  12          3HD2      LEU  12 -13.626  -5.647   2.384
   80   HD22  LEU  12          1HD2      LEU  12 -13.833  -4.958   0.774
   81   HD23  LEU  12          2HD2      LEU  12 -14.813  -4.384   2.125
   82    H    PHE  13           H        PHE  13  -8.697  -5.794   3.150
   83    HA   PHE  13           HA       PHE  13  -6.873  -5.595   0.814
   84    HB2  PHE  13           1HB      PHE  13  -6.277  -5.747   3.800
   85    HB3  PHE  13           2HB      PHE  13  -5.102  -5.442   2.521
   86    HD1  PHE  13           HD1      PHE  13  -5.423  -3.398   0.991
   87    HD2  PHE  13           HD2      PHE  13  -7.603  -3.879   4.684
   88    HE1  PHE  13           HE1      PHE  13  -5.990  -0.984   0.989
   89    HE2  PHE  13           HE2      PHE  13  -8.149  -1.464   4.670
   90    HZ   PHE  13           HZ       PHE  13  -7.343  -0.015   2.825
   91    H    VAL  14           H        VAL  14  -6.458  -7.433  -0.209
   92    HA   VAL  14           HA       VAL  14  -6.359 -10.037   1.273
   93    HB   VAL  14           HB       VAL  14  -6.656  -9.559  -1.724
   94   HG11  VAL  14          1HG1      VAL  14  -7.363 -11.953  -1.738
   95   HG12  VAL  14          2HG1      VAL  14  -7.025 -12.053  -0.012
   96   HG13  VAL  14          3HG1      VAL  14  -5.711 -11.780  -1.151
   97   HG21  VAL  14          3HG2      VAL  14  -9.052 -10.154  -1.361
   98   HG22  VAL  14          1HG2      VAL  14  -8.623  -8.673  -0.509
   99   HG23  VAL  14          2HG2      VAL  14  -8.772 -10.188   0.380
  100    H    ASP  15           H        ASP  15  -4.531 -11.225   1.267
  101    HA   ASP  15           HA       ASP  15  -2.025 -10.040   0.795
  102    HB2  ASP  15           1HB      ASP  15  -1.127 -12.319   1.246
  103    HB3  ASP  15           2HB      ASP  15  -2.349 -11.840   2.423
  104    H    GLY  16           H        GLY  16  -0.529 -10.254  -0.813
  105    HA2  GLY  16           1HA      GLY  16   0.433 -10.965  -2.837
  106    HA3  GLY  16           2HA      GLY  16  -0.984 -11.937  -3.183
  107    H    GLU  17           H        GLU  17  -2.212  -9.086  -2.242
  108    HA   GLU  17           HA       GLU  17  -2.774  -8.217  -4.985
  109    HB2  GLU  17           1HB      GLU  17  -4.545  -8.352  -3.196
  110    HB3  GLU  17           2HB      GLU  17  -3.743  -7.037  -2.346
  111    HG2  GLU  17           1HG      GLU  17  -5.580  -6.100  -3.658
  112    HG3  GLU  17           2HG      GLU  17  -4.075  -5.581  -4.393
  113    H    ARG  18           H        ARG  18  -1.984  -6.451  -5.963
  114    HA   ARG  18           HA       ARG  18   0.293  -5.039  -4.823
  115    HB2  ARG  18           1HB      ARG  18   0.178  -5.709  -7.218
  116    HB3  ARG  18           2HB      ARG  18  -1.167  -4.598  -7.461
  117    HG2  ARG  18           1HG      ARG  18   0.287  -2.682  -6.829
  118    HG3  ARG  18           2HG      ARG  18   1.626  -3.792  -6.534
  119    HD2  ARG  18           1HD      ARG  18   1.821  -2.747  -8.772
  120    HD3  ARG  18           2HD      ARG  18   1.571  -4.488  -8.915
  121    HE   ARG  18           HE       ARG  18  -0.940  -3.181  -8.958
  122   HH11  ARG  18          1HH2      ARG  18   1.921  -3.561 -10.899
  123   HH12  ARG  18          2HH2      ARG  18   1.078  -3.382 -12.401
  124   HH21  ARG  18          1HH1      ARG  18  -2.027  -2.956 -10.921
  125   HH22  ARG  18          2HH1      ARG  18  -1.152  -3.042 -12.413
  126    H    VAL  19           H        VAL  19   0.273  -3.032  -3.931
  127    HA   VAL  19           HA       VAL  19  -2.125  -1.273  -4.153
  128    HB   VAL  19           HB       VAL  19  -2.073  -0.830  -1.708
  129   HG11  VAL  19          1HG1      VAL  19  -3.643  -2.520  -2.598
  130   HG12  VAL  19          2HG1      VAL  19  -3.099  -2.966  -0.982
  131   HG13  VAL  19          3HG1      VAL  19  -2.427  -3.776  -2.391
  132   HG21  VAL  19          3HG2      VAL  19  -0.790  -2.430  -0.226
  133   HG22  VAL  19          1HG2      VAL  19   0.263  -1.400  -1.191
  134   HG23  VAL  19          2HG2      VAL  19  -0.004  -3.071  -1.665
  135    H    LEU  20           H        LEU  20  -1.677   0.874  -3.137
  136    HA   LEU  20           HA       LEU  20   1.089   1.775  -3.839
  137    HB2  LEU  20           1HB      LEU  20  -1.491   3.379  -3.919
  138    HB3  LEU  20           2HB      LEU  20   0.085   3.884  -4.499
  139    HG   LEU  20           HG       LEU  20  -1.605   1.614  -5.634
  140   HD11  LEU  20          1HD1      LEU  20  -1.805   3.069  -7.625
  141   HD12  LEU  20          2HD1      LEU  20  -0.881   4.326  -6.801
  142   HD13  LEU  20          3HD1      LEU  20  -2.461   3.845  -6.189
  143   HD21  LEU  20          3HD2      LEU  20   0.584   0.874  -6.080
  144   HD22  LEU  20          1HD2      LEU  20   1.224   2.499  -6.275
  145   HD23  LEU  20          2HD2      LEU  20   0.230   1.789  -7.540
  146    H    CYS  21           H        CYS  21   2.196   3.001  -2.436
  147    HA   CYS  21           HA       CYS  21   0.959   3.718   0.203
  148    HB2  CYS  21           1HB      CYS  21   2.442   1.732   0.380
  149    HB3  CYS  21           2HB      CYS  21   3.777   2.675  -0.279
  150    HG   CYS  21           HG       CYS  21   2.703   4.195   2.047
  151    H    PHE  22           H        PHE  22   1.055   5.815   0.603
  152    HA   PHE  22           HA       PHE  22   3.092   7.531  -0.766
  153    HB2  PHE  22           1HB      PHE  22   1.523   9.362  -0.561
