*HEADER    OXIDOREDUCTASE                          29-AUG-05   2AUV              
*TITLE     SOLUTION STRUCTURE OF HNDAC : A THIOREDOXIN-LIKE [2FE-2S]             
*TITLE    2 FERREDOXIN INVOLVED IN THE NADP-REDUCING HYDROGENASE                 
*TITLE    3 COMPLEX                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: POTENTIAL NAD-REDUCING HYDROGENASE SUBUNIT;                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SUBUNIT A C-TERMINAL DOMAIN;                               
*COMPND   5 EC: 1.12.1.3;                                                        
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: DESULFOVIBRIO FRUCTOSOVORANS;                   
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                                
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET-HNDAC                                 
*KEYWDS    THIOREDOXIN, THIORDOXIN-LIKE                                          
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    M.NOUAILLER, X.MORELLI, O.BORNET, B.CHETRIT, Z.DERMOUN,               
*AUTHOR   2 F.GUERLESQUIN                                                        
*REVDAT   1   27-JUN-06 2AUV    0                                                

Documents and Settings/matthieu/Bureau/unambig.tbl010044400000020000002000002361611030455323600212260ustar  rootrootassign (resid  12 and name SG   ) (resid  17 and name FE   )    2.860    0.020    0.020
assign (resid  12 and name SG   ) (resid  17 and name SE   )    3.610    0.020    0.020
assign (resid  12 and name SG   ) (resid  17 and name SG   )    3.190    0.020    0.020
assign (resid  12 and name SG   ) (resid  57 and name SE   )    4.350    0.020    0.020
assign (resid  17 and name FE   ) (resid  17 and name SE   )    2.220    0.020    0.020
assign (resid  17 and name FE   ) (resid  57 and name FE   )    2.680    0.020    0.020
assign (resid  17 and name FE   ) (resid  57 and name SE   )    2.150    0.020    0.020
assign (resid  17 and name SE   ) (resid  57 and name FE   )    2.130    0.020    0.020
assign (resid  17 and name SE   ) (resid  57 and name SE   )    3.450    0.020    0.020
assign (resid  53 and name SG   ) (resid  57 and name FE   )    2.860    0.020    0.020
assign (resid  53 and name SG   ) (resid  57 and name SG   )    4.320    0.020    0.020
assign (resid  57 and name SG   ) (resid  57 and name SE   )    4.340    0.020    0.020    
assign (resid  17 and name SG   ) (resid  57 and name SG   )    7.530    0.020    0.020   
assign (resid  12 and name SG   ) (resid  53 and name SG   )    5.330    0.020    0.020    
assign (resid  12 and name SG   ) (resid  57 and name SG   )    7.490    0.020    0.020    
assign (resid  17 and name SG   ) (resid  53 and name SG   )    7.500    0.020    0.020    
assign (resid   4 and name HA   ) (resid   4 and name HB1  )    3.400    1.600    1.600
assign (resid   4 and name HA   ) (resid   4 and name HB2  )    3.000    1.200    1.200
assign (resid   4 and name HG#  ) (resid   4 and name HD#  )    3.400    1.600    1.600
assign (resid   5 and name HA1  ) (resid   5 and name HA2  )    2.500    0.700    0.700
assign (resid   6 and name HA   ) (resid   6 and name HB1  )    3.000    1.200    1.200
assign (resid   6 and name HA   ) (resid   6 and name HB2  )    3.000    1.200    1.200
assign (resid   6 and name HA   ) (resid   6 and name HD1  )    3.000    1.200    1.200
assign (resid   6 and name HA   ) (resid   6 and name HE#  )    3.400    1.600    1.600
assign (resid   6 and name HA   ) (resid   6 and name HG1  )    3.000    1.200    1.200
assign (resid   6 and name HA   ) (resid   6 and name HG2  )    3.000    1.200    1.200
assign (resid   6 and name HB1  ) (resid   6 and name HB2  )    2.500    0.700    0.700
assign (resid   6 and name HB1  ) (resid   6 and name HG1  )    3.000    1.200    1.200
assign (resid   6 and name HB1  ) (resid   6 and name HG2  )    3.000    1.200    1.200
assign (resid   6 and name HE#  ) (resid   6 and name HD1  )    3.400    1.600    1.600
assign (resid   7 and name HB1  ) (resid  65 and name HG2# )    3.400    1.600    1.600
assign (resid   7 and name HB2  ) (resid  65 and name HG2# )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid   6 and name HA   )    3.000    1.200    1.200
assign (resid   7 and name HD#  ) (resid   7 and name HA   )    2.500    0.700    0.700
assign (resid   7 and name HD#  ) (resid   7 and name HB1  )    3.000    1.200    1.200
assign (resid   7 and name HD#  ) (resid   7 and name HB2  )    2.500    0.700    0.700
assign (resid   7 and name HD#  ) (resid  45 and name HB2  )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid  45 and name HG#  )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid  46 and name HA   )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid  65 and name HB   )    3.000    1.200    1.200
assign (resid   7 and name HD#  ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid  65 and name HG2# )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid  66 and name HA1  )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid  66 and name HA2  )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid  68 and name HG1  )    3.400    1.600    1.600
assign (resid   7 and name HD#  ) (resid  68 and name HG2  )    3.000    1.200    1.200
assign (resid   7 and name HE#  ) (resid   6 and name HA   )    3.400    1.600    1.600
assign (resid   7 and name HE#  ) (resid   6 and name HD1  )    3.000    1.200    1.200
assign (resid   7 and name HE#  ) (resid   7 and name HA   )    3.000    1.200    1.200
assign (resid   7 and name HE#  ) (resid   7 and name HB1  )    3.400    1.600    1.600
assign (resid   7 and name HE#  ) (resid   7 and name HB2  )    3.000    1.200    1.200
assign (resid   7 and name HE#  ) (resid  45 and name HB1  )    3.400    1.600    1.600
assign (resid   7 and name HE#  ) (resid  45 and name HG#  )    3.400    1.600    1.600
assign (resid   7 and name HE#  ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid   7 and name HE#  ) (resid  65 and name HG2# )    3.400    1.600    1.600
assign (resid   7 and name HE#  ) (resid  66 and name HA1  )    3.400    1.600    1.600
assign (resid   7 and name HE#  ) (resid  68 and name HG1  )    3.400    1.600    1.600
assign (resid   7 and name HE#  ) (resid  68 and name HG2  )    3.400    1.600    1.600
assign (resid   8 and name HA   ) (resid   8 and name HB#  )    3.400    1.600    1.600
assign (resid   8 and name HA   ) (resid   8 and name HD#  )    3.400    1.600    1.600
assign (resid   9 and name HA   ) (resid   9 and name HB   )    3.400    1.600    1.600
assign (resid   9 and name HB   ) (resid   9 and name HD1# )    3.000    1.200    1.200
assign (resid  10 and name HA   ) (resid  10 and name HB1  )    3.400    1.600    1.600
assign (resid  10 and name HA   ) (resid  10 and name HB2  )    3.400    1.600    1.600
assign (resid  10 and name HA   ) (resid  48 and name HA   )    3.400    1.600    1.600
assign (resid  10 and name HB1  ) (resid  10 and name HB2  )    2.500    0.700    0.700
assign (resid  11 and name HB   ) (resid  11 and name HG1# )    3.000    1.200    1.200
assign (resid  11 and name HB   ) (resid  11 and name HG2# )    2.500    0.700    0.700
assign (resid  11 and name HG1# ) (resid  11 and name HG2# )    3.000    1.200    1.200
assign (resid  11 and name HG2# ) (resid   9 and name HD1# )    3.000    1.200    1.200
assign (resid  21 and name HA2  ) (resid  21 and name HA1  )    3.400    1.600    1.600
assign (resid  22 and name HA   ) (resid  22 and name HB#  )    3.400    1.600    1.600
assign (resid  23 and name HA   ) (resid  23 and name HB1  )    3.000    1.200    1.200
assign (resid  23 and name HA   ) (resid  23 and name HB2  )    3.000    1.200    1.200
assign (resid  23 and name HA   ) (resid  26 and name HB   )    3.400    1.600    1.600
assign (resid  23 and name HA   ) (resid  26 and name HG2# )    3.400    1.600    1.600
assign (resid  23 and name HB1  ) (resid  23 and name HB2  )    2.500    0.700    0.700
assign (resid  24 and name HA   ) (resid  24 and name HB1  )    3.400    1.600    1.600
assign (resid  24 and name HA   ) (resid  24 and name HB2  )    3.000    1.200    1.200
assign (resid  24 and name HA   ) (resid  24 and name HD2  )    3.400    1.600    1.600
assign (resid  24 and name HA   ) (resid  27 and name HB1  )    3.400    1.600    1.600
assign (resid  24 and name HA   ) (resid  27 and name HB2  )    3.400    1.600    1.600
assign (resid  25 and name HA   ) (resid  25 and name HG1# )    3.000    1.200    1.200
assign (resid  25 and name HA   ) (resid  25 and name HG2# )    3.000    1.200    1.200
assign (resid  25 and name HA   ) (resid  26 and name HG2# )    3.400    1.600    1.600
assign (resid  25 and name HA   ) (resid  28 and name HB#  )    3.400    1.600    1.600
assign (resid  25 and name HA   ) (resid  78 and name HG1# )    3.000    1.200    1.200
assign (resid  25 and name HA   ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  25 and name HB   ) (resid  25 and name HG2# )    3.000    1.200    1.200
assign (resid  25 and name HG1# ) (resid  25 and name HG2# )    3.000    1.200    1.200
assign (resid  26 and name HA   ) (resid  25 and name HB   )    3.000    1.200    1.200
assign (resid  26 and name HA   ) (resid  26 and name HB   )    3.000    1.200    1.200
assign (resid  26 and name HA   ) (resid  26 and name HG2# )    3.000    1.200    1.200
assign (resid  26 and name HA   ) (resid  29 and name HB1  )    3.400    1.600    1.600
assign (resid  26 and name HA   ) (resid  73 and name HB   )    3.400    1.600    1.600
assign (resid  26 and name HB   ) (resid  11 and name HG2# )    3.400    1.600    1.600
assign (resid  26 and name HB   ) (resid  26 and name HG2# )    2.500    0.700    0.700
assign (resid  26 and name HG2# ) (resid  11 and name HG2# )    3.400    1.600    1.600
assign (resid  26 and name HG2# ) (resid  22 and name HB#  )    3.400    1.600    1.600
assign (resid  27 and name HB1  ) (resid  27 and name HB2  )    2.500    0.700    0.700
assign (resid  27 and name HD2  ) (resid  26 and name HG2# )    3.400    1.600    1.600
assign (resid  27 and name HD2  ) (resid  27 and name HA   )    3.000    1.200    1.200
assign (resid  27 and name HD2  ) (resid  27 and name HB1  )    3.400    1.600    1.600
assign (resid  27 and name HD2  ) (resid  27 and name HB2  )    2.500    0.700    0.700
assign (resid  27 and name HD2  ) (resid  27 and name HE1  )    3.400    1.600    1.600
assign (resid  27 and name HE1  ) (resid  26 and name HG2# )    3.400    1.600    1.600
assign (resid  27 and name HE1  ) (resid  31 and name HB1  )    3.400    1.600    1.600
assign (resid  27 and name HE1  ) (resid  31 and name HB2  )    3.400    1.600    1.600
assign (resid  27 and name HE1  ) (resid  31 and name HG#  )    3.400    1.600    1.600
assign (resid  28 and name HA   ) (resid  28 and name HB#  )    3.000    1.200    1.200
assign (resid  28 and name HA   ) (resid  31 and name HG#  )    3.000    1.200    1.200
assign (resid  29 and name HA   ) (resid  29 and name HB1  )    3.000    1.200    1.200
assign (resid  29 and name HA   ) (resid  29 and name HB2  )    2.500    0.700    0.700
assign (resid  29 and name HA   ) (resid  32 and name HB1  )    3.400    1.600    1.600
assign (resid  29 and name HA   ) (resid  32 and name HB2  )    3.000    1.200    1.200
assign (resid  29 and name HB1  ) (resid  29 and name HB2  )    2.500    0.700    0.700
assign (resid  29 and name HD#  ) (resid   9 and name HD1# )    3.400    1.600    1.600
assign (resid  29 and name HD#  ) (resid  11 and name HG2# )    3.000    1.200    1.200
assign (resid  29 and name HD#  ) (resid  29 and name HA   )    2.500    0.700    0.700
assign (resid  29 and name HD#  ) (resid  29 and name HB1  )    2.500    0.700    0.700
assign (resid  29 and name HD#  ) (resid  29 and name HB2  )    2.500    0.700    0.700
assign (resid  29 and name HD#  ) (resid  29 and name HE1  )    2.500    0.700    0.700
assign (resid  29 and name HE1  ) (resid   9 and name HD1# )    3.000    1.200    1.200
assign (resid  29 and name HE1  ) (resid  29 and name HA   )    3.000    1.200    1.200
assign (resid  29 and name HE2  ) (resid   9 and name HD1# )    3.400    1.600    1.600
assign (resid  30 and name HA   ) (resid  33 and name HB#  )    3.000    1.200    1.200
assign (resid  31 and name HA   ) (resid  31 and name HB1  )    2.500    0.700    0.700
assign (resid  31 and name HA   ) (resid  31 and name HG#  )    3.000    1.200    1.200
assign (resid  31 and name HA   ) (resid  34 and name HB#  )    3.000    1.200    1.200
assign (resid  31 and name HB1  ) (resid  31 and name HG#  )    2.500    0.700    0.700
assign (resid  32 and name HA   ) (resid  32 and name HB1  )    3.400    1.600    1.600
assign (resid  32 and name HA   ) (resid  32 and name HB2  )    3.400    1.600    1.600
assign (resid  32 and name HA   ) (resid  32 and name HG2  )    2.500    0.700    0.700
assign (resid  32 and name HB1  ) (resid  32 and name HB2  )    2.500    0.700    0.700
assign (resid  32 and name HB1  ) (resid  32 and name HG2  )    2.500    0.700    0.700
assign (resid  33 and name HA   ) (resid  33 and name HB#  )    3.400    1.600    1.600
assign (resid  33 and name HA   ) (resid  33 and name HD2# )    3.000    1.200    1.200
assign (resid  33 and name HA   ) (resid  33 and name HG   )    3.000    1.200    1.200
assign (resid  33 and name HA   ) (resid  35 and name HG2# )    3.400    1.600    1.600
assign (resid  34 and name HA   ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  34 and name HA   ) (resid  33 and name HD2# )    3.400    1.600    1.600
assign (resid  34 and name HA   ) (resid  34 and name HB#  )    3.000    1.200    1.200
assign (resid  34 and name HA   ) (resid  34 and name HG#  )    3.000    1.200    1.200
assign (resid  34 and name HA   ) (resid  35 and name HB   )    3.400    1.600    1.600
assign (resid  34 and name HB#  ) (resid  34 and name HG#  )    3.000    1.200    1.200
assign (resid  34 and name HE1  ) (resid  34 and name HB#  )    3.400    1.600    1.600
assign (resid  34 and name HE1  ) (resid  34 and name HG#  )    2.500    0.700    0.700
assign (resid  35 and name HB   ) (resid  35 and name HG11 )    2.500    0.700    0.700
assign (resid  35 and name HB   ) (resid  35 and name HG12 )    3.000    1.200    1.200
assign (resid  35 and name HB   ) (resid  35 and name HG2# )    3.000    1.200    1.200
assign (resid  36 and name HB2  ) (resid  35 and name HA   )    3.000    1.200    1.200
assign (resid  36 and name HB2  ) (resid  36 and name HB1  )    2.500    0.700    0.700
assign (resid  37 and name HA   ) (resid  35 and name HG2# )    3.400    1.600    1.600
assign (resid  37 and name HA   ) (resid  37 and name HB   )    3.000    1.200    1.200
assign (resid  37 and name HA   ) (resid  37 and name HG11 )    2.500    0.700    0.700
assign (resid  37 and name HA   ) (resid  37 and name HG12 )    3.000    1.200    1.200
assign (resid  37 and name HB   ) (resid  37 and name HG11 )    3.000    1.200    1.200
assign (resid  37 and name HB   ) (resid  37 and name HG12 )    2.500    0.700    0.700
assign (resid  37 and name HG11 ) (resid  36 and name HA   )    3.400    1.600    1.600
assign (resid  37 and name HG12 ) (resid  37 and name HG11 )    2.500    0.700    0.700