  154    HB3  PHE  22           2HB      PHE  22   0.717   8.001  -1.328
  155    HD1  PHE  22           HD2      PHE  22  -1.012   6.679  -0.099
  156    HD2  PHE  22           HD1      PHE  22   0.896  10.075   1.738
  157    HE1  PHE  22           HE2      PHE  22  -2.756   6.712   1.661
  158    HE2  PHE  22           HE1      PHE  22  -0.849  10.098   3.498
  159    HZ   PHE  22           HZ       PHE  22  -2.676   8.420   3.459
  160    H    HIS  23           H        HIS  23   3.404   9.626   0.581
  161    HA   HIS  23           HA       HIS  23   3.542   9.181   3.488
  162    HB2  HIS  23           1HB      HIS  23   6.045   9.617   1.801
  163    HB3  HIS  23           2HB      HIS  23   5.984   9.550   3.564
  164    HD1  HIS  23           HD1      HIS  23   5.562   7.390   0.499
  165    HD2  HIS  23           HD2      HIS  23   5.794   6.931   4.636
  166    HE1  HIS  23           HE1      HIS  23   5.723   4.901   0.935
  167    HE2  HIS  23           HE2      HIS  23   5.869   4.604   3.452
  168    H    GLY  24           H        GLY  24   3.937  11.205   0.667
  169    HA2  GLY  24           1HA      GLY  24   2.671  13.434   1.400
  170    HA3  GLY  24           2HA      GLY  24   4.219  13.702   2.183
  171    HA   PRO  25           HA       PRO  25   6.201  15.054  -1.532
  172    HB2  PRO  25           1HB      PRO  25   7.834  12.514  -1.850
  173    HB3  PRO  25           2HB      PRO  25   8.400  14.198  -1.793
  174    HG2  PRO  25           1HG      PRO  25   8.728  12.631   0.330
  175    HG3  PRO  25           2HG      PRO  25   8.186  14.312   0.553
  176    HD2  PRO  25           1HD      PRO  25   6.506  11.778   0.622
  177    HD3  PRO  25           2HD      PRO  25   6.462  13.186   1.708
  178    H    LEU  26           H        LEU  26   5.766  11.540  -2.064
  179    HA   LEU  26           HA       LEU  26   3.982  11.971  -4.355
  180    HB2  LEU  26           1HB      LEU  26   6.679  12.025  -4.987
  181    HB3  LEU  26           2HB      LEU  26   6.383  10.302  -5.097
  182    HG   LEU  26           HG       LEU  26   4.295  11.024  -6.611
  183   HD11  LEU  26          1HD1      LEU  26   4.680  13.511  -6.086
  184   HD12  LEU  26          2HD1      LEU  26   4.494  13.104  -7.784
  185   HD13  LEU  26          3HD1      LEU  26   6.097  13.426  -7.126
  186   HD21  LEU  26          3HD2      LEU  26   7.147  11.247  -7.665
  187   HD22  LEU  26          1HD2      LEU  26   5.712  10.954  -8.650
  188   HD23  LEU  26          2HD2      LEU  26   6.234   9.748  -7.481
  189    H    ILE  27           H        ILE  27   3.194   9.972  -5.260
  190    HA   ILE  27           HA       ILE  27   2.716   7.966  -3.182
  191    HB   ILE  27           HB       ILE  27   1.644   8.073  -6.040
  192   HG12  ILE  27          1HG1      ILE  27   0.345   9.114  -3.474
  193   HG13  ILE  27          2HG1      ILE  27   1.083  10.135  -4.687
  194   HG21  ILE  27          1HG2      ILE  27  -0.137   6.587  -5.126
  195   HG22  ILE  27          2HG2      ILE  27   0.653   6.610  -3.552
  196   HG23  ILE  27          3HG2      ILE  27   1.447   5.853  -4.925
  197   HD11  ILE  27          3HD1      ILE  27  -1.293   8.315  -5.145
  198   HD12  ILE  27          1HD1      ILE  27  -0.513   9.308  -6.374
  199   HD13  ILE  27          2HD1      ILE  27  -1.333  10.068  -5.012
  200    H    TYR  28           H        TYR  28   3.798   6.091  -3.027
  201    HA   TYR  28           HA       TYR  28   5.532   5.128  -5.277
  202    HB2  TYR  28           1HB      TYR  28   5.781   4.678  -2.273
  203    HB3  TYR  28           2HB      TYR  28   6.887   4.060  -3.503
  204    HD1  TYR  28           HD2      TYR  28   8.311   5.638  -4.855
  205    HD2  TYR  28           HD1      TYR  28   5.829   7.072  -1.629
  206    HE1  TYR  28           HE2      TYR  28   9.526   7.801  -4.867
  207    HE2  TYR  28           HE1      TYR  28   7.054   9.228  -1.663
  208    HH   TYR  28           HH       TYR  28   9.840   9.754  -2.755
  209    H    GLU  29           H        GLU  29   5.781   2.830  -5.472
  210    HA   GLU  29           HA       GLU  29   3.214   1.416  -5.225
  211    HB2  GLU  29           1HB      GLU  29   5.840   0.703  -6.595
  212    HB3  GLU  29           2HB      GLU  29   4.397  -0.315  -6.636
  213    HG2  GLU  29           1HG      GLU  29   3.119   1.511  -7.699
  214    HG3  GLU  29           2HG      GLU  29   4.546   2.548  -7.640
  215    H    ALA  30           H        ALA  30   2.888  -0.440  -4.128
  216    HA   ALA  30           HA       ALA  30   5.008  -1.751  -2.590
  217    HB1  ALA  30           3HB      ALA  30   2.615  -0.440  -1.236
  218    HB2  ALA  30           1HB      ALA  30   4.289   0.108  -1.109
  219    HB3  ALA  30           2HB      ALA  30   3.822  -1.458  -0.443
  220    H    LYS  31           H        LYS  31   3.968  -3.612  -1.327
  221    HA   LYS  31           HA       LYS  31   1.533  -4.697  -2.644
  222    HB2  LYS  31           1HB      LYS  31   3.518  -5.441  -3.944
  223    HB3  LYS  31           2HB      LYS  31   4.167  -6.198  -2.505
  224    HG2  LYS  31           1HG      LYS  31   1.335  -7.018  -3.213
  225    HG3  LYS  31           2HG      LYS  31   2.552  -7.524  -4.365
  226    HD2  LYS  31           1HD      LYS  31   2.964  -8.074  -1.391
  227    HD3  LYS  31           2HD      LYS  31   1.947  -9.127  -2.348
  228    HE2  LYS  31           1HE      LYS  31   4.848  -8.502  -3.011
  229    HE3  LYS  31           2HE      LYS  31   4.284  -9.978  -2.233
  230    HZ1  LYS  31           3HZ      LYS  31   4.119  -9.173  -5.005
  231    HZ2  LYS  31           1HZ      LYS  31   2.686  -9.841  -4.388
  232    HZ3  LYS  31           2HZ      LYS  31   4.134 -10.727  -4.321
  233    H    VAL  32           H        VAL  32   0.377  -6.121  -1.435
  234    HA   VAL  32           HA       VAL  32   0.920  -6.152   1.452
  235    HB   VAL  32           HB       VAL  32  -1.501  -7.297  -0.041
  236   HG11  VAL  32          1HG1      VAL  32  -2.621  -7.020   2.164
  237   HG12  VAL  32          2HG1      VAL  32  -1.110  -6.435   2.860
  238   HG13  VAL  32          3HG1      VAL  32  -1.233  -8.099   2.297
  239   HG21  VAL  32          3HG2      VAL  32  -1.226  -4.882  -0.549
  240   HG22  VAL  32          1HG2      VAL  32  -1.119  -4.524   1.171
  241   HG23  VAL  32          2HG2      VAL  32  -2.621  -5.148   0.484
  242    H    LEU  33           H        LEU  33   2.221  -7.731   2.168
  243    HA   LEU  33           HA       LEU  33   2.351 -10.351   0.811
  244    HB2  LEU  33           1HB      LEU  33   4.477  -9.270   1.460
  245    HB3  LEU  33           2HB      LEU  33   3.966  -9.261   3.133
  246    HG   LEU  33           HG       LEU  33   3.953 -11.755   3.150
  247   HD11  LEU  33          1HD1      LEU  33   3.483 -12.448   0.940
  248   HD12  LEU  33          2HD1      LEU  33   5.170 -12.884   1.141
  249   HD13  LEU  33          3HD1      LEU  33   4.740 -11.431   0.236
  250   HD21  LEU  33          3HD2      LEU  33   6.563 -10.541   2.166
  251   HD22  LEU  33          1HD2      LEU  33   6.407 -12.064   3.043
  252   HD23  LEU  33          2HD2      LEU  33   5.989 -10.546   3.836
  253    H    LYS  34           H        LYS  34   1.320  -8.939   3.878
  254    HA   LYS  34           HA       LYS  34  -0.292 -11.339   4.423
  255    HB2  LYS  34           1HB      LYS  34   1.956 -11.808   5.411
  256    HB3  LYS  34           2HB      LYS  34   1.790 -10.408   6.438
  257    HG2  LYS  34           1HG      LYS  34  -0.378 -11.473   7.354
  258    HG3  LYS  34           2HG      LYS  34   0.080 -12.928   6.476
  259    HD2  LYS  34           1HD      LYS  34   1.673 -11.570   8.703
  260    HD3  LYS  34           2HD      LYS  34   0.798 -13.091   8.825
  261    HE2  LYS  34           1HE      LYS  34   2.348 -13.951   6.923
  262    HE3  LYS  34           2HE      LYS  34   3.352 -12.536   7.281
  263    HZ1  LYS  34           3HZ      LYS  34   2.587 -13.849   9.669
  264    HZ2  LYS  34           1HZ      LYS  34   4.142 -13.534   9.069
  265    HZ3  LYS  34           2HZ      LYS  34   3.325 -14.952   8.608
  266    H    THR  35           H        THR  35  -2.045 -10.940   5.664
  267    HA   THR  35           HA       THR  35  -2.484  -8.171   6.730
  268    HB   THR  35           HB       THR  35  -3.680  -8.243   4.630
  269    HG1  THR  35           HG1      THR  35  -4.878  -8.096   6.973
  270   HG21  THR  35          3HG2      THR  35  -5.321 -10.038   4.120
  271   HG22  THR  35          1HG2      THR  35  -4.817 -10.910   5.566
  272   HG23  THR  35          2HG2      THR  35  -3.683 -10.678   4.234
  273    H    LYS  36           H        LYS  36  -3.671  -8.009   8.554
  274    HA   LYS  36           HA       LYS  36  -4.363 -10.580   9.949
  275    HB2  LYS  36           1HB      LYS  36  -2.537  -9.283  10.990
  276    HB3  LYS  36           2HB      LYS  36  -3.628  -7.932  11.198
  277    HG2  LYS  36           1HG      LYS  36  -5.099  -9.281  12.662
  278    HG3  LYS  36           2HG      LYS  36  -4.093 -10.703  12.377
  279    HD2  LYS  36           1HD      LYS  36  -2.170  -9.561  13.452
  280    HD3  LYS  36           2HD      LYS  36  -3.178  -8.142  13.747
  281    HE2  LYS  36           1HE      LYS  36  -3.034  -9.588  15.769
  282    HE3  LYS  36           2HE      LYS  36  -4.689  -9.493  15.166
  283    HZ1  LYS  36           3HZ      LYS  36  -2.824 -11.669  14.411
  284    HZ2  LYS  36           1HZ      LYS  36  -4.503 -11.609  14.177
  285    HZ3  LYS  36           2HZ      LYS  36  -3.870 -11.772  15.745
  286    HA   PRO  37           HA       PRO  37  -8.390  -8.317   9.538
  287    HB2  PRO  37           1HB      PRO  37  -9.952 -10.210   8.484
  288    HB3  PRO  37           2HB      PRO  37  -8.633  -9.532   7.493
  289    HG2  PRO  37           1HG      PRO  37  -8.625 -12.088   9.112
  290    HG3  PRO  37           2HG      PRO  37  -8.182 -11.861   7.401
  291    HD2  PRO  37           1HD      PRO  37  -6.301 -11.856   9.446
  292    HD3  PRO  37           2HD      PRO  37  -6.070 -10.942   7.942
  293    H    ASP  38           H        ASP  38  -7.181 -10.468  11.663
  294    HA   ASP  38           HA       ASP  38  -9.493 -11.542  12.968
  295    HB2  ASP  38           1HB      ASP  38  -6.665 -11.064  13.970
  296    HB3  ASP  38           2HB      ASP  38  -7.876 -12.036  14.806
  297    H    ALA  39           H        ALA  39  -8.960  -8.431  12.521
  298    HA   ALA  39           HA       ALA  39 -10.492  -7.586  14.818
  299    HB1  ALA  39           3HB      ALA  39  -8.800  -6.071  15.791
  300    HB2  ALA  39           1HB      ALA  39  -7.601  -6.660  14.633
  301    HB3  ALA  39           2HB      ALA  39  -8.252  -7.748  15.857
  302    H    THR  40           H        THR  40 -11.096  -5.365  14.733
  303    HA   THR  40           HA       THR  40 -10.539  -3.897  12.223