assign (resid  38 and name HA1  ) (resid  37 and name HG12 )    3.000    1.200    1.200
assign (resid  38 and name HA2  ) (resid  38 and name HA1  )    3.000    1.200    1.200
assign (resid  39 and name HB1  ) (resid  39 and name HA   )    2.500    0.700    0.700
assign (resid  39 and name HB1  ) (resid  39 and name HB2  )    2.500    0.700    0.700
assign (resid  39 and name HB2  ) (resid  39 and name HA   )    2.500    0.700    0.700
assign (resid  40 and name HB   ) (resid  39 and name HA   )    3.000    1.200    1.200
assign (resid  40 and name HB   ) (resid  40 and name HA   )    3.000    1.200    1.200
assign (resid  40 and name HB   ) (resid  40 and name HG1# )    2.500    0.700    0.700
assign (resid  40 and name HB   ) (resid  40 and name HG2# )    3.000    1.200    1.200
assign (resid  40 and name HG1# ) (resid  39 and name HA   )    3.000    1.200    1.200
assign (resid  40 and name HG1# ) (resid  40 and name HA   )    3.000    1.200    1.200
assign (resid  40 and name HG2# ) (resid  39 and name HA   )    3.400    1.600    1.600
assign (resid  40 and name HG2# ) (resid  40 and name HA   )    3.000    1.200    1.200
assign (resid  40 and name HG2# ) (resid  40 and name HG1# )    3.400    1.600    1.600
assign (resid  41 and name HA   ) (resid  40 and name HG1# )    3.400    1.600    1.600
assign (resid  41 and name HA   ) (resid  40 and name HG2# )    3.400    1.600    1.600
assign (resid  42 and name HA   ) (resid  41 and name HA   )    3.000    1.200    1.200
assign (resid  42 and name HA   ) (resid  41 and name HB   )    3.400    1.600    1.600
assign (resid  42 and name HA   ) (resid  42 and name HB#  )    3.000    1.200    1.200
assign (resid  42 and name HA   ) (resid  42 and name HD#  )    2.500    0.700    0.700
assign (resid  42 and name HD#  ) (resid  42 and name HB#  )    3.400    1.600    1.600
assign (resid  43 and name HA   ) (resid  43 and name HB#  )    3.400    1.600    1.600
assign (resid  44 and name HA1  ) (resid  44 and name HA2  )    2.500    0.700    0.700
assign (resid  45 and name HB1  ) (resid  45 and name HA   )    2.500    0.700    0.700
assign (resid  45 and name HB2  ) (resid  45 and name HA   )    3.000    1.200    1.200
assign (resid  46 and name HA   ) (resid  46 and name HB1  )    3.400    1.600    1.600
assign (resid  46 and name HA   ) (resid  46 and name HB2  )    3.000    1.200    1.200
assign (resid  46 and name HD1  ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  46 and name HD1  ) (resid  33 and name HD2# )    3.000    1.200    1.200
assign (resid  46 and name HD1  ) (resid  40 and name HG1# )    3.400    1.600    1.600
assign (resid  46 and name HD1  ) (resid  44 and name HA2  )    3.400    1.600    1.600
assign (resid  46 and name HD1  ) (resid  45 and name HB1  )    2.500    0.700    0.700
assign (resid  46 and name HD1  ) (resid  45 and name HB2  )    3.400    1.600    1.600
assign (resid  46 and name HD2  ) (resid  32 and name HE22 )    2.500    0.700    0.700
assign (resid  46 and name HD2  ) (resid  33 and name HB#  )    3.400    1.600    1.600
assign (resid  46 and name HD2  ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  46 and name HD2  ) (resid  33 and name HD2# )    3.400    1.600    1.600
assign (resid  46 and name HD2  ) (resid  33 and name HG   )    3.400    1.600    1.600
assign (resid  46 and name HE1  ) (resid  34 and name HB#  )    3.400    1.600    1.600
assign (resid  46 and name HE1  ) (resid  34 and name HG1  )    3.000    1.200    1.200
assign (resid  46 and name HE1  ) (resid  35 and name HG2# )    3.400    1.600    1.600
assign (resid  48 and name HA   ) (resid   9 and name HD1# )    3.400    1.600    1.600
assign (resid  48 and name HA   ) (resid  48 and name HD1# )    3.400    1.600    1.600
assign (resid  48 and name HD1# ) (resid   9 and name HD1# )    3.000    1.200    1.200
assign (resid  48 and name HD1# ) (resid  47 and name HA   )    3.400    1.600    1.600
assign (resid  48 and name HG2# ) (resid  48 and name HD1# )    2.500    0.700    0.700
assign (resid  49 and name HA   ) (resid  49 and name HB#  )    3.400    1.600    1.600
assign (resid  49 and name HB#  ) (resid  48 and name HD1# )    3.400    1.600    1.600
assign (resid  64 and name HA   ) (resid  64 and name HB#  )    3.400    1.600    1.600
assign (resid  64 and name HA   ) (resid  64 and name HE#  )    3.400    1.600    1.600
assign (resid  64 and name HA   ) (resid  64 and name HG2  )    3.000    1.200    1.200
assign (resid  64 and name HA   ) (resid  69 and name HA   )    3.000    1.200    1.200
assign (resid  64 and name HE#  ) (resid  64 and name HB#  )    3.400    1.600    1.600
assign (resid  64 and name HE#  ) (resid  64 and name HG1  )    3.400    1.600    1.600
assign (resid  64 and name HG1  ) (resid  64 and name HG2  )    3.400    1.600    1.600
assign (resid  65 and name HA   ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid  65 and name HA   ) (resid  66 and name HA1  )    3.400    1.600    1.600
assign (resid  65 and name HB   ) (resid  65 and name HA   )    3.000    1.200    1.200
assign (resid  65 and name HB   ) (resid  65 and name HG1# )    2.500    0.700    0.700
assign (resid  65 and name HB   ) (resid  65 and name HG2# )    3.000    1.200    1.200
assign (resid  65 and name HG1# ) (resid  65 and name HG2# )    3.000    1.200    1.200
assign (resid  65 and name HG2# ) (resid   9 and name HD1# )    3.400    1.600    1.600
assign (resid  66 and name HA1  ) (resid  66 and name HA2  )    3.000    1.200    1.200
assign (resid  66 and name HA2  ) (resid  67 and name HB#  )    3.400    1.600    1.600
assign (resid  67 and name HA   ) (resid  66 and name HA2  )    3.400    1.600    1.600
assign (resid  67 and name HA   ) (resid  67 and name HB#  )    3.400    1.600    1.600
assign (resid  67 and name HA   ) (resid  67 and name HG#  )    3.000    1.200    1.200
assign (resid  67 and name HG#  ) (resid  67 and name HB#  )    2.500    0.700    0.700
assign (resid  70 and name HB1  ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid  70 and name HD#  ) (resid  70 and name HA   )    3.000    1.200    1.200
assign (resid  70 and name HD#  ) (resid  70 and name HB1  )    3.000    1.200    1.200
assign (resid  70 and name HD#  ) (resid  70 and name HE#  )    3.000    1.200    1.200
assign (resid  70 and name HE#  ) (resid  70 and name HA   )    3.000    1.200    1.200
assign (resid  72 and name HA   ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  72 and name HA   ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  73 and name HA   ) (resid  73 and name HB   )    3.000    1.200    1.200
assign (resid  73 and name HA   ) (resid  73 and name HG1# )    3.000    1.200    1.200
assign (resid  73 and name HA   ) (resid  73 and name HG2# )    3.000    1.200    1.200
assign (resid  73 and name HA   ) (resid  74 and name HG2# )    3.400    1.600    1.600
assign (resid  73 and name HA   ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  73 and name HG1# ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  73 and name HG2# ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  74 and name HB   ) (resid  26 and name HA   )    3.000    1.200    1.200
assign (resid  74 and name HB   ) (resid  74 and name HG2# )    3.400    1.600    1.600
assign (resid  74 and name HG2# ) (resid  73 and name HG1# )    3.400    1.600    1.600
assign (resid  77 and name HA   ) (resid  77 and name HB1  )    3.000    1.200    1.200
assign (resid  77 and name HA   ) (resid  77 and name HB2  )    3.000    1.200    1.200
assign (resid  77 and name HA   ) (resid  77 and name HG#  )    3.000    1.200    1.200
assign (resid  77 and name HA   ) (resid  79 and name HE#  )    3.400    1.600    1.600
assign (resid  77 and name HB1  ) (resid  77 and name HG#  )    3.000    1.200    1.200
assign (resid  77 and name HB1  ) (resid  81 and name HD1# )    3.400    1.600    1.600
assign (resid  77 and name HB2  ) (resid  73 and name HB   )    3.400    1.600    1.600
assign (resid  77 and name HB2  ) (resid  77 and name HG#  )    3.000    1.200    1.200
assign (resid  77 and name HB2  ) (resid  81 and name HD1# )    3.400    1.600    1.600
assign (resid  77 and name HG#  ) (resid  73 and name HG1# )    3.400    1.600    1.600
assign (resid  77 and name HG#  ) (resid  73 and name HG2# )    3.400    1.600    1.600
assign (resid  77 and name HG#  ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  78 and name HA   ) (resid  78 and name HG1# )    2.500    0.700    0.700
assign (resid  78 and name HA   ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  78 and name HA   ) (resid  81 and name HB   )    3.000    1.200    1.200
assign (resid  78 and name HB   ) (resid  78 and name HG1# )    2.500    0.700    0.700
assign (resid  78 and name HB   ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  78 and name HG1# ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  79 and name HA   ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  79 and name HA   ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  79 and name HA   ) (resid  79 and name HB#  )    3.000    1.200    1.200
assign (resid  79 and name HA   ) (resid  82 and name HB1  )    3.400    1.600    1.600
assign (resid  79 and name HG#  ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  80 and name HA   ) (resid  80 and name HB1  )    3.000    1.200    1.200
assign (resid  80 and name HA   ) (resid  80 and name HB2  )    3.000    1.200    1.200
assign (resid  80 and name HA   ) (resid  80 and name HD1  )    3.400    1.600    1.600
assign (resid  80 and name HA   ) (resid  80 and name HD2  )    3.400    1.600    1.600
assign (resid  80 and name HA   ) (resid  83 and name HB#  )    3.000    1.200    1.200
assign (resid  80 and name HB1  ) (resid  80 and name HD2  )    3.000    1.200    1.200
assign (resid  80 and name HB1  ) (resid  80 and name HG1  )    2.500    0.700    0.700
assign (resid  80 and name HB1  ) (resid  80 and name HG2  )    2.500    0.700    0.700
assign (resid  80 and name HD1  ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  80 and name HD2  ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  81 and name HA   ) (resid  81 and name HB   )    2.500    0.700    0.700
assign (resid  81 and name HA   ) (resid  81 and name HD1# )    3.000    1.200    1.200
assign (resid  81 and name HA   ) (resid  81 and name HG2# )    3.000    1.200    1.200
assign (resid  81 and name HB   ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  81 and name HB   ) (resid  81 and name HD1# )    2.500    0.700    0.700
assign (resid  81 and name HG2# ) (resid  65 and name HG2# )    3.400    1.600    1.600
assign (resid  82 and name HA   ) (resid  72 and name HD22 )    3.400    1.600    1.600
assign (resid  82 and name HA   ) (resid  82 and name HB1  )    3.400    1.600    1.600
assign (resid  82 and name HA   ) (resid  82 and name HG   )    3.000    1.200    1.200
assign (resid  82 and name HB2  ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  84 and name HA   ) (resid  72 and name HB1  )    3.000    1.200    1.200
assign (resid  84 and name HA   ) (resid  72 and name HB2  )    3.400    1.600    1.600
assign (resid  84 and name HA   ) (resid  84 and name HB1  )    3.000    1.200    1.200
assign (resid  84 and name HA   ) (resid  84 and name HG1  )    3.400    1.600    1.600
assign (resid  84 and name HA   ) (resid  84 and name HG2  )    3.400    1.600    1.600
assign (resid  84 and name HB1  ) (resid  84 and name HB2  )    2.500    0.700    0.700
assign (resid  84 and name HG1  ) (resid  81 and name HD1# )    3.400    1.600    1.600
assign (resid  84 and name HG1  ) (resid  84 and name HB1  )    3.000    1.200    1.200
assign (resid  84 and name HG1  ) (resid  84 and name HB2  )    3.000    1.200    1.200
assign (resid  84 and name HG1  ) (resid  84 and name HG2  )    2.500    0.700    0.700
assign (resid  85 and name HA   ) (resid  72 and name HB1  )    3.400    1.600    1.600
assign (resid  85 and name HA   ) (resid  72 and name HB2  )    3.400    1.600    1.600
assign (resid  85 and name HA   ) (resid  84 and name HB1  )    3.400    1.600    1.600
assign (resid  85 and name HB1  ) (resid  40 and name HG1# )    3.400    1.600    1.600
assign (resid  85 and name HB1  ) (resid  40 and name HG2# )    3.400    1.600    1.600
assign (resid  85 and name HB1  ) (resid  85 and name HB2  )    2.500    0.700    0.700
assign (resid  85 and name HB2  ) (resid  40 and name HB   )    3.400    1.600    1.600
assign (resid  85 and name HB2  ) (resid  40 and name HG1# )    3.400    1.600    1.600
assign (resid  85 and name HB2  ) (resid  40 and name HG2# )    3.400    1.600    1.600
assign (resid  85 and name HB2  ) (resid  45 and name HB1  )    3.400    1.600    1.600
assign (resid  85 and name HB2  ) (resid  70 and name HD#  )    3.400    1.600    1.600
assign (resid  85 and name HD1  ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid  85 and name HD1  ) (resid  65 and name HG2# )    3.000    1.200    1.200
assign (resid  85 and name HD1  ) (resid  72 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HD1  ) (resid  72 and name HB2  )    3.000    1.200    1.200
assign (resid  85 and name HD1  ) (resid  82 and name HA   )    3.000    1.200    1.200
assign (resid  85 and name HD1  ) (resid  84 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HD1  ) (resid  85 and name HA   )    3.000    1.200    1.200
assign (resid  85 and name HD1  ) (resid  85 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HD1  ) (resid  85 and name HB2  )    3.000    1.200    1.200
assign (resid  85 and name HD2  ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid  85 and name HD2  ) (resid  65 and name HG2# )    3.400    1.600    1.600
assign (resid  85 and name HD2  ) (resid  72 and name HB2  )    3.400    1.600    1.600
assign (resid  85 and name HD2  ) (resid  82 and name HA   )    3.000    1.200    1.200
assign (resid  85 and name HD2  ) (resid  84 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HD2  ) (resid  85 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HD2  ) (resid  85 and name HB2  )    3.400    1.600    1.600
assign (resid  85 and name HE1  ) (resid   9 and name HB   )    3.400    1.600    1.600
assign (resid  85 and name HE1  ) (resid  65 and name HG1# )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  65 and name HG2# )    3.400    1.600    1.600
assign (resid  85 and name HE1  ) (resid  68 and name HB#  )    3.400    1.600    1.600
assign (resid  85 and name HE1  ) (resid  70 and name HA   )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  70 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  70 and name HB2  )    2.500    0.700    0.700
assign (resid  85 and name HE1  ) (resid  70 and name HE#  )    2.500    0.700    0.700
assign (resid  85 and name HE1  ) (resid  71 and name HN   )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  72 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  72 and name HB2  )    3.400    1.600    1.600
assign (resid  85 and name HE1  ) (resid  84 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  85 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  85 and name HB2  )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  85 and name HD1  )    3.000    1.200    1.200
assign (resid  85 and name HE1  ) (resid  85 and name HD2  )    3.400    1.600    1.600
assign (resid  85 and name HE2  ) (resid  65 and name HG2# )    3.000    1.200    1.200
assign (resid  85 and name HE2  ) (resid  70 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HE2  ) (resid  70 and name HB2  )    3.000    1.200    1.200
assign (resid  85 and name HE2  ) (resid  72 and name HB1  )    3.400    1.600    1.600
assign (resid  85 and name HE2  ) (resid  72 and name HB2  )    3.400    1.600    1.600
assign (resid  85 and name HE2  ) (resid  85 and name HB2  )    3.000    1.200    1.200
assign (resid  85 and name HE2  ) (resid  85 and name HD1  )    3.000    1.200    1.200
assign (resid   4 and name HN   ) (resid   4 and name HB1  )    3.000    1.200    1.200
assign (resid   4 and name HN   ) (resid   4 and name HB2  )    2.500    0.700    0.700
assign (resid   4 and name HN   ) (resid   4 and name HD#  )    3.000    1.200    1.200
assign (resid   4 and name HN   ) (resid   4 and name HG#  )    3.000    1.200    1.200
assign (resid   5 and name HN   ) (resid   4 and name HA   )    2.500    0.700    0.700
assign (resid   5 and name HN   ) (resid   4 and name HB1  )    2.500    0.700    0.700
assign (resid   5 and name HN   ) (resid   4 and name HB2  )    2.500    0.700    0.700
assign (resid   5 and name HN   ) (resid   4 and name HN   )    2.500    0.700    0.700
assign (resid   5 and name HN   ) (resid   5 and name HA1  )    2.500    0.700    0.700
assign (resid   5 and name HN   ) (resid   5 and name HA2  )    2.500    0.700    0.700
assign (resid   6 and name HN   ) (resid   5 and name HA1  )    2.500    0.700    0.700
assign (resid   6 and name HN   ) (resid   5 and name HA2  )    2.500    0.700    0.700
assign (resid   6 and name HN   ) (resid   5 and name HN   )    3.400    1.600    1.600
assign (resid   6 and name HN   ) (resid   6 and name HA   )    2.500    0.700    0.700
assign (resid   6 and name HN   ) (resid   6 and name HB1  )    2.500    0.700    0.700
assign (resid   6 and name HN   ) (resid   6 and name HB2  )    3.000    1.200    1.200
assign (resid   6 and name HN   ) (resid   6 and name HD1  )    3.000    1.200    1.200
assign (resid   6 and name HN   ) (resid   6 and name HG2  )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid   5 and name HA1  )    3.400    1.600    1.600
assign (resid   7 and name HN   ) (resid   5 and name HA2  )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid   5 and name HN   )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid   6 and name HA   )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid   6 and name HB1  )    3.400    1.600    1.600
assign (resid   7 and name HN   ) (resid   6 and name HB2  )    3.400    1.600    1.600
assign (resid   7 and name HN   ) (resid   6 and name HG2  )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid   6 and name HN   )    2.500    0.700    0.700
assign (resid   7 and name HN   ) (resid   7 and name HA   )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid   7 and name HB1  )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid   7 and name HB2  )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid  46 and name HA   )    3.000    1.200    1.200
assign (resid   7 and name HN   ) (resid  68 and name HG1  )    3.400    1.600    1.600
assign (resid   7 and name HN   ) (resid  68 and name HG2  )    3.400    1.600    1.600
assign (resid   9 and name HN   ) (resid   8 and name HA   )    2.500    0.700    0.700
assign (resid   9 and name HN   ) (resid   9 and name HA   )    3.000    1.200    1.200
assign (resid   9 and name HN   ) (resid   9 and name HB   )    2.500    0.700    0.700
assign (resid   9 and name HN   ) (resid   9 and name HD1# )    3.000    1.200    1.200
assign (resid   9 and name HN   ) (resid  47 and name HN   )    3.000    1.200    1.200
assign (resid   9 and name HN   ) (resid  48 and name HA   )    3.000    1.200    1.200
assign (resid  10 and name HN   ) (resid   9 and name HA   )    2.500    0.700    0.700
assign (resid  10 and name HN   ) (resid   9 and name HB   )    3.400    1.600    1.600
assign (resid  10 and name HN   ) (resid   9 and name HD1# )    3.400    1.600    1.600
assign (resid  10 and name HN   ) (resid  10 and name HA   )    3.000    1.200    1.200
assign (resid  10 and name HN   ) (resid  10 and name HB1  )    3.000    1.200    1.200
assign (resid  10 and name HN   ) (resid  10 and name HB2  )    3.000    1.200    1.200
assign (resid  10 and name HN   ) (resid  64 and name HN   )    2.500    0.700    0.700
assign (resid  10 and name HN   ) (resid  65 and name HA   )    3.000    1.200    1.200
assign (resid  10 and name HN   ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid  11 and name HN   ) (resid  10 and name HA   )    2.500    0.700    0.700
assign (resid  11 and name HN   ) (resid  10 and name HB2  )    3.400    1.600    1.600
assign (resid  11 and name HN   ) (resid  10 and name HN   )    3.400    1.600    1.600
assign (resid  11 and name HN   ) (resid  11 and name HA   )    2.500    0.700    0.700
assign (resid  11 and name HN   ) (resid  11 and name HB   )    3.000    1.200    1.200
assign (resid  11 and name HN   ) (resid  11 and name HG1# )    3.400    1.600    1.600
assign (resid  11 and name HN   ) (resid  11 and name HG2# )    3.400    1.600    1.600
assign (resid  11 and name HN   ) (resid  50 and name HA   )    3.000    1.200    1.200
assign (resid  21 and name HN   ) (resid  21 and name HA1  )    2.500    0.700    0.700
assign (resid  21 and name HN   ) (resid  21 and name HA2  )    2.500    0.700    0.700
assign (resid  22 and name HN   ) (resid  21 and name HA1  )    3.400    1.600    1.600
assign (resid  22 and name HN   ) (resid  21 and name HA2  )    3.400    1.600    1.600
assign (resid  22 and name HN   ) (resid  21 and name HN   )    3.000    1.200    1.200
assign (resid  23 and name HN   ) (resid  21 and name HA1  )    3.400    1.600    1.600
assign (resid  23 and name HN   ) (resid  22 and name HN   )    3.000    1.200    1.200
assign (resid  23 and name HN   ) (resid  23 and name HA   )    2.500    0.700    0.700
assign (resid  23 and name HN   ) (resid  23 and name HB1  )    2.500    0.700    0.700
assign (resid  24 and name HN   ) (resid  22 and name HA   )    3.400    1.600    1.600
assign (resid  24 and name HN   ) (resid  23 and name HA   )    3.000    1.200    1.200
assign (resid  24 and name HN   ) (resid  23 and name HB1  )    3.000    1.200    1.200
assign (resid  24 and name HN   ) (resid  23 and name HB2  )    3.400    1.600    1.600
assign (resid  24 and name HN   ) (resid  23 and name HN   )    2.500    0.700    0.700
assign (resid  24 and name HN   ) (resid  24 and name HA   )    2.500    0.700    0.700
assign (resid  24 and name HN   ) (resid  24 and name HB1  )    3.000    1.200    1.200
assign (resid  24 and name HN   ) (resid  24 and name HB2  )    3.000    1.200    1.200
assign (resid  24 and name HN   ) (resid  24 and name HD1  )    3.000    1.200    1.200
assign (resid  24 and name HN   ) (resid  24 and name HD2  )    3.000    1.200    1.200
assign (resid  25 and name HN   ) (resid  23 and name HA   )    3.400    1.600    1.600
assign (resid  25 and name HN   ) (resid  23 and name HN   )    3.400    1.600    1.600
assign (resid  25 and name HN   ) (resid  24 and name HA   )    3.400    1.600    1.600
assign (resid  25 and name HN   ) (resid  24 and name HB1  )    3.400    1.600    1.600
assign (resid  25 and name HN   ) (resid  24 and name HB2  )    3.400    1.600    1.600
assign (resid  25 and name HN   ) (resid  24 and name HN   )    2.500    0.700    0.700
assign (resid  25 and name HN   ) (resid  25 and name HA   )    2.500    0.700    0.700
assign (resid  25 and name HN   ) (resid  25 and name HB   )    2.500    0.700    0.700
assign (resid  25 and name HN   ) (resid  25 and name HG1# )    3.400    1.600    1.600
assign (resid  25 and name HN   ) (resid  25 and name HG2# )    3.000    1.200    1.200
assign (resid  26 and name HN   ) (resid  23 and name HA   )    3.000    1.200    1.200
assign (resid  26 and name HN   ) (resid  24 and name HA   )    3.400    1.600    1.600
assign (resid  26 and name HN   ) (resid  24 and name HN   )    3.400    1.600    1.600
assign (resid  26 and name HN   ) (resid  25 and name HA   )    3.000    1.200    1.200
assign (resid  26 and name HN   ) (resid  25 and name HB   )    2.500    0.700    0.700
assign (resid  26 and name HN   ) (resid  25 and name HN   )    2.500    0.700    0.700
assign (resid  26 and name HN   ) (resid  26 and name HA   )    2.500    0.700    0.700
assign (resid  26 and name HN   ) (resid  26 and name HG2# )    3.000    1.200    1.200
assign (resid  27 and name HN   ) (resid  23 and name HA   )    3.400    1.600    1.600
assign (resid  27 and name HN   ) (resid  24 and name HA   )    2.500    0.700    0.700
assign (resid  27 and name HN   ) (resid  25 and name HA   )    3.400    1.600    1.600
assign (resid  27 and name HN   ) (resid  25 and name HN   )    3.400    1.600    1.600
assign (resid  27 and name HN   ) (resid  26 and name HA   )    3.000    1.200    1.200
assign (resid  27 and name HN   ) (resid  26 and name HN   )    2.500    0.700    0.700
assign (resid  27 and name HN   ) (resid  27 and name HA   )    2.500    0.700    0.700
assign (resid  27 and name HN   ) (resid  27 and name HB1  )    2.500    0.700    0.700
assign (resid  27 and name HN   ) (resid  27 and name HB2  )    3.000    1.200    1.200
assign (resid  28 and name HN   ) (resid  24 and name HA   )    3.000    1.200    1.200
assign (resid  28 and name HN   ) (resid  25 and name HA   )    3.000    1.200    1.200
assign (resid  28 and name HN   ) (resid  26 and name HA   )    3.400    1.600    1.600
assign (resid  28 and name HN   ) (resid  27 and name HA   )    2.500    0.700    0.700
assign (resid  28 and name HN   ) (resid  27 and name HB1  )    2.500    0.700    0.700
assign (resid  28 and name HN   ) (resid  27 and name HB2  )    3.000    1.200    1.200
assign (resid  28 and name HN   ) (resid  27 and name HN   )    2.500    0.700    0.700
assign (resid  28 and name HN   ) (resid  28 and name HA   )    2.500    0.700    0.700
assign (resid  28 and name HN   ) (resid  28 and name HB#  )    2.500    0.700    0.700
assign (resid  28 and name HN   ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  28 and name HN   ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  29 and name HN   ) (resid  25 and name HA   )    3.400    1.600    1.600
assign (resid  29 and name HN   ) (resid  26 and name HA   )    2.500    0.700    0.700
assign (resid  29 and name HN   ) (resid  27 and name HA   )    3.400    1.600    1.600
assign (resid  29 and name HN   ) (resid  27 and name HN   )    3.000    1.200    1.200
assign (resid  29 and name HN   ) (resid  28 and name HA   )    3.400    1.600    1.600
assign (resid  29 and name HN   ) (resid  28 and name HB#  )    3.000    1.200    1.200
assign (resid  29 and name HN   ) (resid  28 and name HN   )    2.500    0.700    0.700
assign (resid  29 and name HN   ) (resid  29 and name HA   )    2.500    0.700    0.700
assign (resid  29 and name HN   ) (resid  29 and name HB1  )    2.500    0.700    0.700
assign (resid  29 and name HN   ) (resid  29 and name HB2  )    2.500    0.700    0.700
assign (resid  29 and name HN   ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  29 and name HN   ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  30 and name HN   ) (resid  26 and name HA   )    3.000    1.200    1.200
assign (resid  30 and name HN   ) (resid  27 and name HA   )    2.500    0.700    0.700
assign (resid  30 and name HN   ) (resid  28 and name HN   )    3.400    1.600    1.600
assign (resid  30 and name HN   ) (resid  29 and name HA   )    3.000    1.200    1.200
assign (resid  30 and name HN   ) (resid  29 and name HB1  )    2.500    0.700    0.700
assign (resid  30 and name HN   ) (resid  29 and name HB2  )    2.500    0.700    0.700
assign (resid  30 and name HN   ) (resid  30 and name HA   )    2.500    0.700    0.700
assign (resid  31 and name HN   ) (resid  27 and name HA   )    3.000    1.200    1.200
assign (resid  31 and name HN   ) (resid  28 and name HA   )    3.000    1.200    1.200
assign (resid  31 and name HN   ) (resid  29 and name HA   )    3.400    1.600    1.600
assign (resid  31 and name HN   ) (resid  29 and name HN   )    3.400    1.600    1.600
assign (resid  31 and name HN   ) (resid  30 and name HA   )    2.500    0.700    0.700
assign (resid  31 and name HN   ) (resid  30 and name HN   )    2.500    0.700    0.700
assign (resid  31 and name HN   ) (resid  31 and name HA   )    2.500    0.700    0.700
assign (resid  31 and name HN   ) (resid  31 and name HB1  )    3.000    1.200    1.200
assign (resid  31 and name HN   ) (resid  31 and name HB2  )    3.400    1.600    1.600
assign (resid  31 and name HN   ) (resid  31 and name HG#  )    2.500    0.700    0.700
assign (resid  32 and name HE21 ) (resid  32 and name HA   )    3.400    1.600    1.600
assign (resid  32 and name HE21 ) (resid  32 and name HB1  )    2.500    0.700    0.700
assign (resid  32 and name HE21 ) (resid  32 and name HB2  )    2.500    0.700    0.700
assign (resid  32 and name HE21 ) (resid  32 and name HE22 )    2.500    0.700    0.700
assign (resid  32 and name HE21 ) (resid  32 and name HG2  )    3.400    1.600    1.600
assign (resid  32 and name HE21 ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  32 and name HE21 ) (resid  82 and name HB1  )    3.400    1.600    1.600
assign (resid  32 and name HE21 ) (resid  82 and name HB2  )    3.000    1.200    1.200
assign (resid  32 and name HE22 ) (resid  32 and name HB1  )    3.000    1.200    1.200
assign (resid  32 and name HE22 ) (resid  32 and name HB2  )    3.000    1.200    1.200
assign (resid  32 and name HE22 ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  32 and name HE22 ) (resid  79 and name HN   )    3.000    1.200    1.200
assign (resid  32 and name HE22 ) (resid  82 and name HB1  )    3.000    1.200    1.200
assign (resid  32 and name HE22 ) (resid  82 and name HB2  )    3.000    1.200    1.200
assign (resid  32 and name HN   ) (resid  28 and name HA   )    3.000    1.200    1.200
assign (resid  32 and name HN   ) (resid  29 and name HA   )    3.000    1.200    1.200
assign (resid  32 and name HN   ) (resid  31 and name HA   )    2.500    0.700    0.700
assign (resid  32 and name HN   ) (resid  31 and name HB2  )    3.000    1.200    1.200
assign (resid  32 and name HN   ) (resid  31 and name HN   )    2.500    0.700    0.700
assign (resid  32 and name HN   ) (resid  32 and name HA   )    2.500    0.700    0.700
assign (resid  32 and name HN   ) (resid  32 and name HB1  )    2.500    0.700    0.700
assign (resid  32 and name HN   ) (resid  32 and name HB2  )    2.500    0.700    0.700
assign (resid  32 and name HN   ) (resid  32 and name HG2  )    2.500    0.700    0.700
assign (resid  32 and name HN   ) (resid  78 and name HG2# )    3.400    1.600    1.600
assign (resid  33 and name HN   ) (resid  29 and name HA   )    3.000    1.200    1.200
assign (resid  33 and name HN   ) (resid  31 and name HA   )    3.400    1.600    1.600
assign (resid  33 and name HN   ) (resid  31 and name HN   )    3.400    1.600    1.600
assign (resid  33 and name HN   ) (resid  32 and name HA   )    3.000    1.200    1.200
assign (resid  33 and name HN   ) (resid  32 and name HN   )    2.500    0.700    0.700