  304    HB   THR  40           HB       THR  40 -12.906  -3.517  11.787
  305    HG1  THR  40           HG1      THR  40 -14.423  -4.254  13.122
  306   HG21  THR  40          3HG2      THR  40 -13.511  -5.749  11.041
  307   HG22  THR  40          1HG2      THR  40 -12.471  -6.493  12.249
  308   HG23  THR  40          2HG2      THR  40 -11.759  -5.624  10.888
  309    HA   PRO  41           HA       PRO  41  -9.811  -1.846  11.721
  310    HB2  PRO  41           1HB      PRO  41  -7.997   0.030  12.507
  311    HB3  PRO  41           2HB      PRO  41  -9.686   0.465  12.157
  312    HG2  PRO  41           1HG      PRO  41  -8.435  -0.130  14.840
  313    HG3  PRO  41           2HG      PRO  41  -9.412   1.281  14.360
  314    HD2  PRO  41           1HD      PRO  41 -10.571  -0.809  15.656
  315    HD3  PRO  41           2HD      PRO  41 -11.446   0.033  14.354
  316    H    VAL  42           H        VAL  42  -7.278  -1.896  11.427
  317    HA   VAL  42           HA       VAL  42  -5.721  -3.269  13.424
  318    HB   VAL  42           HB       VAL  42  -7.299  -5.094  12.738
  319   HG11  VAL  42          1HG1      VAL  42  -7.397  -5.964  10.502
  320   HG12  VAL  42          2HG1      VAL  42  -5.962  -5.073  10.003
  321   HG13  VAL  42          3HG1      VAL  42  -7.474  -4.218  10.303
  322   HG21  VAL  42          3HG2      VAL  42  -4.790  -5.486  13.438
  323   HG22  VAL  42          1HG2      VAL  42  -4.529  -5.837  11.736
  324   HG23  VAL  42          2HG2      VAL  42  -5.640  -6.815  12.680
  325    H    GLU  43           H        GLU  43  -3.669  -4.248  12.348
  326    HA   GLU  43           HA       GLU  43  -2.587  -2.253  10.466
  327    HB2  GLU  43           1HB      GLU  43  -0.384  -3.171  11.206
  328    HB3  GLU  43           2HB      GLU  43  -1.334  -2.533  12.549
  329    HG2  GLU  43           1HG      GLU  43  -2.069  -4.840  13.119
  330    HG3  GLU  43           2HG      GLU  43  -1.107  -5.480  11.791
  331    H    TYR  44           H        TYR  44  -0.992  -3.117   8.899
  332    HA   TYR  44           HA       TYR  44  -1.625  -5.799   7.789
  333    HB2  TYR  44           1HB      TYR  44  -1.675  -3.174   6.243
  334    HB3  TYR  44           2HB      TYR  44  -1.859  -4.781   5.539
  335    HD1  TYR  44           HD1      TYR  44  -3.475  -2.211   7.700
  336    HD2  TYR  44           HD2      TYR  44  -3.939  -6.102   5.901
  337    HE1  TYR  44           HE1      TYR  44  -5.886  -2.202   8.276
  338    HE2  TYR  44           HE2      TYR  44  -6.350  -6.072   6.477
  339    HH   TYR  44           HH       TYR  44  -8.103  -4.474   6.989
  340    H    TYR  45           H        TYR  45  -0.048  -6.667   6.487
  341    HA   TYR  45           HA       TYR  45   2.675  -5.677   7.079
  342    HB2  TYR  45           1HB      TYR  45   1.884  -8.142   7.270
  343    HB3  TYR  45           2HB      TYR  45   2.058  -8.211   5.525
  344    HD1  TYR  45           HD1      TYR  45   4.352  -7.376   4.508
  345    HD2  TYR  45           HD2      TYR  45   3.868  -8.503   8.633
  346    HE1  TYR  45           HE1      TYR  45   6.787  -7.731   4.701
  347    HE2  TYR  45           HE2      TYR  45   6.315  -8.839   8.817
  348    HH   TYR  45           HH       TYR  45   8.409  -8.635   5.983
  349    H    ILE  46           H        ILE  46   3.188  -4.038   5.759
  350    HA   ILE  46           HA       ILE  46   2.894  -4.361   2.804
  351    HB   ILE  46           HB       ILE  46   3.351  -1.795   4.397
  352   HG12  ILE  46          1HG1      ILE  46   1.162  -2.695   5.030
  353   HG13  ILE  46          2HG1      ILE  46   0.925  -1.325   3.961
  354   HG21  ILE  46          1HG2      ILE  46   4.087  -1.667   2.038
  355   HG22  ILE  46          2HG2      ILE  46   2.638  -0.697   2.276
  356   HG23  ILE  46          3HG2      ILE  46   2.520  -2.277   1.506
  357   HD11  ILE  46          3HD1      ILE  46   0.498  -4.258   3.402
  358   HD12  ILE  46          1HD1      ILE  46   0.746  -3.142   2.060
  359   HD13  ILE  46          2HD1      ILE  46  -0.607  -2.914   3.158
  360    H    HIS  47           H        HIS  47   4.642  -4.163   1.520
  361    HA   HIS  47           HA       HIS  47   7.288  -3.441   2.619
  362    HB2  HIS  47           1HB      HIS  47   8.364  -5.482   1.882
  363    HB3  HIS  47           2HB      HIS  47   6.989  -5.951   2.881
  364    HD1  HIS  47           HD1      HIS  47   8.423  -6.332  -0.474
  365    HD2  HIS  47           HD2      HIS  47   4.671  -6.824   1.265
  366    HE1  HIS  47           HE1      HIS  47   7.041  -7.653  -2.130
  367    HE2  HIS  47           HE2      HIS  47   4.761  -7.982  -1.077
  368    H    TYR  48           H        TYR  48   8.639  -2.544   1.105
  369    HA   TYR  48           HA       TYR  48   7.439  -1.568  -1.339
  370    HB2  TYR  48           1HB      TYR  48  10.313  -1.393  -0.336
  371    HB3  TYR  48           2HB      TYR  48   9.631  -0.465  -1.671
  372    HD1  TYR  48           HD1      TYR  48   7.513   0.969  -1.214
  373    HD2  TYR  48           HD2      TYR  48  10.056  -0.517   1.940
  374    HE1  TYR  48           HE1      TYR  48   6.573   2.643   0.348
  375    HE2  TYR  48           HE2      TYR  48   9.105   1.171   3.484
  376    HH   TYR  48           HH       TYR  48   6.299   2.792   2.935
  377    H    ALA  49           H        ALA  49   7.686  -2.302  -3.376
  378    HA   ALA  49           HA       ALA  49   8.550  -4.974  -3.866