assign (resid  33 and name HN   ) (resid  33 and name HA   )    3.000    1.200    1.200
assign (resid  33 and name HN   ) (resid  33 and name HB#  )    3.000    1.200    1.200
assign (resid  33 and name HN   ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  33 and name HN   ) (resid  33 and name HD2# )    3.000    1.200    1.200
assign (resid  33 and name HN   ) (resid  82 and name HD1# )    3.400    1.600    1.600
assign (resid  33 and name HN   ) (resid  82 and name HD2# )    3.400    1.600    1.600
assign (resid  34 and name HN   ) (resid  31 and name HA   )    2.500    0.700    0.700
assign (resid  34 and name HN   ) (resid  32 and name HN   )    3.000    1.200    1.200
assign (resid  34 and name HN   ) (resid  33 and name HA   )    3.000    1.200    1.200
assign (resid  34 and name HN   ) (resid  33 and name HB#  )    3.400    1.600    1.600
assign (resid  34 and name HN   ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  34 and name HN   ) (resid  33 and name HD2# )    3.400    1.600    1.600
assign (resid  34 and name HN   ) (resid  33 and name HG   )    3.000    1.200    1.200
assign (resid  34 and name HN   ) (resid  33 and name HN   )    2.500    0.700    0.700
assign (resid  34 and name HN   ) (resid  35 and name HB   )    2.500    0.700    0.700
assign (resid  34 and name HN   ) (resid  35 and name HD1# )    3.400    1.600    1.600
assign (resid  34 and name HN   ) (resid  35 and name HG11 )    2.500    0.700    0.700
assign (resid  34 and name HN   ) (resid  35 and name HG2# )    3.400    1.600    1.600
assign (resid  34 and name HN   ) (resid  35 and name HN   )    2.500    0.700    0.700
assign (resid  35 and name HN   ) (resid  34 and name HA   )    2.500    0.700    0.700
assign (resid  35 and name HN   ) (resid  34 and name HB#  )    3.000    1.200    1.200
assign (resid  35 and name HN   ) (resid  34 and name HN   )    2.500    0.700    0.700
assign (resid  35 and name HN   ) (resid  35 and name HA   )    2.500    0.700    0.700
assign (resid  35 and name HN   ) (resid  35 and name HB   )    3.000    1.200    1.200
assign (resid  35 and name HN   ) (resid  35 and name HD1# )    3.000    1.200    1.200
assign (resid  35 and name HN   ) (resid  35 and name HG11 )    3.000    1.200    1.200
assign (resid  35 and name HN   ) (resid  35 and name HG12 )    2.500    0.700    0.700
assign (resid  35 and name HN   ) (resid  35 and name HG2# )    3.000    1.200    1.200
assign (resid  36 and name HN   ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  36 and name HN   ) (resid  35 and name HA   )    2.500    0.700    0.700
assign (resid  36 and name HN   ) (resid  35 and name HB   )    2.500    0.700    0.700
assign (resid  36 and name HN   ) (resid  35 and name HD1# )    3.400    1.600    1.600
assign (resid  36 and name HN   ) (resid  35 and name HG12 )    3.400    1.600    1.600
assign (resid  36 and name HN   ) (resid  35 and name HG2# )    3.000    1.200    1.200
assign (resid  36 and name HN   ) (resid  35 and name HN   )    3.400    1.600    1.600
assign (resid  36 and name HN   ) (resid  36 and name HA   )    2.500    0.700    0.700
assign (resid  36 and name HN   ) (resid  36 and name HB1  )    2.500    0.700    0.700
assign (resid  36 and name HN   ) (resid  36 and name HB2  )    2.500    0.700    0.700
assign (resid  37 and name HN   ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  37 and name HN   ) (resid  33 and name HD2# )    3.400    1.600    1.600
assign (resid  37 and name HN   ) (resid  35 and name HG2# )    3.400    1.600    1.600
assign (resid  37 and name HN   ) (resid  36 and name HB1  )    3.000    1.200    1.200
assign (resid  37 and name HN   ) (resid  36 and name HB2  )    2.500    0.700    0.700
assign (resid  37 and name HN   ) (resid  37 and name HA   )    3.000    1.200    1.200
assign (resid  37 and name HN   ) (resid  37 and name HB   )    2.500    0.700    0.700
assign (resid  37 and name HN   ) (resid  37 and name HG11 )    2.500    0.700    0.700
assign (resid  37 and name HN   ) (resid  37 and name HG12 )    2.500    0.700    0.700
assign (resid  37 and name HN   ) (resid  38 and name HN   )    3.400    1.600    1.600
assign (resid  38 and name HN   ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  38 and name HN   ) (resid  35 and name HG12 )    3.400    1.600    1.600
assign (resid  38 and name HN   ) (resid  35 and name HG2# )    3.400    1.600    1.600
assign (resid  38 and name HN   ) (resid  37 and name HA   )    2.500    0.700    0.700
assign (resid  38 and name HN   ) (resid  37 and name HG11 )    2.500    0.700    0.700
assign (resid  38 and name HN   ) (resid  37 and name HG12 )    3.400    1.600    1.600
assign (resid  38 and name HN   ) (resid  38 and name HA1  )    2.500    0.700    0.700
assign (resid  38 and name HN   ) (resid  38 and name HA2  )    2.500    0.700    0.700
assign (resid  38 and name HN   ) (resid  39 and name HN   )    2.500    0.700    0.700
assign (resid  39 and name HN   ) (resid  33 and name HD1# )    3.000    1.200    1.200
assign (resid  39 and name HN   ) (resid  35 and name HG2# )    3.400    1.600    1.600
assign (resid  39 and name HN   ) (resid  36 and name HN   )    3.400    1.600    1.600
assign (resid  39 and name HN   ) (resid  37 and name HA   )    3.400    1.600    1.600
assign (resid  39 and name HN   ) (resid  37 and name HG11 )    3.000    1.200    1.200
assign (resid  39 and name HN   ) (resid  38 and name HA1  )    3.000    1.200    1.200
assign (resid  39 and name HN   ) (resid  38 and name HA2  )    2.500    0.700    0.700
assign (resid  39 and name HN   ) (resid  38 and name HN   )    2.500    0.700    0.700
assign (resid  39 and name HN   ) (resid  39 and name HA   )    2.500    0.700    0.700
assign (resid  39 and name HN   ) (resid  39 and name HB1  )    2.500    0.700    0.700
assign (resid  39 and name HN   ) (resid  39 and name HB2  )    2.500    0.700    0.700
assign (resid  39 and name HN   ) (resid  40 and name HN   )    3.000    1.200    1.200
assign (resid  40 and name HN   ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  40 and name HN   ) (resid  33 and name HD2# )    3.400    1.600    1.600
assign (resid  40 and name HN   ) (resid  35 and name HB   )    3.000    1.200    1.200
assign (resid  40 and name HN   ) (resid  39 and name HA   )    2.500    0.700    0.700
assign (resid  40 and name HN   ) (resid  39 and name HB1  )    2.500    0.700    0.700
assign (resid  40 and name HN   ) (resid  39 and name HB2  )    2.500    0.700    0.700
assign (resid  40 and name HN   ) (resid  39 and name HN   )    3.400    1.600    1.600
assign (resid  40 and name HN   ) (resid  40 and name HA   )    2.500    0.700    0.700
assign (resid  40 and name HN   ) (resid  40 and name HB   )    2.500    0.700    0.700
assign (resid  40 and name HN   ) (resid  40 and name HG1# )    3.000    1.200    1.200
assign (resid  40 and name HN   ) (resid  40 and name HG2# )    3.000    1.200    1.200
assign (resid  41 and name HN   ) (resid  33 and name HD1# )    3.000    1.200    1.200
assign (resid  41 and name HN   ) (resid  33 and name HD2# )    3.400    1.600    1.600
assign (resid  41 and name HN   ) (resid  34 and name HE1  )    3.400    1.600    1.600
assign (resid  41 and name HN   ) (resid  35 and name HG2# )    3.400    1.600    1.600
assign (resid  41 and name HN   ) (resid  36 and name HB1  )    3.400    1.600    1.600
assign (resid  41 and name HN   ) (resid  39 and name HA   )    3.000    1.200    1.200
assign (resid  41 and name HN   ) (resid  40 and name HA   )    2.500    0.700    0.700
assign (resid  41 and name HN   ) (resid  40 and name HB   )    2.500    0.700    0.700
assign (resid  41 and name HN   ) (resid  40 and name HG1# )    3.000    1.200    1.200
assign (resid  41 and name HN   ) (resid  40 and name HG2# )    3.000    1.200    1.200
assign (resid  41 and name HN   ) (resid  40 and name HN   )    3.000    1.200    1.200
assign (resid  41 and name HN   ) (resid  41 and name HA   )    2.500    0.700    0.700
assign (resid  41 and name HN   ) (resid  41 and name HB   )    3.000    1.200    1.200
assign (resid  41 and name HN   ) (resid  42 and name HA   )    3.400    1.600    1.600
assign (resid  41 and name HN   ) (resid  42 and name HB#  )    3.400    1.600    1.600
assign (resid  41 and name HN   ) (resid  42 and name HD#  )    3.000    1.200    1.200
assign (resid  41 and name HN   ) (resid  46 and name HB1  )    3.400    1.600    1.600
assign (resid  43 and name HN   ) (resid  33 and name HD1# )    3.400    1.600    1.600
assign (resid  43 and name HN   ) (resid  36 and name HB1  )    3.000    1.200    1.200
assign (resid  43 and name HN   ) (resid  38 and name HA2  )    3.000    1.200    1.200
assign (resid  43 and name HN   ) (resid  40 and name HG2# )    3.400    1.600    1.600
assign (resid  43 and name HN   ) (resid  42 and name HA   )    3.000    1.200    1.200
assign (resid  43 and name HN   ) (resid  42 and name HD#  )    3.000    1.200    1.200
assign (resid  43 and name HN   ) (resid  43 and name HA   )    2.500    0.700    0.700
assign (resid  43 and name HN   ) (resid  43 and name HB#  )    3.000    1.200    1.200
assign (resid  43 and name HN   ) (resid  44 and name HA2  )    3.000    1.200    1.200
assign (resid  43 and name HN   ) (resid  45 and name HB1  )    3.000    1.200    1.200
assign (resid  43 and name HN   ) (resid  45 and name HN   )    3.400    1.600    1.600
assign (resid  44 and name HN   ) (resid  40 and name HG1# )    3.400    1.600    1.600
assign (resid  44 and name HN   ) (resid  40 and name HG2# )    3.400    1.600    1.600
assign (resid  44 and name HN   ) (resid  42 and name HA   )    3.000    1.200    1.200
assign (resid  44 and name HN   ) (resid  43 and name HA   )    3.000    1.200    1.200
assign (resid  44 and name HN   ) (resid  43 and name HN   )    2.500    0.700    0.700
assign (resid  44 and name HN   ) (resid  44 and name HA1  )    2.500    0.700    0.700
assign (resid  44 and name HN   ) (resid  44 and name HA2  )    2.500    0.700    0.700
assign (resid  44 and name HN   ) (resid  45 and name HB1  )    3.000    1.200    1.200
assign (resid  44 and name HN   ) (resid  45 and name HN   )    2.500    0.700    0.700
assign (resid  44 and name HN   ) (resid  46 and name HN   )    3.400    1.600    1.600
assign (resid  45 and name HN   ) (resid   6 and name HB2  )    3.400    1.600    1.600
assign (resid  45 and name HN   ) (resid  39 and name HB2  )    3.400    1.600    1.600
assign (resid  45 and name HN   ) (resid  40 and name HG1# )    3.000    1.200    1.200
assign (resid  45 and name HN   ) (resid  40 and name HG2# )    3.400    1.600    1.600
assign (resid  45 and name HN   ) (resid  43 and name HN   )    3.000    1.200    1.200
assign (resid  45 and name HN   ) (resid  44 and name HA1  )    3.000    1.200    1.200
assign (resid  45 and name HN   ) (resid  44 and name HA2  )    2.500    0.700    0.700
assign (resid  45 and name HN   ) (resid  44 and name HN   )    3.000    1.200    1.200
assign (resid  45 and name HN   ) (resid  45 and name HA   )    2.500    0.700    0.700
assign (resid  45 and name HN   ) (resid  45 and name HB1  )    3.000    1.200    1.200
assign (resid  45 and name HN   ) (resid  45 and name HB2  )    2.500    0.700    0.700
assign (resid  45 and name HN   ) (resid  45 and name HG#  )    3.000    1.200    1.200
assign (resid  45 and name HN   ) (resid  46 and name HD1  )    3.400    1.600    1.600
assign (resid  45 and name HN   ) (resid  46 and name HN   )    2.500    0.700    0.700
assign (resid  46 and name HN   ) (resid  44 and name HA2  )    3.000    1.200    1.200
assign (resid  46 and name HN   ) (resid  45 and name HA   )    3.000    1.200    1.200
assign (resid  46 and name HN   ) (resid  45 and name HB1  )    2.500    0.700    0.700
assign (resid  46 and name HN   ) (resid  45 and name HB2  )    2.500    0.700    0.700
assign (resid  46 and name HN   ) (resid  45 and name HG#  )    3.400    1.600    1.600
assign (resid  46 and name HN   ) (resid  45 and name HN   )    2.500    0.700    0.700
assign (resid  46 and name HN   ) (resid  46 and name HA   )    2.500    0.700    0.700
assign (resid  46 and name HN   ) (resid  46 and name HB1  )    2.500    0.700    0.700
assign (resid  46 and name HN   ) (resid  46 and name HB2  )    2.500    0.700    0.700
assign (resid  47 and name HN   ) (resid   8 and name HA   )    2.500    0.700    0.700
assign (resid  47 and name HN   ) (resid   9 and name HN   )    3.000    1.200    1.200
assign (resid  47 and name HN   ) (resid  46 and name HA   )    2.500    0.700    0.700
assign (resid  47 and name HN   ) (resid  46 and name HB1  )    3.000    1.200    1.200
assign (resid  47 and name HN   ) (resid  46 and name HB2  )    2.500    0.700    0.700
assign (resid  47 and name HN   ) (resid  47 and name HA   )    3.000    1.200    1.200
assign (resid  48 and name HN   ) (resid  47 and name HA   )    2.500    0.700    0.700
assign (resid  48 and name HN   ) (resid  48 and name HA   )    3.000    1.200    1.200
assign (resid  48 and name HN   ) (resid  48 and name HD1# )    3.400    1.600    1.600
assign (resid  48 and name HN   ) (resid  48 and name HG2# )    3.000    1.200    1.200
assign (resid  49 and name HN   ) (resid   9 and name HB   )    3.000    1.200    1.200
assign (resid  49 and name HN   ) (resid   9 and name HD1# )    3.400    1.600    1.600
assign (resid  49 and name HN   ) (resid   9 and name HN   )    3.000    1.200    1.200
assign (resid  49 and name HN   ) (resid  10 and name HA   )    2.500    0.700    0.700
assign (resid  49 and name HN   ) (resid  11 and name HN   )    3.000    1.200    1.200
assign (resid  49 and name HN   ) (resid  48 and name HA   )    2.500    0.700    0.700
assign (resid  49 and name HN   ) (resid  48 and name HD1# )    3.000    1.200    1.200
assign (resid  49 and name HN   ) (resid  48 and name HG2# )    3.000    1.200    1.200
assign (resid  49 and name HN   ) (resid  49 and name HA   )    2.500    0.700    0.700
assign (resid  49 and name HN   ) (resid  49 and name HB#  )    3.000    1.200    1.200
assign (resid  50 and name HN   ) (resid  11 and name HG2# )    3.000    1.200    1.200
assign (resid  50 and name HN   ) (resid  11 and name HN   )    3.400    1.600    1.600
assign (resid  50 and name HN   ) (resid  49 and name HA   )    2.500    0.700    0.700
assign (resid  50 and name HN   ) (resid  49 and name HB#  )    2.500    0.700    0.700
assign (resid  50 and name HN   ) (resid  49 and name HN   )    3.400    1.600    1.600
assign (resid  50 and name HN   ) (resid  50 and name HA   )    3.000    1.200    1.200
assign (resid  50 and name HN   ) (resid  50 and name HB   )    3.000    1.200    1.200
assign (resid  64 and name HN   ) (resid  10 and name HN   )    3.000    1.200    1.200
assign (resid  64 and name HN   ) (resid  11 and name HA   )    3.000    1.200    1.200
assign (resid  64 and name HN   ) (resid  11 and name HG2# )    3.000    1.200    1.200
assign (resid  64 and name HN   ) (resid  63 and name HA   )    2.500    0.700    0.700
assign (resid  64 and name HN   ) (resid  64 and name HA   )    3.000    1.200    1.200
assign (resid  64 and name HN   ) (resid  64 and name HB#  )    3.000    1.200    1.200
assign (resid  64 and name HN   ) (resid  64 and name HG2  )    3.000    1.200    1.200