  379    HB1  ALA  49           3HB      ALA  49   7.963  -2.726  -5.831
  380    HB2  ALA  49           1HB      ALA  49   6.780  -3.859  -5.178
  381    HB3  ALA  49           2HB      ALA  49   8.068  -4.443  -6.234
  382    H    GLY  50           H        GLY  50  10.521  -5.750  -4.408
  383    HA2  GLY  50           1HA      GLY  50  12.637  -5.853  -5.372
  384    HA3  GLY  50           2HA      GLY  50  12.548  -4.144  -5.780
  385    H    TRP  51           H        TRP  51  11.835  -5.217  -2.542
  386    HA   TRP  51           HA       TRP  51  14.546  -4.488  -1.539
  387    HB2  TRP  51           1HB      TRP  51  11.928  -3.291  -0.535
  388    HB3  TRP  51           2HB      TRP  51  13.514  -3.046   0.200
  389    HD1  TRP  51           HD1      TRP  51  11.374  -1.870  -2.680
  390    HE1  TRP  51           HE1      TRP  51  12.611  -0.017  -3.973
  391    HE3  TRP  51           HE3      TRP  51  15.977  -2.224  -0.513
  392    HZ2  TRP  51           HZ2      TRP  51  15.214   1.159  -4.076
  393    HZ3  TRP  51           HZ3      TRP  51  17.823  -0.728  -1.228
  394    HH2  TRP  51           HH2      TRP  51  17.447   0.962  -3.006
  395    H    SER  52           H        SER  52  14.880  -5.081   0.678
  396    HA   SER  52           HA       SER  52  14.152  -7.769   1.204
  397    HB2  SER  52           1HB      SER  52  15.335  -5.676   3.061
  398    HB3  SER  52           2HB      SER  52  15.299  -7.414   3.375
  399    HG   SER  52           HG       SER  52  16.876  -5.932   1.659
  400    H    LYS  53           H        LYS  53  12.544  -8.643   2.403
  401    HA   LYS  53           HA       LYS  53  10.336  -6.970   3.320
  402    HB2  LYS  53           1HB      LYS  53   9.162  -9.116   3.666
  403    HB3  LYS  53           2HB      LYS  53   9.845  -9.000   2.042
  404    HG2  LYS  53           1HG      LYS  53  11.791 -10.373   2.769
  405    HG3  LYS  53           2HG      LYS  53  11.084 -10.518   4.379
  406    HD2  LYS  53           1HD      LYS  53   9.098 -11.648   3.421
  407    HD3  LYS  53           2HD      LYS  53   9.781 -11.490   1.800
  408    HE2  LYS  53           1HE      LYS  53  10.192 -13.754   2.731
  409    HE3  LYS  53           2HE      LYS  53  11.711 -12.891   2.471
  410    HZ1  LYS  53           3HZ      LYS  53  10.284 -12.897   5.067
  411    HZ2  LYS  53           1HZ      LYS  53  11.870 -12.387   4.754
  412    HZ3  LYS  53           2HZ      LYS  53  11.477 -14.038   4.667
  413    H    ASN  54           H        ASN  54  13.171  -8.007   4.727
  414    HA   ASN  54           HA       ASN  54  12.285  -8.781   7.338
  415    HB2  ASN  54           1HB      ASN  54  14.667  -8.385   7.969
  416    HB3  ASN  54           2HB      ASN  54  14.514  -9.380   6.525
  417   HD21  ASN  54          2HD2      ASN  54  16.802  -8.601   6.090
  418   HD22  ASN  54          1HD2      ASN  54  17.008  -7.099   5.328
  419    H    TRP  55           H        TRP  55  12.344  -5.797   5.728
  420    HA   TRP  55           HA       TRP  55  12.848  -4.023   7.908
  421    HB2  TRP  55           1HB      TRP  55  12.963  -3.419   5.460
  422    HB3  TRP  55           2HB      TRP  55  11.207  -3.500   5.386
  423    HD1  TRP  55           HD1      TRP  55   9.907  -1.768   7.159
  424    HE1  TRP  55           HE1      TRP  55  10.551   0.641   7.800
  425    HE3  TRP  55           HE3      TRP  55  14.819  -1.785   5.784
  426    HZ2  TRP  55           HZ2      TRP  55  12.849   2.340   7.739
  427    HZ3  TRP  55           HZ3      TRP  55  16.218   0.241   6.086
  428    HH2  TRP  55           HH2      TRP  55  15.240   2.305   7.062
  429    H    ASP  56           H        ASP  56  10.077  -5.779   6.790
  430    HA   ASP  56           HA       ASP  56   7.863  -5.876   7.421
  431    HB2  ASP  56           1HB      ASP  56   9.179  -5.580  10.141
  432    HB3  ASP  56           2HB      ASP  56   7.586  -6.272   9.842
  433    H    GLU  57           H        GLU  57   7.440  -3.672   6.438
  434    HA   GLU  57           HA       GLU  57   7.145  -1.438   8.315
  435    HB2  GLU  57           1HB      GLU  57   7.890  -1.138   5.913
  436    HB3  GLU  57           2HB      GLU  57   6.275  -1.580   5.399
  437    HG2  GLU  57           1HG      GLU  57   5.343   0.321   6.698
  438    HG3  GLU  57           2HG      GLU  57   6.965   0.769   7.204
  439    H    TRP  58           H        TRP  58   5.602  -2.382   9.754
  440    HA   TRP  58           HA       TRP  58   2.945  -3.131   8.851
  441    HB2  TRP  58           1HB      TRP  58   4.392  -2.964  11.499
  442    HB3  TRP  58           2HB      TRP  58   2.643  -2.804  11.574
  443    HD1  TRP  58           HD1      TRP  58   1.353  -4.846  10.007
  444    HE1  TRP  58           HE1      TRP  58   1.810  -7.374  10.174
  445    HE3  TRP  58           HE3      TRP  58   6.009  -4.763  12.102
  446    HZ2  TRP  58           HZ2      TRP  58   3.869  -9.138  11.066
  447    HZ3  TRP  58           HZ3      TRP  58   7.198  -6.882  12.604
  448    HH2  TRP  58           HH2      TRP  58   6.135  -9.067  12.093
  449    H    VAL  59           H        VAL  59   1.407  -1.682   8.326
  450    HA   VAL  59           HA       VAL  59   1.264   0.909   9.762
  451    HB   VAL  59           HB       VAL  59   0.852   2.013   7.386
  452   HG11  VAL  59          1HG1      VAL  59   2.800   2.586   8.769
  453   HG12  VAL  59          2HG1      VAL  59   3.298   2.421   7.086
  454   HG13  VAL  59          3HG1      VAL  59   3.634   1.131   8.238
  455   HG21  VAL  59          3HG2      VAL  59   1.999   0.921   5.517
  456   HG22  VAL  59          1HG2      VAL  59   0.775  -0.173   6.160
  457   HG23  VAL  59          2HG2      VAL  59   2.478  -0.429   6.540
  458    HA   PRO  60           HA       PRO  60  -3.105   0.141   9.614
  459    HB2  PRO  60           1HB      PRO  60  -4.171   2.644   9.911
  460    HB3  PRO  60           2HB      PRO  60  -3.220   1.891  11.215
  461    HG2  PRO  60           1HG      PRO  60  -2.246   3.795   9.074
  462    HG3  PRO  60           2HG      PRO  60  -2.088   3.956  10.842
  463    HD2  PRO  60           1HD      PRO  60  -0.044   2.938   9.421
  464    HD3  PRO  60           2HD      PRO  60  -0.481   2.188  10.972
  465    H    GLU  61           H        GLU  61  -5.036   0.488   8.333
  466    HA   GLU  61           HA       GLU  61  -4.670   0.415   5.571
  467    HB2  GLU  61           1HB      GLU  61  -7.175   0.685   5.449
  468    HB3  GLU  61           2HB      GLU  61  -6.655  -0.545   6.605
  469    HG2  GLU  61           1HG      GLU  61  -6.898   1.095   8.463
  470    HG3  GLU  61           2HG      GLU  61  -7.437   2.314   7.314
  471    H    ASN  62           H        ASN  62  -4.763   3.132   7.624
  472    HA   ASN  62           HA       ASN  62  -5.857   5.124   5.941
  473    HB2  ASN  62           1HB      ASN  62  -3.691   5.461   8.044
  474    HB3  ASN  62           2HB      ASN  62  -4.733   6.729   7.412
  475   HD21  ASN  62          2HD2      ASN  62  -4.417   5.010  10.146
  476   HD22  ASN  62          1HD2      ASN  62  -6.045   4.795  10.578
  477    H    ARG  63           H        ARG  63  -2.515   3.916   6.197
  478    HA   ARG  63           HA       ARG  63  -1.543   5.807   4.153
  479    HB2  ARG  63           1HB      ARG  63  -0.164   3.592   5.718
  480    HB3  ARG  63           2HB      ARG  63   0.655   4.661   4.575
  481    HG2  ARG  63           1HG      ARG  63  -0.005   6.630   5.928
  482    HG3  ARG  63           2HG      ARG  63  -0.829   5.572   7.074
  483    HD2  ARG  63           1HD      ARG  63   1.324   4.446   7.581
  484    HD3  ARG  63           2HD      ARG  63   2.147   5.520   6.445
  485    HE   ARG  63           HE       ARG  63   0.750   7.118   8.290
  486   HH11  ARG  63          1HH2      ARG  63   3.410   4.880   8.207
  487   HH12  ARG  63          2HH2      ARG  63   4.233   5.612   9.542
  488   HH21  ARG  63          1HH1      ARG  63   1.832   8.062  10.031
  489   HH22  ARG  63          2HH1      ARG  63   3.342   7.410  10.572
  490    H    VAL  64           H        VAL  64  -3.214   2.937   4.049
  491    HA   VAL  64           HA       VAL  64  -1.935   2.079   1.481
  492    HB   VAL  64           HB       VAL  64  -3.622   0.365   3.358
  493   HG11  VAL  64          1HG1      VAL  64  -3.607  -0.371   0.984
  494   HG12  VAL  64          2HG1      VAL  64  -2.719  -1.503   1.990
  495   HG13  VAL  64          3HG1      VAL  64  -1.847  -0.347   0.985
  496   HG21  VAL  64          3HG2      VAL  64  -0.590   0.485   3.047
  497   HG22  VAL  64          1HG2      VAL  64  -1.471  -0.693   4.021
  498   HG23  VAL  64          2HG2      VAL  64  -1.494   1.010   4.468
  499    H    LEU  65           H        LEU  65  -3.162   1.932  -0.289
  500    HA   LEU  65           HA       LEU  65  -6.116   2.278  -0.131
  501    HB2  LEU  65           1HB      LEU  65  -6.025   3.956  -1.956
  502    HB3  LEU  65           2HB      LEU  65  -5.283   4.540  -0.478
  503    HG   LEU  65           HG       LEU  65  -3.374   3.185  -2.398
  504   HD11  LEU  65          1HD1      LEU  65  -4.717   4.396  -3.996
  505   HD12  LEU  65          2HD1      LEU  65  -3.158   5.192  -3.840
  506   HD13  LEU  65          3HD1      LEU  65  -4.587   5.882  -3.063
  507   HD21  LEU  65          3HD2      LEU  65  -1.874   4.990  -1.698
  508   HD22  LEU  65          1HD2      LEU  65  -2.637   4.293  -0.269
  509   HD23  LEU  65          2HD2      LEU  65  -3.203   5.840  -0.903
  510    H    LYS  66           H        LYS  66  -7.218   1.688  -2.055
  511    HA   LYS  66           HA       LYS  66  -6.229  -0.740  -3.210
  512    HB2  LYS  66           1HB      LYS  66  -8.628   0.989  -3.933
  513    HB3  LYS  66           2HB      LYS  66  -8.328  -0.643  -4.537
  514    HG2  LYS  66           1HG      LYS  66  -8.435  -1.544  -2.243
  515    HG3  LYS  66           2HG      LYS  66  -8.629   0.081  -1.592
  516    HD2  LYS  66           1HD      LYS  66 -10.822  -0.998  -1.678
  517    HD3  LYS  66           2HD      LYS  66 -10.784   0.312  -2.851
  518    HE2  LYS  66           1HE      LYS  66 -10.606  -1.245  -4.699
  519    HE3  LYS  66           2HE      LYS  66 -10.200  -2.584  -3.621
  520    HZ1  LYS  66           3HZ      LYS  66 -12.491  -2.003  -2.585
  521    HZ2  LYS  66           1HZ      LYS  66 -12.406  -2.940  -3.996
  522    HZ3  LYS  66           2HZ      LYS  66 -12.788  -1.288  -4.098
  523    H    TYR  67           H        TYR  67  -5.809  -1.165  -5.402
  524    HA   TYR  67           HA       TYR  67  -4.408   1.002  -6.819
  525    HB2  TYR  67           1HB      TYR  67  -3.375  -1.255  -6.549
  526    HB3  TYR  67           2HB      TYR  67  -4.687  -1.964  -7.484
  527    HD1  TYR  67           HD2      TYR  67  -4.898  -1.505  -9.936