assign (resid  64 and name HN   ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid  64 and name HN   ) (resid  69 and name HG1# )    3.400    1.600    1.600
assign (resid  65 and name HN   ) (resid  64 and name HA   )    2.500    0.700    0.700
assign (resid  65 and name HN   ) (resid  64 and name HB#  )    3.000    1.200    1.200
assign (resid  65 and name HN   ) (resid  64 and name HE#  )    3.400    1.600    1.600
assign (resid  65 and name HN   ) (resid  64 and name HG1  )    3.400    1.600    1.600
assign (resid  65 and name HN   ) (resid  64 and name HG2  )    2.500    0.700    0.700
assign (resid  65 and name HN   ) (resid  65 and name HA   )    2.500    0.700    0.700
assign (resid  65 and name HN   ) (resid  65 and name HG1# )    3.000    1.200    1.200
assign (resid  65 and name HN   ) (resid  65 and name HG2# )    3.000    1.200    1.200
assign (resid  65 and name HN   ) (resid  68 and name HN   )    3.000    1.200    1.200
assign (resid  65 and name HN   ) (resid  69 and name HA   )    3.400    1.600    1.600
assign (resid  65 and name HN   ) (resid  70 and name HD#  )    3.000    1.200    1.200
assign (resid  65 and name HN   ) (resid  70 and name HE#  )    3.000    1.200    1.200
assign (resid  66 and name HN   ) (resid   8 and name HB#  )    3.000    1.200    1.200
assign (resid  66 and name HN   ) (resid   9 and name HA   )    3.000    1.200    1.200
assign (resid  66 and name HN   ) (resid  65 and name HA   )    2.500    0.700    0.700
assign (resid  66 and name HN   ) (resid  65 and name HB   )    3.000    1.200    1.200
assign (resid  66 and name HN   ) (resid  65 and name HG1# )    3.000    1.200    1.200
assign (resid  66 and name HN   ) (resid  65 and name HG2# )    3.000    1.200    1.200
assign (resid  66 and name HN   ) (resid  65 and name HN   )    3.400    1.600    1.600
assign (resid  66 and name HN   ) (resid  66 and name HA1  )    2.500    0.700    0.700
assign (resid  66 and name HN   ) (resid  66 and name HA2  )    2.500    0.700    0.700
assign (resid  66 and name HN   ) (resid  67 and name HN   )    3.400    1.600    1.600
assign (resid  67 and name HN   ) (resid   8 and name HB#  )    3.400    1.600    1.600
assign (resid  67 and name HN   ) (resid  66 and name HA1  )    2.500    0.700    0.700
assign (resid  67 and name HN   ) (resid  66 and name HA2  )    2.500    0.700    0.700
assign (resid  67 and name HN   ) (resid  66 and name HN   )    3.000    1.200    1.200
assign (resid  67 and name HN   ) (resid  67 and name HA   )    3.000    1.200    1.200
assign (resid  67 and name HN   ) (resid  67 and name HB#  )    2.500    0.700    0.700
assign (resid  67 and name HN   ) (resid  67 and name HG#  )    2.500    0.700    0.700
assign (resid  67 and name HN   ) (resid  68 and name HN   )    2.500    0.700    0.700
assign (resid  68 and name HN   ) (resid  64 and name HA   )    3.400    1.600    1.600
assign (resid  68 and name HN   ) (resid  65 and name HB   )    3.400    1.600    1.600
assign (resid  68 and name HN   ) (resid  65 and name HG1# )    3.400    1.600    1.600
assign (resid  68 and name HN   ) (resid  65 and name HN   )    3.000    1.200    1.200
assign (resid  68 and name HN   ) (resid  66 and name HA1  )    2.500    0.700    0.700
assign (resid  68 and name HN   ) (resid  67 and name HA   )    2.500    0.700    0.700
assign (resid  68 and name HN   ) (resid  67 and name HB#  )    3.000    1.200    1.200
assign (resid  68 and name HN   ) (resid  67 and name HG#  )    3.400    1.600    1.600
assign (resid  68 and name HN   ) (resid  67 and name HN   )    2.500    0.700    0.700
assign (resid  68 and name HN   ) (resid  68 and name HA   )    2.500    0.700    0.700
assign (resid  68 and name HN   ) (resid  68 and name HB#  )    2.500    0.700    0.700
assign (resid  68 and name HN   ) (resid  68 and name HD#  )    3.400    1.600    1.600
assign (resid  69 and name HN   ) (resid  64 and name HG2  )    2.500    0.700    0.700
assign (resid  69 and name HN   ) (resid  68 and name HA   )    2.500    0.700    0.700
assign (resid  69 and name HN   ) (resid  69 and name HA   )    2.500    0.700    0.700
assign (resid  69 and name HN   ) (resid  69 and name HG1# )    2.500    0.700    0.700
assign (resid  70 and name HN   ) (resid  63 and name HG1# )    3.000    1.200    1.200
assign (resid  70 and name HN   ) (resid  64 and name HA   )    3.000    1.200    1.200
assign (resid  70 and name HN   ) (resid  64 and name HB#  )    3.400    1.600    1.600
assign (resid  70 and name HN   ) (resid  69 and name HA   )    2.500    0.700    0.700
assign (resid  70 and name HN   ) (resid  70 and name HA   )    3.000    1.200    1.200
assign (resid  70 and name HN   ) (resid  70 and name HB1  )    3.000    1.200    1.200
assign (resid  70 and name HN   ) (resid  70 and name HB2  )    3.000    1.200    1.200
assign (resid  70 and name HN   ) (resid  70 and name HD#  )    3.000    1.200    1.200
assign (resid  70 and name HN   ) (resid  70 and name HE#  )    3.400    1.600    1.600
assign (resid  71 and name HN   ) (resid  70 and name HA   )    2.500    0.700    0.700
assign (resid  71 and name HN   ) (resid  70 and name HB2  )    3.000    1.200    1.200
assign (resid  71 and name HN   ) (resid  70 and name HD#  )    3.000    1.200    1.200
assign (resid  71 and name HN   ) (resid  71 and name HA1  )    2.500    0.700    0.700
assign (resid  71 and name HN   ) (resid  71 and name HA2  )    2.500    0.700    0.700
assign (resid  71 and name HN   ) (resid  73 and name HG1# )    3.400    1.600    1.600
assign (resid  72 and name HD21 ) (resid  72 and name HA   )    3.000    1.200    1.200
assign (resid  72 and name HD21 ) (resid  72 and name HB1  )    3.000    1.200    1.200
assign (resid  72 and name HD21 ) (resid  72 and name HB2  )    3.000    1.200    1.200
assign (resid  72 and name HD21 ) (resid  72 and name HD22 )    2.500    0.700    0.700
assign (resid  72 and name HD21 ) (resid  73 and name HG1# )    3.400    1.600    1.600
assign (resid  72 and name HD22 ) (resid  72 and name HB1  )    3.400    1.600    1.600
assign (resid  72 and name HD22 ) (resid  72 and name HB2  )    3.400    1.600    1.600
assign (resid  72 and name HD22 ) (resid  73 and name HG1# )    3.400    1.600    1.600
assign (resid  72 and name HN   ) (resid  71 and name HA1  )    3.000    1.200    1.200
assign (resid  72 and name HN   ) (resid  71 and name HA2  )    3.000    1.200    1.200
assign (resid  72 and name HN   ) (resid  72 and name HA   )    2.500    0.700    0.700
assign (resid  72 and name HN   ) (resid  72 and name HD21 )    3.400    1.600    1.600
assign (resid  72 and name HN   ) (resid  73 and name HN   )    3.400    1.600    1.600
assign (resid  73 and name HN   ) (resid  72 and name HA   )    2.500    0.700    0.700
assign (resid  73 and name HN   ) (resid  72 and name HN   )    3.400    1.600    1.600
assign (resid  73 and name HN   ) (resid  73 and name HA   )    3.000    1.200    1.200
assign (resid  73 and name HN   ) (resid  73 and name HG1# )    3.000    1.200    1.200
assign (resid  73 and name HN   ) (resid  73 and name HG2# )    3.000    1.200    1.200
assign (resid  73 and name HN   ) (resid  74 and name HN   )    3.400    1.600    1.600
assign (resid  73 and name HN   ) (resid  78 and name HA   )    3.400    1.600    1.600
assign (resid  74 and name HN   ) (resid  25 and name HG2# )    3.400    1.600    1.600
assign (resid  74 and name HN   ) (resid  73 and name HA   )    2.500    0.700    0.700
assign (resid  74 and name HN   ) (resid  73 and name HG1# )    3.000    1.200    1.200
assign (resid  74 and name HN   ) (resid  73 and name HG2# )    3.000    1.200    1.200
assign (resid  74 and name HN   ) (resid  73 and name HN   )    3.400    1.600    1.600
assign (resid  74 and name HN   ) (resid  74 and name HA   )    2.500    0.700    0.700
assign (resid  74 and name HN   ) (resid  74 and name HG2# )    3.000    1.200    1.200
assign (resid  76 and name HN   ) (resid  76 and name HA1  )    3.000    1.200    1.200
assign (resid  76 and name HN   ) (resid  76 and name HA2  )    2.500    0.700    0.700
assign (resid  76 and name HN   ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  76 and name HN   ) (resid  79 and name HG#  )    3.400    1.600    1.600
assign (resid  77 and name HE21 ) (resid  73 and name HG2# )    3.400    1.600    1.600
assign (resid  77 and name HE21 ) (resid  74 and name HG2# )    3.400    1.600    1.600
assign (resid  77 and name HE21 ) (resid  77 and name HB1  )    3.000    1.200    1.200
assign (resid  77 and name HE21 ) (resid  77 and name HB2  )    3.000    1.200    1.200
assign (resid  77 and name HE21 ) (resid  77 and name HG#  )    3.400    1.600    1.600
assign (resid  77 and name HE21 ) (resid  78 and name HG1# )    3.400    1.600    1.600
assign (resid  77 and name HE22 ) (resid  77 and name HB1  )    3.000    1.200    1.200
assign (resid  77 and name HE22 ) (resid  77 and name HB2  )    3.000    1.200    1.200
assign (resid  77 and name HN   ) (resid  74 and name HN   )    3.000    1.200    1.200
assign (resid  77 and name HN   ) (resid  76 and name HA1  )    2.500    0.700    0.700
assign (resid  77 and name HN   ) (resid  76 and name HA2  )    3.000    1.200    1.200
assign (resid  77 and name HN   ) (resid  77 and name HA   )    2.500    0.700    0.700
assign (resid  77 and name HN   ) (resid  77 and name HB1  )    3.000    1.200    1.200
assign (resid  77 and name HN   ) (resid  77 and name HB2  )    3.000    1.200    1.200
assign (resid  77 and name HN   ) (resid  77 and name HG#  )    2.500    0.700    0.700
assign (resid  77 and name HN   ) (resid  78 and name HB   )    3.400    1.600    1.600
assign (resid  77 and name HN   ) (resid  78 and name HN   )    2.500    0.700    0.700
assign (resid  78 and name HN   ) (resid  28 and name HB#  )    3.400    1.600    1.600
assign (resid  78 and name HN   ) (resid  76 and name HA1  )    3.000    1.200    1.200
assign (resid  78 and name HN   ) (resid  76 and name HA2  )    3.400    1.600    1.600
assign (resid  78 and name HN   ) (resid  77 and name HA   )    3.000    1.200    1.200
assign (resid  78 and name HN   ) (resid  77 and name HG#  )    3.000    1.200    1.200
assign (resid  78 and name HN   ) (resid  77 and name HN   )    2.500    0.700    0.700
assign (resid  78 and name HN   ) (resid  78 and name HA   )    2.500    0.700    0.700
assign (resid  78 and name HN   ) (resid  78 and name HB   )    2.500    0.700    0.700
assign (resid  78 and name HN   ) (resid  78 and name HG1# )    2.500    0.700    0.700
assign (resid  78 and name HN   ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  78 and name HN   ) (resid  79 and name HN   )    2.500    0.700    0.700
assign (resid  78 and name HN   ) (resid  80 and name HN   )    3.000    1.200    1.200
assign (resid  79 and name HN   ) (resid  32 and name HE22 )    3.000    1.200    1.200
assign (resid  79 and name HN   ) (resid  77 and name HA   )    3.400    1.600    1.600
assign (resid  79 and name HN   ) (resid  77 and name HN   )    3.400    1.600    1.600
assign (resid  79 and name HN   ) (resid  78 and name HA   )    3.000    1.200    1.200
assign (resid  79 and name HN   ) (resid  78 and name HB   )    2.500    0.700    0.700
assign (resid  79 and name HN   ) (resid  78 and name HG1# )    3.000    1.200    1.200
assign (resid  79 and name HN   ) (resid  78 and name HG2# )    3.000    1.200    1.200
assign (resid  79 and name HN   ) (resid  78 and name HN   )    2.500    0.700    0.700
assign (resid  79 and name HN   ) (resid  79 and name HA   )    2.500    0.700    0.700
assign (resid  79 and name HN   ) (resid  79 and name HB#  )    2.500    0.700    0.700
assign (resid  79 and name HN   ) (resid  79 and name HG#  )    3.400    1.600    1.600
assign (resid  79 and name HN   ) (resid  80 and name HG1  )    2.500    0.700    0.700
assign (resid  79 and name HN   ) (resid  80 and name HN   )    2.500    0.700    0.700
assign (resid  80 and name HN   ) (resid  77 and name HA   )    3.000    1.200    1.200
assign (resid  80 and name HN   ) (resid  78 and name HA   )    3.400    1.600    1.600
assign (resid  80 and name HN   ) (resid  79 and name HA   )    3.000    1.200    1.200
assign (resid  80 and name HN   ) (resid  79 and name HB#  )    3.000    1.200    1.200
assign (resid  80 and name HN   ) (resid  79 and name HG#  )    3.400    1.600    1.600
assign (resid  80 and name HN   ) (resid  79 and name HN   )    3.000    1.200    1.200
assign (resid  80 and name HN   ) (resid  80 and name HA   )    2.500    0.700    0.700
assign (resid  80 and name HN   ) (resid  80 and name HB1  )    2.500    0.700    0.700
assign (resid  80 and name HN   ) (resid  80 and name HB2  )    2.500    0.700    0.700
assign (resid  80 and name HN   ) (resid  80 and name HD1  )    3.000    1.200    1.200
assign (resid  80 and name HN   ) (resid  80 and name HD2  )    3.000    1.200    1.200
assign (resid  80 and name HN   ) (resid  80 and name HG1  )    3.000    1.200    1.200
assign (resid  80 and name HN   ) (resid  80 and name HG2  )    3.000    1.200    1.200
assign (resid  80 and name HN   ) (resid  81 and name HD1# )    3.400    1.600    1.600
assign (resid  81 and name HN   ) (resid  78 and name HA   )    3.000    1.200    1.200
assign (resid  81 and name HN   ) (resid  80 and name HB1  )    3.000    1.200    1.200
assign (resid  81 and name HN   ) (resid  80 and name HB2  )    3.000    1.200    1.200
assign (resid  81 and name HN   ) (resid  80 and name HD1  )    3.000    1.200    1.200
assign (resid  81 and name HN   ) (resid  80 and name HG1  )    3.400    1.600    1.600
assign (resid  81 and name HN   ) (resid  80 and name HG2  )    3.000    1.200    1.200
assign (resid  81 and name HN   ) (resid  80 and name HN   )    2.500    0.700    0.700
assign (resid  81 and name HN   ) (resid  81 and name HA   )    2.500    0.700    0.700
assign (resid  81 and name HN   ) (resid  81 and name HB   )    3.000    1.200    1.200
assign (resid  81 and name HN   ) (resid  81 and name HD1# )    3.000    1.200    1.200
assign (resid  81 and name HN   ) (resid  81 and name HG2# )    3.000    1.200    1.200
assign (resid  81 and name HN   ) (resid  83 and name HN   )    3.400    1.600    1.600
assign (resid  82 and name HN   ) (resid  72 and name HB2  )    3.400    1.600    1.600
assign (resid  82 and name HN   ) (resid  72 and name HD22 )    3.400    1.600    1.600
assign (resid  82 and name HN   ) (resid  78 and name HA   )    3.400    1.600    1.600
assign (resid  82 and name HN   ) (resid  79 and name HA   )    3.000    1.200    1.200
assign (resid  82 and name HN   ) (resid  80 and name HA   )    3.400    1.600    1.600
assign (resid  82 and name HN   ) (resid  80 and name HN   )    3.400    1.600    1.600
assign (resid  82 and name HN   ) (resid  81 and name HA   )    3.000    1.200    1.200
assign (resid  82 and name HN   ) (resid  81 and name HB   )    2.500    0.700    0.700
assign (resid  82 and name HN   ) (resid  81 and name HD1# )    3.400    1.600    1.600
assign (resid  82 and name HN   ) (resid  81 and name HG2# )    3.000    1.200    1.200
assign (resid  82 and name HN   ) (resid  81 and name HN   )    3.000    1.200    1.200
assign (resid  82 and name HN   ) (resid  82 and name HA   )    3.000    1.200    1.200
assign (resid  82 and name HN   ) (resid  82 and name HB1  )    3.000    1.200    1.200