  528    HD2  TYR  67           HD1      TYR  67  -1.647   0.159  -7.651
  529    HE1  TYR  67           HE2      TYR  67  -3.726  -0.893 -12.033
  530    HE2  TYR  67           HE1      TYR  67  -0.491   0.775  -9.757
  531    HH   TYR  67           HH       TYR  67  -1.944   0.949 -12.668
  532    H    ASN  68           H        ASN  68  -5.526   2.233  -8.191
  533    HA   ASN  68           HA       ASN  68  -7.353   1.039 -10.170
  534    HB2  ASN  68           1HB      ASN  68  -8.288   3.189  -8.224
  535    HB3  ASN  68           2HB      ASN  68  -9.204   2.595  -9.607
  536   HD21  ASN  68          2HD2      ASN  68  -9.222  -0.053  -9.535
  537   HD22  ASN  68          1HD2      ASN  68  -9.697  -0.677  -8.030
  538    H    ASP  69           H        ASP  69  -7.698   2.333 -11.961
  539    HA   ASP  69           HA       ASP  69  -5.633   3.875 -12.899
  540    HB2  ASP  69           1HB      ASP  69  -7.467   2.931 -14.285
  541    HB3  ASP  69           2HB      ASP  69  -8.558   4.166 -13.668
  542    H    ASP  70           H        ASP  70  -8.183   4.879 -10.753
  543    HA   ASP  70           HA       ASP  70  -7.918   7.723 -11.160
  544    HB2  ASP  70           1HB      ASP  70  -9.098   6.174  -8.820
  545    HB3  ASP  70           2HB      ASP  70  -9.329   7.894  -9.147
  546    H    ASN  71           H        ASN  71  -6.727   5.440  -8.669
  547    HA   ASN  71           HA       ASN  71  -5.302   7.393  -7.158
  548    HB2  ASN  71           1HB      ASN  71  -4.740   4.411  -7.388
  549    HB3  ASN  71           2HB      ASN  71  -4.219   5.496  -6.098
  550   HD21  ASN  71          2HD2      ASN  71  -6.544   3.214  -6.754
  551   HD22  ASN  71          1HD2      ASN  71  -7.777   3.772  -5.730
  552    H    VAL  72           H        VAL  72  -4.526   5.433  -9.957
  553    HA   VAL  72           HA       VAL  72  -1.711   5.996 -10.070
  554    HB   VAL  72           HB       VAL  72  -3.673   5.223 -12.275
  555   HG11  VAL  72          1HG1      VAL  72  -0.621   5.246 -12.278
  556   HG12  VAL  72          2HG1      VAL  72  -1.666   6.232 -13.301
  557   HG13  VAL  72          3HG1      VAL  72  -1.606   4.491 -13.529
  558   HG21  VAL  72          3HG2      VAL  72  -1.709   3.537 -10.666
  559   HG22  VAL  72          1HG2      VAL  72  -2.758   2.942 -11.953
  560   HG23  VAL  72          2HG2      VAL  72  -3.457   3.540 -10.451
  561    H    LYS  73           H        LYS  73  -4.629   7.495 -11.392
  562    HA   LYS  73           HA       LYS  73  -3.493   9.487 -12.993
  563    HB2  LYS  73           1HB      LYS  73  -5.905   8.846 -12.960
  564    HB3  LYS  73           2HB      LYS  73  -6.079   9.672 -11.424
  565    HG2  LYS  73           1HG      LYS  73  -5.419  11.819 -12.476
  566    HG3  LYS  73           2HG      LYS  73  -5.240  10.995 -14.025
  567    HD2  LYS  73           1HD      LYS  73  -7.647  10.350 -13.956
  568    HD3  LYS  73           2HD      LYS  73  -7.822  11.183 -12.413
  569    HE2  LYS  73           1HE      LYS  73  -7.215  13.326 -13.501
  570    HE3  LYS  73           2HE      LYS  73  -7.049  12.490 -15.048
  571    HZ1  LYS  73           3HZ      LYS  73  -9.310  12.035 -15.137
  572    HZ2  LYS  73           1HZ      LYS  73  -9.267  13.615 -14.520
  573    HZ3  LYS  73           2HZ      LYS  73  -9.541  12.304 -13.475
  574    H    ARG  74           H        ARG  74  -4.209   9.403  -9.533
  575    HA   ARG  74           HA       ARG  74  -3.630  12.120  -8.914
  576    HB2  ARG  74           1HB      ARG  74  -3.486   9.635  -7.163
  577    HB3  ARG  74           2HB      ARG  74  -3.275  11.271  -6.546
  578    HG2  ARG  74           1HG      ARG  74  -5.544  11.872  -7.355
  579    HG3  ARG  74           2HG      ARG  74  -5.763  10.235  -7.960
  580    HD2  ARG  74           1HD      ARG  74  -5.508   9.350  -5.652
  581    HD3  ARG  74           2HD      ARG  74  -5.307  10.994  -5.049
  582    HE   ARG  74           HE       ARG  74  -7.793   9.715  -5.756
  583   HH11  ARG  74          1HH2      ARG  74  -6.145  12.777  -5.612
  584   HH12  ARG  74          2HH2      ARG  74  -7.603  13.706  -5.547
  585   HH21  ARG  74          1HH1      ARG  74  -9.695  10.947  -5.665
  586   HH22  ARG  74          2HH1      ARG  74  -9.607  12.674  -5.579
  587    H    ARG  75           H        ARG  75  -1.575   9.229  -9.091
  588    HA   ARG  75           HA       ARG  75   0.826  10.455  -8.107
  589    HB2  ARG  75           1HB      ARG  75   0.552   7.975  -8.277
  590    HB3  ARG  75           2HB      ARG  75   0.535   8.101 -10.030
  591    HG2  ARG  75           1HG      ARG  75   2.853   9.084  -9.955
  592    HG3  ARG  75           2HG      ARG  75   2.855   8.889  -8.206
  593    HD2  ARG  75           1HD      ARG  75   2.493   6.588 -10.167
  594    HD3  ARG  75           2HD      ARG  75   4.045   7.046  -9.463
  595    HE   ARG  75           HE       ARG  75   2.280   6.694  -7.331
  596   HH11  ARG  75          1HH2      ARG  75   3.555   4.803  -9.952
  597   HH12  ARG  75          2HH2      ARG  75   3.628   3.338  -9.040
  598   HH21  ARG  75          1HH1      ARG  75   2.419   4.784  -6.130
  599   HH22  ARG  75          2HH1      ARG  75   2.991   3.330  -6.868
  600    H    GLN  76           H        GLN  76  -0.612  10.003 -11.280
  601    HA   GLN  76           HA       GLN  76   1.474  11.188 -12.817
  602    HB2  GLN  76           1HB      GLN  76  -0.031   9.718 -13.954
  603    HB3  GLN  76           2HB      GLN  76  -1.428  10.507 -13.259
  604    HG2  GLN  76           1HG      GLN  76  -1.070  11.011 -15.702
  605    HG3  GLN  76           2HG      GLN  76  -1.205  12.427 -14.676
  606   HE21  GLN  76          2HE2      GLN  76   1.617  10.260 -15.378
  607   HE22  GLN  76          1HE2      GLN  76   2.635  11.521 -15.884
  608    H    GLU  77           H        GLU  77  -1.321  12.366 -11.066
  609    HA   GLU  77           HA       GLU  77  -1.296  15.045 -12.140
  610    HB2  GLU  77           1HB      GLU  77  -3.278  13.926 -10.948
  611    HB3  GLU  77           2HB      GLU  77  -2.410  14.161  -9.439
  612    HG2  GLU  77           1HG      GLU  77  -3.952  16.021  -9.674
  613    HG3  GLU  77           2HG      GLU  77  -2.331  16.649  -9.932
  614    H    LEU  78           H        LEU  78  -0.041  13.485  -9.225
  615    HA   LEU  78           HA       LEU  78   1.239  15.791  -8.139
  616    HB2  LEU  78           1HB      LEU  78   1.553  12.824  -7.650
  617    HB3  LEU  78           2HB      LEU  78   2.388  14.028  -6.687
  618    HG   LEU  78           HG       LEU  78  -0.657  14.151  -6.953
  619   HD11  LEU  78          1HD1      LEU  78   0.864  12.554  -4.861
  620   HD12  LEU  78          2HD1      LEU  78  -0.111  11.865  -6.160
  621   HD13  LEU  78          3HD1      LEU  78  -0.881  12.817  -4.897
  622   HD21  LEU  78          3HD2      LEU  78   1.260  15.033  -4.734
  623   HD22  LEU  78          1HD2      LEU  78  -0.486  15.282  -4.743
  624   HD23  LEU  78          2HD2      LEU  78   0.519  16.107  -5.917
  625    H    ALA  79           H        ALA  79   2.117  13.344 -10.445
  626    HA   ALA  79           HA       ALA  79   4.954  13.633 -10.368
  627    HB1  ALA  79           3HB      ALA  79   3.852  11.752 -11.517
  628    HB2  ALA  79           1HB      ALA  79   4.955  12.599 -12.600
  629    HB3  ALA  79           2HB      ALA  79   3.219  12.865 -12.735
  630    H    ARG  80           H        ARG  80   2.579  15.132 -12.606
  631    HA   ARG  80           HA       ARG  80   4.437  16.885 -13.854
  632    HB2  ARG  80           1HB      ARG  80   2.379  18.135 -14.604
  633    HB3  ARG  80           2HB      ARG  80   2.296  16.405 -14.938
  634    HG2  ARG  80           1HG      ARG  80   0.926  16.060 -12.933
  635    HG3  ARG  80           2HG      ARG  80   1.024  17.764 -12.520
  636    HD2  ARG  80           1HD      ARG  80  -1.116  17.297 -13.611
  637    HD3  ARG  80           2HD      ARG  80  -0.129  18.313 -14.662
  638    HE   ARG  80           HE       ARG  80   0.331  15.589 -15.306
  639   HH11  ARG  80          1HH2      ARG  80  -2.183  17.987 -15.459
  640   HH12  ARG  80          2HH2      ARG  80  -2.908  17.327 -16.886
  641   HH21  ARG  80          1HH1      ARG  80  -0.628  14.733 -17.173
  642   HH22  ARG  80          2HH1      ARG  80  -2.027  15.490 -17.855
  643    H    GLN  81           H        GLN  81   2.658  17.013 -10.874
  644    HA   GLN  81           HA       GLN  81   2.929  19.820 -10.369
  645    HB2  GLN  81           1HB      GLN  81   1.313  18.050  -9.273
  646    HB3  GLN  81           2HB      GLN  81   2.647  17.716  -8.183
  647    HG2  GLN  81           1HG      GLN  81   1.353  20.446  -8.605
  648    HG3  GLN  81           2HG      GLN  81   1.067  19.385  -7.231
  649   HE21  GLN  81          2HE2      GLN  81   2.756  22.106  -7.982
  650   HE22  GLN  81          1HE2      GLN  81   4.089  21.916  -6.950
  651    H    CYS  82           H        CYS  82   4.823  16.947  -9.511
  652    HA   CYS  82           HA       CYS  82   6.670  18.127  -7.767
  653    HB2  CYS  82           1HB      CYS  82   6.362  15.688  -8.084
  654    HB3  CYS  82           2HB      CYS  82   7.110  15.805  -9.675
  655    HG   CYS  82           HG       CYS  82   8.627  15.599  -7.115
  656    H    GLY  83           H        GLY  83   6.727  17.733 -11.296
  657    HA2  GLY  83           1HA      GLY  83   7.920  18.775 -12.941
  658    HA3  GLY  83           2HA      GLY  83   8.178  20.092 -11.799
  659    H    GLU  84           H        GLU  84  10.312  20.373 -12.531
  660    HA   GLU  84           HA       GLU  84  12.569  20.076 -12.576
  661    HB2  GLU  84           1HB      GLU  84  12.091  20.067 -10.096
  662    HB3  GLU  84           2HB      GLU  84  12.053  18.310 -10.148
  663    HG2  GLU  84           1HG      GLU  84  14.273  19.004  -9.405
  664    HG3  GLU  84           2HG      GLU  84  14.431  18.337 -11.021
  665    H    ARG  85           H        ARG  85  12.972  18.984 -14.437
  666    HA   ARG  85           HA       ARG  85  12.428  16.285 -15.016
  667    HB2  ARG  85           1HB      ARG  85  14.102  16.571 -16.860
  668    HB3  ARG  85           2HB      ARG  85  12.928  17.887 -16.784
  669    HG2  ARG  85           1HG      ARG  85  14.566  19.284 -15.543
  670    HG3  ARG  85           2HG      ARG  85  15.747  17.979 -15.621
  671    HD2  ARG  85           1HD      ARG  85  15.717  18.090 -18.091
  672    HD3  ARG  85           2HD      ARG  85  14.533  19.399 -18.024
  673    HE   ARG  85           HE       ARG  85  17.375  19.612 -17.566
  674   HH11  ARG  85          1HH2      ARG  85  14.270  20.947 -16.736
  675   HH12  ARG  85          2HH2      ARG  85  14.909  22.490 -16.280
  676   HH21  ARG  85          1HH1      ARG  85  18.198  21.634 -16.961
  677   HH22  ARG  85          2HH1      ARG  85  17.129  22.877 -16.406