assign (resid  82 and name HN   ) (resid  82 and name HB2  )    2.500    0.700    0.700
assign (resid  82 and name HN   ) (resid  82 and name HD2# )    3.400    1.600    1.600
assign (resid  82 and name HN   ) (resid  83 and name HB#  )    3.400    1.600    1.600
assign (resid  83 and name HN   ) (resid  80 and name HA   )    2.500    0.700    0.700
assign (resid  83 and name HN   ) (resid  82 and name HA   )    3.000    1.200    1.200
assign (resid  83 and name HN   ) (resid  82 and name HB1  )    3.000    1.200    1.200
assign (resid  83 and name HN   ) (resid  82 and name HB2  )    3.000    1.200    1.200
assign (resid  83 and name HN   ) (resid  82 and name HG   )    3.000    1.200    1.200
assign (resid  83 and name HN   ) (resid  82 and name HN   )    2.500    0.700    0.700
assign (resid  83 and name HN   ) (resid  83 and name HB#  )    2.500    0.700    0.700
assign (resid  83 and name HN   ) (resid  84 and name HB2  )    3.400    1.600    1.600
assign (resid  83 and name HN   ) (resid  85 and name HN   )    3.400    1.600    1.600
assign (resid  84 and name HN   ) (resid  80 and name HA   )    3.400    1.600    1.600
assign (resid  84 and name HN   ) (resid  81 and name HA   )    3.400    1.600    1.600
assign (resid  84 and name HN   ) (resid  82 and name HA   )    3.400    1.600    1.600
assign (resid  84 and name HN   ) (resid  82 and name HB1  )    3.400    1.600    1.600
assign (resid  84 and name HN   ) (resid  82 and name HG   )    3.400    1.600    1.600
assign (resid  84 and name HN   ) (resid  83 and name HA   )    3.000    1.200    1.200
assign (resid  84 and name HN   ) (resid  83 and name HB#  )    3.000    1.200    1.200
assign (resid  84 and name HN   ) (resid  83 and name HN   )    2.500    0.700    0.700
assign (resid  84 and name HN   ) (resid  84 and name HA   )    2.500    0.700    0.700
assign (resid  84 and name HN   ) (resid  84 and name HB1  )    2.500    0.700    0.700
assign (resid  84 and name HN   ) (resid  84 and name HB2  )    2.500    0.700    0.700
assign (resid  84 and name HN   ) (resid  84 and name HG1  )    3.000    1.200    1.200
assign (resid  84 and name HN   ) (resid  84 and name HG2  )    3.000    1.200    1.200
assign (resid  84 and name HN   ) (resid  85 and name HD1  )    3.400    1.600    1.600
assign (resid  84 and name HN   ) (resid  85 and name HN   )    2.500    0.700    0.700
assign (resid  85 and name HD2  ) (resid  82 and name HD1# )    3.400    1.600    1.600
assign (resid  85 and name HN   ) (resid  82 and name HA   )    3.000    1.200    1.200
assign (resid  85 and name HN   ) (resid  82 and name HG   )    3.400    1.600    1.600
assign (resid  85 and name HN   ) (resid  83 and name HA   )    3.000    1.200    1.200
assign (resid  85 and name HN   ) (resid  83 and name HB#  )    3.400    1.600    1.600
assign (resid  85 and name HN   ) (resid  83 and name HN   )    3.400    1.600    1.600
assign (resid  85 and name HN   ) (resid  84 and name HA   )    3.000    1.200    1.200
assign (resid  85 and name HN   ) (resid  84 and name HB1  )    3.000    1.200    1.200
assign (resid  85 and name HN   ) (resid  84 and name HB2  )    2.500    0.700    0.700
assign (resid  85 and name HN   ) (resid  84 and name HN   )    2.500    0.700    0.700
assign (resid  85 and name HN   ) (resid  85 and name HA   )    2.500    0.700    0.700
assign (resid  85 and name HN   ) (resid  85 and name HB1  )    2.500    0.700    0.700
assign (resid  85 and name HN   ) (resid  85 and name HB2  )    2.500    0.700    0.700
assign (resid  85 and name HN   ) (resid  85 and name HD1  )    2.500    0.700    0.700
assign (resid  85 and name HN   ) (resid  85 and name HD2  )    3.000    1.200    1.200

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          HT1       MET   1   9.569  -5.195  -7.999
    2   2H    MET   1          HT2       MET   1   8.731  -6.241  -9.038
    3   3H    MET   1          HT3       MET   1   8.990  -4.626  -9.486
    4    HA   MET   1           HA       MET   1  11.109  -6.653  -9.086
    5   1HB   MET   1          HB2       MET   1   9.930  -5.481 -11.610
    6   2HB   MET   1          HB1       MET   1  11.418  -6.417 -11.565
    7   1HG   MET   1          HG2       MET   1   8.668  -7.381 -10.809
    8   2HG   MET   1          HG1       MET   1   9.577  -7.811 -12.258
    9   1HE   MET   1          HE1       MET   1   8.288 -10.020 -10.366
   10   2HE   MET   1          HE2       MET   1   9.616 -11.180 -10.292
   11   3HE   MET   1          HE3       MET   1   9.229 -10.373 -11.813
   12    H    VAL   2           HN       VAL   2  10.528  -3.555 -10.807
   13    HA   VAL   2           HA       VAL   2  13.132  -2.565 -10.306
   14    HB   VAL   2           HB       VAL   2  10.611  -0.964 -10.811
   15   1HG1  VAL   2          HG11      VAL   2  12.368   0.398  -9.843
   16   2HG1  VAL   2          HG12      VAL   2  12.151   0.802 -11.547
   17   3HG1  VAL   2          HG13      VAL   2  13.515  -0.194 -11.044
   18   1HG2  VAL   2          HG21      VAL   2  11.048  -2.540 -12.609
   19   2HG2  VAL   2          HG22      VAL   2  12.713  -1.969 -12.726
   20   3HG2  VAL   2          HG23      VAL   2  11.379  -0.892 -13.141
   21    HA   PRO   3           HA       PRO   3  11.213  -1.044  -6.131
   22   1HB   PRO   3          HB2       PRO   3   8.560  -2.331  -6.193
   23   2HB   PRO   3          HB1       PRO   3   9.002  -0.713  -5.639
   24   1HG   PRO   3          HG2       PRO   3   7.614  -1.104  -7.905
   25   2HG   PRO   3          HG1       PRO   3   8.795   0.209  -7.744
   26   1HD   PRO   3          HD2       PRO   3   9.074  -2.438  -9.115
   27   2HD   PRO   3          HD1       PRO   3   9.651  -0.838  -9.625
   28    H    LYS   4           HN       LYS   4  12.264  -2.429  -4.889
   29    HA   LYS   4           HA       LYS   4  13.088  -4.905  -5.557
   30   1HB   LYS   4          HB2       LYS   4  13.771  -3.385  -3.601
   31   2HB   LYS   4          HB1       LYS   4  12.559  -4.263  -2.691
   32   1HG   LYS   4          HG2       LYS   4  14.674  -5.238  -2.243
   33   2HG   LYS   4          HG1       LYS   4  13.754  -6.365  -3.239
   34   1HD   LYS   4          HD2       LYS   4  15.110  -6.078  -5.058
   35   2HD   LYS   4          HD1       LYS   4  15.529  -4.420  -4.613
   36   1HE   LYS   4          HE2       LYS   4  16.500  -6.888  -3.175
   37   2HE   LYS   4          HE1       LYS   4  17.426  -5.997  -4.385
   38   1HZ   LYS   4          HZ1       LYS   4  17.950  -5.408  -2.036
   39   2HZ   LYS   4          HZ2       LYS   4  16.386  -4.770  -1.886
   40   3HZ   LYS   4          HZ3       LYS   4  17.475  -4.090  -2.992
   41    H    GLY   5           HN       GLY   5  10.720  -4.442  -3.040
   42   1HA   GLY   5          HA2       GLY   5   8.574  -5.606  -3.137
   43   2HA   GLY   5          HA1       GLY   5   9.425  -6.932  -3.897
   44    H    LYS   6           HN       LYS   6  10.775  -5.200  -1.267
   45    HA   LYS   6           HA       LYS   6  11.171  -7.394   0.371
   46   1HB   LYS   6          HB2       LYS   6  12.262  -5.122   0.501
   47   2HB   LYS   6          HB1       LYS   6  10.793  -4.545   1.288
   48   1HG   LYS   6          HG2       LYS   6  11.215  -5.661   3.212
   49   2HG   LYS   6          HG1       LYS   6  12.097  -6.947   2.388
   50   1HD   LYS   6          HD2       LYS   6  13.737  -5.744   3.571
   51   2HD   LYS   6          HD1       LYS   6  13.846  -5.215   1.896
   52   1HE   LYS   6          HE2       LYS   6  12.556  -3.219   2.411
   53   2HE   LYS   6          HE1       LYS   6  12.411  -3.742   4.090
   54   1HZ   LYS   6          HZ1       LYS   6  14.987  -3.778   3.971
   55   2HZ   LYS   6          HZ2       LYS   6  14.176  -2.311   4.196
   56   3HZ   LYS   6          HZ3       LYS   6  14.770  -2.716   2.662
   57    H    TYR   7           HN       TYR   7   8.698  -4.827   0.714
   58    HA   TYR   7           HA       TYR   7   7.038  -6.731   2.149
   59   1HB   TYR   7          HB2       TYR   7   6.592  -3.752   1.927
   60   2HB   TYR   7          HB1       TYR   7   5.914  -4.865   3.112
   61    HD1  TYR   7           HD1      TYR   7   8.659  -6.311   3.522
   62    HD2  TYR   7           HD2      TYR   7   7.414  -2.260   3.567
   63    HE1  TYR   7           HE1      TYR   7  10.463  -5.773   5.085
   64    HE2  TYR   7           HE2      TYR   7   9.174  -1.709   5.114
   65    HH   TYR   7           HH       TYR   7  11.813  -3.630   5.697
   66    HA   PRO   8           HA       PRO   8   4.953  -6.690  -2.075
   67   1HB   PRO   8          HB2       PRO   8   4.118  -9.208  -0.653
   68   2HB   PRO   8          HB1       PRO   8   4.441  -8.954  -2.379
   69   1HG   PRO   8          HG2       PRO   8   6.253 -10.149  -0.907
   70   2HG   PRO   8          HG1       PRO   8   6.763  -8.881  -2.041
   71   1HD   PRO   8          HD2       PRO   8   6.413  -8.733   0.929
   72   2HD   PRO   8          HD1       PRO   8   7.688  -8.036  -0.093
   73    H    ILE   9           HN       ILE   9   3.563  -5.018  -1.503
   74    HA   ILE   9           HA       ILE   9   1.725  -5.387   0.677
   75    HB   ILE   9           HB       ILE   9   2.285  -3.239   0.898
   76   1HG1  ILE   9          HG12      ILE   9   0.313  -2.944  -1.376
   77   2HG1  ILE   9          HG11      ILE   9  -0.067  -3.056   0.341
   78   1HG2  ILE   9          HG21      ILE   9   2.839  -3.076  -2.058
   79   2HG2  ILE   9          HG22      ILE   9   4.019  -3.356  -0.777
   80   3HG2  ILE   9          HG23      ILE   9   3.169  -1.813  -0.874
   81   1HD1  ILE   9          HD11      ILE   9   1.159  -0.958   0.706
   82   2HD1  ILE   9          HD12      ILE   9  -0.217  -0.781  -0.382
   83   3HD1  ILE   9          HD13      ILE   9   1.423  -0.844  -1.038
   84    H    SER  10           HN       SER  10  -0.295  -5.930   0.559
   85    HA   SER  10           HA       SER  10  -1.505  -6.336  -2.081
   86   1HB   SER  10          HB2       SER  10  -2.407  -7.418   0.598
   87   2HB   SER  10          HB1       SER  10  -2.955  -7.935  -1.001
   88    HG   SER  10           HG       SER  10  -0.439  -8.258  -1.178
   89    H    VAL  11           HN       VAL  11  -2.746  -4.710  -2.736
   90    HA   VAL  11           HA       VAL  11  -4.389  -3.261  -0.749
   91    HB   VAL  11           HB       VAL  11  -3.866  -2.004  -3.385
   92   1HG1  VAL  11          HG11      VAL  11  -5.275  -0.888  -1.783
   93   2HG1  VAL  11          HG12      VAL  11  -3.788   0.035  -2.007
   94   3HG1  VAL  11          HG13      VAL  11  -4.001  -0.957  -0.565
   95   1HG2  VAL  11          HG21      VAL  11  -1.750  -2.270  -1.266
   96   2HG2  VAL  11          HG22      VAL  11  -1.734  -1.026  -2.531
   97   3HG2  VAL  11          HG23      VAL  11  -1.661  -2.738  -2.973
   98    H    CYS  12           HN       CYS  12  -6.580  -3.592  -1.012
   99    HA   CYS  12           HA       CYS  12  -7.648  -4.854  -3.312
  100   1HB   CYS  12          HB2       CYS  12  -8.905  -5.041  -1.273
  101   2HB   CYS  12          HB1       CYS  12  -9.027  -3.288  -1.124
  102    H    MET  13           HN       MET  13  -7.809  -3.996  -5.258
  103    HA   MET  13           HA       MET  13  -9.123  -1.371  -5.419
  104   1HB   MET  13          HB2       MET  13  -7.227  -2.609  -7.430
  105   2HB   MET  13          HB1       MET  13  -8.176  -1.159  -7.724
  106   1HG   MET  13          HG2       MET  13  -7.020  -0.117  -5.761
  107   2HG   MET  13          HG1       MET  13  -5.968  -1.530  -5.720
  108   1HE   MET  13          HE1       MET  13  -4.393  -2.233  -7.821
  109   2HE   MET  13          HE2       MET  13  -4.246  -1.259  -9.283
  110   3HE   MET  13          HE3       MET  13  -5.757  -2.096  -8.931
  111    H    GLY  14           HN       GLY  14 -10.162  -4.117  -5.057
  112   1HA   GLY  14          HA2       GLY  14 -11.041  -5.179  -7.543
  113   2HA   GLY  14          HA1       GLY  14 -11.648  -5.626  -5.956
  114    H    THR  15           HN       THR  15 -13.600  -5.697  -7.595
  115    HA   THR  15           HA       THR  15 -14.517  -3.289  -8.724
  116    HB   THR  15           HB       THR  15 -16.639  -4.582  -9.130
  117    HG1  THR  15           HG1      THR  15 -16.260  -6.945  -8.669
  118   1HG2  THR  15          HG21      THR  15 -14.048  -5.938  -9.891
  119   2HG2  THR  15          HG22      THR  15 -14.773  -4.563 -10.727
  120   3HG2  THR  15          HG23      THR  15 -15.596  -6.122 -10.714
  121    H    ALA  16           HN       ALA  16 -15.511  -5.013  -5.795
  122    HA   ALA  16           HA       ALA  16 -17.709  -3.303  -5.233
  123   1HB   ALA  16          HB1       ALA  16 -16.195  -5.111  -3.356
  124   2HB   ALA  16          HB2       ALA  16 -17.544  -5.600  -4.379
  125   3HB   ALA  16          HB3       ALA  16 -17.799  -4.429  -3.087
  126    H    CYS  17           HN       CYS  17 -14.488  -3.578  -3.723
  127    HA   CYS  17           HA       CYS  17 -14.902  -1.389  -1.987
  128   1HB   CYS  17          HB2       CYS  17 -12.374  -2.739  -2.901
  129   2HB   CYS  17          HB1       CYS  17 -12.445  -1.557  -1.623
  130    H    PHE  18           HN       PHE  18 -13.541  -1.616  -5.217
  131    HA   PHE  18           HA       PHE  18 -12.267   0.890  -5.376
  132   1HB   PHE  18          HB2       PHE  18 -12.007  -1.016  -6.975
  133   2HB   PHE  18          HB1       PHE  18 -13.595  -0.638  -7.619
  134    HD1  PHE  18           HD1      PHE  18 -10.098   0.403  -7.420
  135    HD2  PHE  18           HD2      PHE  18 -13.933   1.276  -9.056
  136    HE1  PHE  18           HE1      PHE  18  -9.056   1.924  -9.048
  137    HE2  PHE  18           HE2      PHE  18 -12.894   2.802 -10.678
  138    HZ   PHE  18           HZ       PHE  18 -10.454   3.126 -10.680
  139    H    VAL  19           HN       VAL  19 -15.629  -0.003  -5.686
  140    HA   VAL  19           HA       VAL  19 -16.419   2.263  -7.222
  141    HB   VAL  19           HB       VAL  19 -17.655   0.030  -7.071
  142   1HG1  VAL  19          HG11      VAL  19 -19.452  -0.096  -5.406
  143   2HG1  VAL  19          HG12      VAL  19 -18.802   1.338  -4.611
  144   3HG1  VAL  19          HG13      VAL  19 -17.853  -0.147  -4.665
  145   1HG2  VAL  19          HG21      VAL  19 -19.805   1.077  -7.536
  146   2HG2  VAL  19          HG22      VAL  19 -18.486   1.971  -8.292
  147   3HG2  VAL  19          HG23      VAL  19 -19.235   2.584  -6.819
  148    H    LYS  20           HN       LYS  20 -15.750   1.805  -3.933
  149    HA   LYS  20           HA       LYS  20 -17.538   3.821  -2.888
  150   1HB   LYS  20          HB2       LYS  20 -16.670   1.754  -1.675
  151   2HB   LYS  20          HB1       LYS  20 -15.113   2.555  -1.588
  152   1HG   LYS  20          HG2       LYS  20 -16.225   4.395  -0.314
  153   2HG   LYS  20          HG1       LYS  20 -17.683   3.399  -0.274
  154   1HD   LYS  20          HD2       LYS  20 -14.977   2.692   0.869
  155   2HD   LYS  20          HD1       LYS  20 -16.439   3.084   1.779
  156   1HE   LYS  20          HE2       LYS  20 -17.536   1.094   0.972
  157   2HE   LYS  20          HE1       LYS  20 -16.182   0.737  -0.102
  158   1HZ   LYS  20          HZ1       LYS  20 -16.080   0.757   2.870
  159   2HZ   LYS  20          HZ2       LYS  20 -14.771   0.427   1.844
  160   3HZ   LYS  20          HZ3       LYS  20 -16.099  -0.623   1.886
  161    H    GLY  21           HN       GLY  21 -15.027   4.092  -4.867
  162   1HA   GLY  21          HA2       GLY  21 -14.017   6.052  -5.596
  163   2HA   GLY  21          HA1       GLY  21 -14.561   6.851  -4.123
  164    H    ALA  22           HN       ALA  22 -12.874   3.840  -3.981
  165    HA   ALA  22           HA       ALA  22 -11.020   4.971  -2.135
  166   1HB   ALA  22          HB1       ALA  22 -11.032   2.209  -3.346
  167   2HB   ALA  22          HB2       ALA  22 -11.912   2.687  -1.896
  168   3HB   ALA  22          HB3       ALA  22 -10.149   2.720  -1.907
  169    H    ASP  23           HN       ASP  23 -11.049   4.472  -5.493
  170    HA   ASP  23           HA       ASP  23  -8.386   3.945  -6.079
  171   1HB   ASP  23          HB2       ASP  23 -10.006   3.756  -7.816
  172   2HB   ASP  23          HB1       ASP  23 -10.498   5.440  -7.625
  173    H    LYS  24           HN       LYS  24 -10.021   7.095  -5.643
  174    HA   LYS  24           HA       LYS  24  -7.723   8.575  -6.471
  175   1HB   LYS  24          HB2       LYS  24 -10.018   9.498  -4.728
  176   2HB   LYS  24          HB1       LYS  24  -8.937  10.520  -5.670
  177   1HG   LYS  24          HG2       LYS  24  -9.796   9.568  -7.732
  178   2HG   LYS  24          HG1       LYS  24 -10.841   8.488  -6.814
  179   1HD   LYS  24          HD2       LYS  24 -12.160  10.307  -7.585
  180   2HD   LYS  24          HD1       LYS  24 -11.948  10.500  -5.848
  181   1HE   LYS  24          HE2       LYS  24 -11.693  12.623  -7.078
  182   2HE   LYS  24          HE1       LYS  24 -10.243  12.167  -6.190
  183   1HZ   LYS  24          HZ1       LYS  24  -9.788  12.997  -8.447
  184   2HZ   LYS  24          HZ2       LYS  24 -10.645  11.688  -9.096
  185   3HZ   LYS  24          HZ3       LYS  24  -9.227  11.419  -8.208
  186    H    VAL  25           HN       VAL  25  -8.893   7.437  -3.390
  187    HA   VAL  25           HA       VAL  25  -6.872   8.797  -1.915
  188    HB   VAL  25           HB       VAL  25  -7.841   6.604  -0.412
  189   1HG1  VAL  25          HG11      VAL  25  -8.868   8.417   0.919
  190   2HG1  VAL  25          HG12      VAL  25  -8.478   9.553  -0.373
  191   3HG1  VAL  25          HG13      VAL  25  -7.184   8.738   0.506
  192   1HG2  VAL  25          HG21      VAL  25 -10.025   8.109  -1.856
  193   2HG2  VAL  25          HG22      VAL  25 -10.260   7.037  -0.477
  194   3HG2  VAL  25          HG23      VAL  25  -9.669   6.387  -2.005
  195    H    VAL  26           HN       VAL  26  -7.144   5.506  -3.284
  196    HA   VAL  26           HA       VAL  26  -4.624   4.704  -2.200
  197    HB   VAL  26           HB       VAL  26  -4.564   2.867  -3.677
  198   1HG1  VAL  26          HG11      VAL  26  -6.264   2.646  -1.984
  199   2HG1  VAL  26          HG12      VAL  26  -6.767   1.835  -3.467
  200   3HG1  VAL  26          HG13      VAL  26  -7.452   3.404  -3.045
  201   1HG2  VAL  26          HG21      VAL  26  -6.606   4.280  -5.371
  202   2HG2  VAL  26          HG22      VAL  26  -6.056   2.617  -5.619
  203   3HG2  VAL  26          HG23      VAL  26  -4.918   3.957  -5.779
  204    H    HIS  27           HN       HIS  27  -5.635   6.656  -4.921
  205    HA   HIS  27           HA       HIS  27  -3.265   6.620  -6.401
  206   1HB   HIS  27          HB2       HIS  27  -5.469   7.717  -7.096
  207   2HB   HIS  27          HB1       HIS  27  -4.949   9.096  -6.121
  208    HD1  HIS  27           HD1      HIS  27  -2.505  10.103  -6.860
  209    HD2  HIS  27           HD2      HIS  27  -4.502   7.730  -9.635
  210    HE1  HIS  27           HE1      HIS  27  -1.339  10.490  -9.037
  211    HE2  HIS  27           HE2      HIS  27  -2.398   8.853 -10.637
  212    H    ALA  28           HN       ALA  28  -4.274   8.523  -3.687
  213    HA   ALA  28           HA       ALA  28  -2.087  10.202  -3.359
  214   1HB   ALA  28          HB1       ALA  28  -4.067  10.259  -1.892
  215   2HB   ALA  28          HB2       ALA  28  -2.569  10.191  -0.964
  216   3HB   ALA  28          HB3       ALA  28  -3.555   8.741  -1.150
  217    H    PHE  29           HN       PHE  29  -2.538   6.929  -2.143
  218    HA   PHE  29           HA       PHE  29  -0.055   6.385  -1.045
  219   1HB   PHE  29          HB2       PHE  29  -2.004   4.889  -0.956
  220   2HB   PHE  29          HB1       PHE  29  -1.798   4.524  -2.659
  221    HD1  PHE  29           HD1      PHE  29   0.534   4.821   0.193
  222    HD2  PHE  29           HD2      PHE  29  -0.973   2.419  -2.965
  223    HE1  PHE  29           HE1      PHE  29   2.191   3.115   0.718
  224    HE2  PHE  29           HE2      PHE  29   0.684   0.687  -2.442
  225    HZ   PHE  29           HZ       PHE  29   2.276   1.031  -0.593
  226    H    LYS  30           HN       LYS  30  -1.165   5.851  -4.333
  227    HA   LYS  30           HA       LYS  30   1.048   4.708  -5.478
  228   1HB   LYS  30          HB2       LYS  30  -0.676   6.837  -6.739
  229   2HB   LYS  30          HB1       LYS  30   0.391   5.749  -7.616
  230   1HG   LYS  30          HG2       LYS  30  -1.943   4.856  -5.939
  231   2HG   LYS  30          HG1       LYS  30  -2.000   5.103  -7.685
  232   1HD   LYS  30          HD2       LYS  30  -0.043   3.235  -6.366
  233   2HD   LYS  30          HD1       LYS  30  -1.646   2.720  -6.894
  234   1HE   LYS  30          HE2       LYS  30   0.454   3.960  -8.670
  235   2HE   LYS  30          HE1       LYS  30   0.113   2.235  -8.558
  236   1HZ   LYS  30          HZ1       LYS  30  -1.016   3.126 -10.449
  237   2HZ   LYS  30          HZ2       LYS  30  -1.732   4.353  -9.526
  238   3HZ   LYS  30          HZ3       LYS  30  -2.185   2.739  -9.281
  239    H    GLU  31           HN       GLU  31   0.461   8.109  -5.072
  240    HA   GLU  31           HA       GLU  31   3.052   8.892  -6.054
  241   1HB   GLU  31          HB2       GLU  31   1.008  10.557  -4.577
  242   2HB   GLU  31          HB1       GLU  31   2.328  11.153  -5.573
  243   1HG   GLU  31          HG2       GLU  31   1.307  10.420  -7.555
  244   2HG   GLU  31          HG1       GLU  31   0.133   9.442  -6.676
  245    H    GLN  32           HN       GLN  32   1.631   8.203  -3.016
  246    HA   GLN  32           HA       GLN  32   3.491   9.338  -1.307
  247   1HB   GLN  32          HB2       GLN  32   1.668   6.982  -1.091
  248   2HB   GLN  32          HB1       GLN  32   2.779   7.408   0.195
  249   1HG   GLN  32          HG2       GLN  32   1.648   9.793  -0.230
  250   2HG   GLN  32          HG1       GLN  32   0.320   8.723  -0.682
  251   1HE2  GLN  32          HE21      GLN  32   1.315   6.645   1.139
  252   2HE2  GLN  32          HE22      GLN  32   0.880   7.160   2.733
  253    H    LEU  33           HN       LEU  33   3.620   6.315  -3.173
  254    HA   LEU  33           HA       LEU  33   5.854   5.096  -2.074
  255   1HB   LEU  33          HB2       LEU  33   4.555   4.564  -4.294
  256   2HB   LEU  33          HB1       LEU  33   5.740   5.623  -5.035
  257    HG   LEU  33           HG       LEU  33   6.192   3.004  -3.673
  258   1HD1  LEU  33          HD11      LEU  33   7.167   2.378  -5.832
  259   2HD1  LEU  33          HD12      LEU  33   6.743   3.977  -6.448
  260   3HD1  LEU  33          HD13      LEU  33   5.471   2.855  -5.953
  261   1HD2  LEU  33          HD21      LEU  33   8.365   4.847  -4.663
  262   2HD2  LEU  33          HD22      LEU  33   8.595   3.203  -4.063
  263   3HD2  LEU  33          HD23      LEU  33   8.027   4.468  -2.973
  264    H    LYS  34           HN       LYS  34   5.674   7.496  -4.530
  265    HA   LYS  34           HA       LYS  34   6.812   9.303  -5.155
  266   1HB   LYS  34          HB2       LYS  34   7.744  10.782  -3.466
  267   2HB   LYS  34          HB1       LYS  34   6.188  10.131  -2.985
  268   1HG   LYS  34          HG2       LYS  34   7.293   9.949  -1.016
  269   2HG   LYS  34          HG1       LYS  34   7.712   8.378  -1.712
  270   1HD   LYS  34          HD2       LYS  34   9.851   9.266  -2.461
  271   2HD   LYS  34          HD1       LYS  34   9.426  10.864  -1.841
  272   1HE   LYS  34          HE2       LYS  34   9.187   9.797   0.427
  273   2HE   LYS  34          HE1       LYS  34   9.896   8.340  -0.269
  274   1HZ   LYS  34          HZ1       LYS  34  11.564   9.690   0.832
  275   2HZ   LYS  34          HZ2       LYS  34  11.182  11.014  -0.156
  276   3HZ   LYS  34          HZ3       LYS  34  11.871   9.622  -0.838
  277    H    ILE  35           HN       ILE  35   8.537   6.852  -3.722
  278    HA   ILE  35           HA       ILE  35  10.341   5.717  -4.299
  279    HB   ILE  35           HB       ILE  35  10.636   6.678  -7.004
  280   1HG1  ILE  35          HG12      ILE  35   7.992   5.470  -6.331
  281   2HG1  ILE  35          HG11      ILE  35   8.166   7.217  -6.477
  282   1HG2  ILE  35          HG21      ILE  35  11.424   4.545  -6.249
  283   2HG2  ILE  35          HG22      ILE  35  10.137   4.287  -7.429
  284   3HG2  ILE  35          HG23      ILE  35   9.802   4.110  -5.701
  285   1HD1  ILE  35          HD11      ILE  35   7.301   6.221  -8.521
  286   2HD1  ILE  35          HD12      ILE  35   8.724   5.183  -8.624
  287   3HD1  ILE  35          HD13      ILE  35   8.894   6.931  -8.787
  288    H    ASP  36           HN       ASP  36  12.281   6.125  -6.142
  289    HA   ASP  36           HA       ASP  36  13.769   8.507  -5.533
  290   1HB   ASP  36          HB2       ASP  36  14.147   7.045  -3.564
  291   2HB   ASP  36          HB1       ASP  36  14.745   5.765  -4.612
  292    H    ILE  37           HN       ILE  37  14.078   5.181  -6.436
  293    HA   ILE  37           HA       ILE  37  14.625   5.618  -9.218
  294    HB   ILE  37           HB       ILE  37  16.772   4.359  -9.119
  295   1HG1  ILE  37          HG12      ILE  37  16.285   4.864  -6.238
  296   2HG1  ILE  37          HG11      ILE  37  16.646   3.339  -7.040
  297   1HG2  ILE  37          HG21      ILE  37  16.879   6.736  -9.558
  298   2HG2  ILE  37          HG22      ILE  37  18.222   6.258  -8.519
  299   3HG2  ILE  37          HG23      ILE  37  16.821   7.077  -7.829
  300   1HD1  ILE  37          HD11      ILE  37  18.952   4.086  -7.429
  301   2HD1  ILE  37          HD12      ILE  37  18.543   4.045  -5.715
  302   3HD1  ILE  37          HD13      ILE  37  18.601   5.587  -6.571
  303    H    GLY  38           HN       GLY  38  13.047   4.098  -7.063
  304   1HA   GLY  38          HA2       GLY  38  12.968   1.466  -7.995
  305   2HA   GLY  38          HA1       GLY  38  14.140   1.554  -6.665
  306    H    ASP  39           HN       ASP  39  13.223   3.263  -4.972
  307    HA   ASP  39           HA       ASP  39  10.441   3.155  -4.407
  308   1HB   ASP  39          HB2       ASP  39  11.844   0.884  -3.771
  309   2HB   ASP  39          HB1       ASP  39  11.782   1.814  -2.281
  310    H    VAL  40           HN       VAL  40   9.893   4.543  -3.193
  311    HA   VAL  40           HA       VAL  40   9.981   6.378  -1.751
  312    HB   VAL  40           HB       VAL  40   8.757   4.843  -0.597
  313   1HG1  VAL  40          HG11      VAL  40   9.384   2.788   0.340
  314   2HG1  VAL  40          HG12      VAL  40  11.099   3.147   0.134
  315   3HG1  VAL  40          HG13      VAL  40  10.086   2.851  -1.282
  316   1HG2  VAL  40          HG21      VAL  40   9.806   6.402   0.974
  317   2HG2  VAL  40          HG22      VAL  40  11.069   5.189   1.234
  318   3HG2  VAL  40          HG23      VAL  40   9.403   4.845   1.707
  319    H    THR  41           HN       THR  41  12.277   4.203  -0.540
  320    HA   THR  41           HA       THR  41  14.263   6.306  -0.012
  321    HB   THR  41           HB       THR  41  13.631   4.135   1.978
  322    HG1  THR  41           HG1      THR  41  12.787   5.971   3.272
  323   1HG2  THR  41          HG21      THR  41  15.914   4.977   2.041
  324   2HG2  THR  41          HG22      THR  41  15.043   5.477   3.489
  325   3HG2  THR  41          HG23      THR  41  15.319   6.630   2.184
  326    HA   PRO  42           HA       PRO  42  15.162   3.618  -3.106
  327   1HB   PRO  42          HB2       PRO  42  17.995   3.557  -2.833
  328   2HB   PRO  42          HB1       PRO  42  17.025   4.515  -3.951
  329   1HG   PRO  42          HG2       PRO  42  18.148   5.268  -1.308
  330   2HG   PRO  42          HG1       PRO  42  17.838   6.279  -2.732
  331   1HD   PRO  42          HD2       PRO  42  16.241   6.422  -0.605
  332   2HD   PRO  42          HD1       PRO  42  15.554   6.461  -2.247
  333    H    ASP  43           HN       ASP  43  14.197   1.906  -2.264
  334    HA   ASP  43           HA       ASP  43  16.101  -0.188  -1.349
  335   1HB   ASP  43          HB2       ASP  43  15.170   0.856   0.696
  336   2HB   ASP  43          HB1       ASP  43  13.546   0.487   0.132
  337    H    GLY  44           HN       GLY  44  12.622   0.342  -1.747
  338   1HA   GLY  44          HA2       GLY  44  11.373  -0.987  -3.388
  339   2HA   GLY  44          HA1       GLY  44  12.542  -2.285  -3.125
  340    H    ARG  45           HN       ARG  45  11.142  -0.233  -0.726
  341    HA   ARG  45           HA       ARG  45  10.363  -2.223   1.062
  342   1HB   ARG  45          HB2       ARG  45   9.743   0.685   0.623
  343   2HB   ARG  45          HB1       ARG  45   8.967  -0.219   1.912
  344   1HG   ARG  45          HG2       ARG  45  11.147  -0.735   2.885
  345   2HG   ARG  45          HG1       ARG  45  11.936   0.136   1.569
  346   1HD   ARG  45          HD2       ARG  45  10.808   2.193   2.266
  347   2HD   ARG  45          HD1       ARG  45  10.036   1.318   3.587
  348    HE   ARG  45           HE       ARG  45  12.946   1.252   3.539
  349   1HH1  ARG  45          HH11      ARG  45  10.020   2.683   4.846
  350   2HH1  ARG  45          HH12      ARG  45  10.844   3.440   6.179
  351   1HH2  ARG  45          HH21      ARG  45  14.016   2.234   5.307
  352   2HH2  ARG  45          HH22      ARG  45  13.115   3.182   6.453
  353    H    PHE  46           HN       PHE  46   8.671  -0.357  -1.388
  354    HA   PHE  46           HA       PHE  46   6.145  -1.606  -0.893
  355   1HB   PHE  46          HB2       PHE  46   7.145   0.228  -3.089
  356   2HB   PHE  46          HB1       PHE  46   5.489  -0.268  -2.888
  357    HD1  PHE  46           HD1      PHE  46   8.050   2.054  -1.930
  358    HD2  PHE  46           HD2      PHE  46   4.189   0.612  -0.929
  359    HE1  PHE  46           HE1      PHE  46   7.602   4.148  -0.696
  360    HE2  PHE  46           HE2      PHE  46   3.756   2.649   0.362
  361    HZ   PHE  46           HZ       PHE  46   5.453   4.422   0.478
  362    H    SER  47           HN       SER  47   5.364  -3.360  -1.933
  363    HA   SER  47           HA       SER  47   6.109  -3.760  -4.723
  364   1HB   SER  47          HB2       SER  47   7.455  -5.372  -3.322
  365   2HB   SER  47          HB1       SER  47   5.934  -6.066  -2.762
  366    HG   SER  47           HG       SER  47   7.158  -6.210  -5.277
  367    H    ILE  48           HN       ILE  48   4.030  -2.532  -4.614
  368    HA   ILE  48           HA       ILE  48   1.774  -3.700  -3.339
  369    HB   ILE  48           HB       ILE  48   0.482  -1.863  -4.075
  370   1HG1  ILE  48          HG12      ILE  48   1.040  -1.940  -6.480
  371   2HG1  ILE  48          HG11      ILE  48   1.134  -0.302  -5.837
  372   1HG2  ILE  48          HG21      ILE  48   2.091  -1.201  -2.434
  373   2HG2  ILE  48          HG22      ILE  48   1.912   0.110  -3.603
  374   3HG2  ILE  48          HG23      ILE  48   3.321  -0.949  -3.673
  375   1HD1  ILE  48          HD11      ILE  48   3.553  -0.509  -5.689
  376   2HD1  ILE  48          HD12      ILE  48   2.977  -0.763  -7.338
  377   3HD1  ILE  48          HD13      ILE  48   3.446  -2.146  -6.340
  378    H    ASP  49           HN       ASP  49   0.492  -5.215  -4.040
  379    HA   ASP  49           HA       ASP  49  -0.608  -4.864  -6.685
  380   1HB   ASP  49          HB2       ASP  49  -0.337  -7.090  -7.488
  381   2HB   ASP  49          HB1       ASP  49   1.255  -6.543  -6.985
  382    H    THR  50           HN       THR  50  -2.637  -5.194  -6.730
  383    HA   THR  50           HA       THR  50  -4.466  -5.667  -4.842
  384    HB   THR  50           HB       THR  50  -5.811  -6.750  -6.815
  385    HG1  THR  50           HG1      THR  50  -4.584  -7.084  -8.498
  386   1HG2  THR  50          HG21      THR  50  -4.762  -3.920  -6.911
  387   2HG2  THR  50          HG22      THR  50  -6.137  -4.484  -5.961
  388   3HG2  THR  50          HG23      THR  50  -6.212  -4.513  -7.721
  389    H    LEU  51           HN       LEU  51  -2.628  -8.317  -6.396
  390    HA   LEU  51           HA       LEU  51  -4.821  -9.969  -6.748
  391   1HB   LEU  51          HB2       LEU  51  -2.673 -10.186  -7.894
  392   2HB   LEU  51          HB1       LEU  51  -1.946 -10.781  -6.415
  393    HG   LEU  51           HG       LEU  51  -3.472 -12.743  -6.495
  394   1HD1  LEU  51          HD11      LEU  51  -4.213 -11.655  -9.206
  395   2HD1  LEU  51          HD12      LEU  51  -5.272 -11.713  -7.796
  396   3HD1  LEU  51          HD13      LEU  51  -4.703 -13.211  -8.536
  397   1HD2  LEU  51          HD21      LEU  51  -1.219 -12.928  -7.373
  398   2HD2  LEU  51          HD22      LEU  51  -1.748 -12.286  -8.929
  399   3HD2  LEU  51          HD23      LEU  51  -2.335 -13.855  -8.378
  400    H    ARG  52           HN       ARG  52  -2.568 -10.062  -3.959
  401    HA   ARG  52           HA       ARG  52  -3.758 -12.348  -2.791
  402   1HB   ARG  52          HB2       ARG  52  -1.528 -11.421  -2.161
  403   2HB   ARG  52          HB1       ARG  52  -2.351 -10.103  -1.334
  404   1HG   ARG  52          HG2       ARG  52  -2.745 -11.352   0.462
  405   2HG   ARG  52          HG1       ARG  52  -3.338 -12.701  -0.508
  406   1HD   ARG  52          HD2       ARG  52  -1.417 -13.451   0.693
  407   2HD   ARG  52          HD1       ARG  52  -0.969 -13.293  -1.004
  408    HE   ARG  52           HE       ARG  52  -0.376 -10.988   0.636
  409   1HH1  ARG  52          HH11      ARG  52   0.815 -13.994  -0.740
  410   2HH1  ARG  52          HH12      ARG  52   2.489 -13.597  -0.457
  411   1HH2  ARG  52          HH21      ARG  52   1.815 -10.496   1.042
  412   2HH2  ARG  52          HH22      ARG  52   3.056 -11.630   0.599
  413    H    CYS  53           HN       CYS  53  -4.107  -8.972  -1.982
  414    HA   CYS  53           HA       CYS  53  -6.330  -9.209  -0.269
  415   1HB   CYS  53          HB2       CYS  53  -4.699  -7.340  -0.185
  416   2HB   CYS  53          HB1       CYS  53  -5.377  -6.725  -1.690
  417    H    VAL  54           HN       VAL  54  -8.350  -7.646  -0.852
  418    HA   VAL  54           HA       VAL  54 -10.398  -7.763  -1.828
  419    HB   VAL  54           HB       VAL  54  -9.195  -8.957  -4.335
  420   1HG1  VAL  54          HG11      VAL  54 -11.639  -8.963  -4.156
  421   2HG1  VAL  54          HG12      VAL  54 -11.082  -7.894  -5.444
  422   3HG1  VAL  54          HG13      VAL  54 -11.622  -7.217  -3.909
  423   1HG2  VAL  54          HG21      VAL  54  -9.434  -6.013  -3.708
  424   2HG2  VAL  54          HG22      VAL  54  -8.906  -6.720  -5.236
  425   3HG2  VAL  54          HG23      VAL  54  -7.924  -6.923  -3.786
  426    H    GLY  55           HN       GLY  55  -9.076  -9.825  -0.354
  427   1HA   GLY  55          HA2       GLY  55 -10.560 -12.183  -1.292
  428   2HA   GLY  55          HA1       GLY  55  -9.085 -12.263  -0.345
  429    H    GLY  56           HN       GLY  56 -12.336 -10.657  -0.011
  430   1HA   GLY  56          HA2       GLY  56 -13.890 -10.946   1.669
  431   2HA   GLY  56          HA1       GLY  56 -13.095 -12.464   2.022
  432    H    CYS  57           HN       CYS  57 -12.506  -8.916   2.599
  433    HA   CYS  57           HA       CYS  57 -11.153  -9.748   5.124
  434   1HB   CYS  57          HB2       CYS  57 -10.209  -7.393   3.607
  435   2HB   CYS  57          HB1       CYS  57  -9.313  -8.471   4.629
  436    H    ALA  58           HN       ALA  58 -12.922  -7.395   3.248
  437    HA   ALA  58           HA       ALA  58 -12.190  -5.019   4.339
  438   1HB   ALA  58          HB1       ALA  58 -13.520  -5.347   2.308
  439   2HB   ALA  58          HB2       ALA  58 -14.144  -4.075   3.357
  440   3HB   ALA  58          HB3       ALA  58 -14.936  -5.649   3.316
  441    H    LEU  59           HN       LEU  59 -14.502  -7.227   5.952
  442    HA   LEU  59           HA       LEU  59 -15.576  -5.083   7.547
  443   1HB   LEU  59          HB2       LEU  59 -16.689  -7.310   7.116
  444   2HB   LEU  59          HB1       LEU  59 -15.548  -8.019   8.241
  445    HG   LEU  59           HG       LEU  59 -16.436  -6.532  10.023
  446   1HD1  LEU  59          HD11      LEU  59 -18.505  -5.824   7.949
  447   2HD1  LEU  59          HD12      LEU  59 -17.276  -4.739   8.598
  448   3HD1  LEU  59          HD13      LEU  59 -18.544  -5.366   9.652
  449   1HD2  LEU  59          HD21      LEU  59 -18.530  -7.741  10.340
  450   2HD2  LEU  59          HD22      LEU  59 -17.251  -8.820   9.783
  451   3HD2  LEU  59          HD23      LEU  59 -18.490  -8.267   8.657
  452    H    ALA  60           HN       ALA  60 -12.532  -6.509   7.576
  453    HA   ALA  60           HA       ALA  60 -12.053  -4.904  10.002
  454   1HB   ALA  60          HB1       ALA  60 -10.274  -7.052   8.820
  455   2HB   ALA  60          HB2       ALA  60 -11.248  -7.219  10.281
  456   3HB   ALA  60          HB3       ALA  60  -9.910  -6.072  10.241
  457    HA   PRO  61           HA       PRO  61  -9.732  -2.525   6.893
  458   1HB   PRO  61          HB2       PRO  61  -7.826  -1.585   8.881
  459   2HB   PRO  61          HB1       PRO  61  -9.045  -0.660   8.003
  460   1HG   PRO  61          HG2       PRO  61  -9.179  -1.157  10.686
  461   2HG   PRO  61          HG1       PRO  61 -10.605  -0.893   9.667
  462   1HD   PRO  61          HD2       PRO  61  -9.454  -3.457  10.697
  463   2HD   PRO  61          HD1       PRO  61 -11.156  -2.976  10.512
  464    H    ILE  62           HN       ILE  62  -8.486  -3.819   5.629
  465    HA   ILE  62           HA       ILE  62  -6.098  -5.029   6.840
  466    HB   ILE  62           HB       ILE  62  -7.790  -5.882   4.515
  467   1HG1  ILE  62          HG12      ILE  62  -7.378  -8.135   5.578
  468   2HG1  ILE  62          HG11      ILE  62  -6.546  -7.294   6.878
  469   1HG2  ILE  62          HG21      ILE  62  -5.565  -5.737   3.559
  470   2HG2  ILE  62          HG22      ILE  62  -6.043  -7.424   3.757
  471   3HG2  ILE  62          HG23      ILE  62  -4.909  -6.689   4.892
  472   1HD1  ILE  62          HD11      ILE  62  -9.429  -6.930   6.110
  473   2HD1  ILE  62          HD12      ILE  62  -8.595  -6.107   7.428
  474   3HD1  ILE  62          HD13      ILE  62  -8.825  -7.854   7.484
  475    H    VAL  63           HN       VAL  63  -4.139  -4.072   6.344
  476    HA   VAL  63           HA       VAL  63  -3.832  -3.503   3.485
  477    HB   VAL  63           HB       VAL  63  -2.321  -1.937   5.557
  478   1HG1  VAL  63          HG11      VAL  63  -1.914  -0.427   3.667
  479   2HG1  VAL  63          HG12      VAL  63  -2.836  -1.509   2.620
  480   3HG1  VAL  63          HG13      VAL  63  -1.331  -2.062   3.356
  481   1HG2  VAL  63          HG21      VAL  63  -3.849  -0.060   5.164
  482   2HG2  VAL  63          HG22      VAL  63  -4.667  -1.434   5.909
  483   3HG2  VAL  63          HG23      VAL  63  -4.875  -1.112   4.189
  484    H    MET  64           HN       MET  64  -2.165  -4.772   2.664
  485    HA   MET  64           HA       MET  64  -0.380  -5.816   4.770
  486   1HB   MET  64          HB2       MET  64  -1.752  -7.560   3.663
  487   2HB   MET  64          HB1       MET  64  -1.026  -7.109   2.122
  488   1HG   MET  64          HG2       MET  64   1.199  -7.596   3.135
  489   2HG   MET  64          HG1       MET  64   0.349  -8.258   4.528
  490   1HE   MET  64          HE1       MET  64  -2.167  -9.655   3.233
  491   2HE   MET  64          HE2       MET  64  -1.159 -10.331   4.512
  492   3HE   MET  64          HE3       MET  64  -1.544 -11.298   3.087
  493    H    VAL  65           HN       VAL  65   1.692  -5.291   4.638
  494    HA   VAL  65           HA       VAL  65   2.820  -5.015   1.920
  495    HB   VAL  65           HB       VAL  65   4.795  -4.056   3.543
  496   1HG1  VAL  65          HG11      VAL  65   4.132  -3.013   1.470
  497   2HG1  VAL  65          HG12      VAL  65   4.210  -1.805   2.755
  498   3HG1  VAL  65          HG13      VAL  65   2.647  -2.421   2.217
  499   1HG2  VAL  65          HG21      VAL  65   2.178  -3.174   4.695
  500   2HG2  VAL  65          HG22      VAL  65   3.713  -2.355   4.996
  501   3HG2  VAL  65          HG23      VAL  65   3.486  -4.029   5.512
  502    H    GLY  66           HN       GLY  66   3.803  -6.926   1.526
  503   1HA   GLY  66          HA2       GLY  66   4.829  -8.938   1.885
  504   2HA   GLY  66          HA1       GLY  66   5.934  -7.949   2.855
  505    H    GLU  67           HN       GLU  67   6.296  -9.492   4.227
  506    HA   GLU  67           HA       GLU  67   4.283 -10.712   5.883
  507   1HB   GLU  67          HB2       GLU  67   7.244 -10.507   6.452
  508   2HB   GLU  67          HB1       GLU  67   6.119 -11.724   7.038
  509   1HG   GLU  67          HG2       GLU  67   6.844 -11.381   4.142
  510   2HG   GLU  67          HG1       GLU  67   7.677 -12.479   5.240
  511    H    LYS  68           HN       LYS  68   4.377  -7.759   5.705
  512    HA   LYS  68           HA       LYS  68   5.243  -7.022   8.411
  513   1HB   LYS  68          HB2       LYS  68   4.675  -5.091   6.166
  514   2HB   LYS  68          HB1       LYS  68   5.511  -4.762   7.669
  515   1HG   LYS  68          HG2       LYS  68   6.631  -6.515   5.455
  516   2HG   LYS  68          HG1       LYS  68   6.955  -4.799   5.633
  517   1HD   LYS  68          HD2       LYS  68   8.794  -5.876   6.625
  518   2HD   LYS  68          HD1       LYS  68   7.807  -5.309   7.968
  519   1HE   LYS  68          HE2       LYS  68   6.951  -7.510   8.351
  520   2HE   LYS  68          HE1       LYS  68   7.713  -8.115   6.881
  521   1HZ   LYS  68          HZ1       LYS  68   9.211  -7.035   9.204
  522   2HZ   LYS  68          HZ2       LYS  68   9.857  -7.810   7.840
  523   3HZ   LYS  68          HZ3       LYS  68   8.912  -8.681   8.945
  524    H    VAL  69           HN       VAL  69   2.696  -6.846   6.045
  525    HA   VAL  69           HA       VAL  69   0.542  -6.048   6.092
  526    HB   VAL  69           HB       VAL  69   0.603  -7.433   8.766
  527   1HG1  VAL  69          HG11      VAL  69  -1.750  -6.742   7.005
  528   2HG1  VAL  69          HG12      VAL  69  -1.369  -6.008   8.563
  529   3HG1  VAL  69          HG13      VAL  69  -1.811  -7.713   8.477
  530   1HG2  VAL  69          HG21      VAL  69  -0.276  -9.355   7.504
  531   2HG2  VAL  69          HG22      VAL  69   1.330  -8.876   6.956
  532   3HG2  VAL  69          HG23      VAL  69  -0.092  -8.437   6.007
  533    H    TYR  70           HN       TYR  70   0.358  -3.861   6.114
  534    HA   TYR  70           HA       TYR  70   0.493  -2.472   8.702
  535   1HB   TYR  70          HB2       TYR  70   1.379  -1.574   5.950
  536   2HB   TYR  70          HB1       TYR  70   1.048  -0.428   7.253
  537    HD1  TYR  70           HD1      TYR  70   2.291  -3.516   8.514
  538    HD2  TYR  70           HD2      TYR  70   3.502   0.163   6.785
  539    HE1  TYR  70           HE1      TYR  70   4.540  -3.856   9.387
  540    HE2  TYR  70           HE2      TYR  70   5.737  -0.164   7.640
  541    HH   TYR  70           HH       TYR  70   6.914  -1.344   9.360
  542    H    GLY  71           HN       GLY  71  -0.282   0.021   7.513
  543   1HA   GLY  71          HA2       GLY  71  -3.122  -0.419   6.910
  544   2HA   GLY  71          HA1       GLY  71  -2.641   0.678   8.193
  545    H    ASN  72           HN       ASN  72  -0.552   0.624   5.436
  546    HA   ASN  72           HA       ASN  72  -1.497   3.305   4.744
  547   1HB   ASN  72          HB2       ASN  72   1.012   2.878   5.013
  548   2HB   ASN  72          HB1       ASN  72   0.942   1.880   3.568
  549   1HD2  ASN  72          HD21      ASN  72  -1.181   3.722   2.432
  550   2HD2  ASN  72          HD22      ASN  72  -0.303   5.094   1.873
  551    H    VAL  73           HN       VAL  73  -3.261   3.188   3.568
  552    HA   VAL  73           HA       VAL  73  -3.330   1.419   1.211
  553    HB   VAL  73           HB       VAL  73  -5.948   1.873   1.842
  554   1HG1  VAL  73          HG11      VAL  73  -6.007  -0.485   2.495
  555   2HG1  VAL  73          HG12      VAL  73  -4.246  -0.490   2.586
  556   3HG1  VAL  73          HG13      VAL  73  -5.047  -0.219   1.039
  557   1HG2  VAL  73          HG21      VAL  73  -4.445   1.342   4.399
  558   2HG2  VAL  73          HG22      VAL  73  -6.201   1.303   4.208
  559   3HG2  VAL  73          HG23      VAL  73  -5.316   2.817   3.990
  560    H    THR  74           HN       THR  74  -5.791   3.505   2.324
  561    HA   THR  74           HA       THR  74  -5.508   5.242   0.020
  562    HB   THR  74           HB       THR  74  -7.106   4.194  -1.124
  563    HG1  THR  74           HG1      THR  74  -9.287   4.343  -0.351
  564   1HG2  THR  74          HG21      THR  74  -8.329   2.239  -0.297
  565   2HG2  THR  74          HG22      THR  74  -7.750   2.566   1.336
  566   3HG2  THR  74          HG23      THR  74  -6.607   2.125   0.067
  567    HA   PRO  75           HA       PRO  75  -8.859   7.372   2.494
  568   1HB   PRO  75          HB2       PRO  75  -9.608   6.020   4.927
  569   2HB   PRO  75          HB1       PRO  75 -10.571   6.281   3.473
  570   1HG   PRO  75          HG2       PRO  75  -9.689   3.829   4.304
  571   2HG   PRO  75          HG1       PRO  75 -10.046   4.227   2.613
  572   1HD   PRO  75          HD2       PRO  75  -7.406   4.117   4.024
  573   2HD   PRO  75          HD1       PRO  75  -7.836   3.552   2.396
  574    H    GLY  76           HN       GLY  76  -6.544   8.325   2.928
  575   1HA   GLY  76          HA2       GLY  76  -5.687  10.030   4.245
  576   2HA   GLY  76          HA1       GLY  76  -6.841   9.605   5.495
  577    H    GLN  77           HN       GLN  77  -5.652   6.732   5.034
  578    HA   GLN  77           HA       GLN  77  -4.185   6.941   7.515
  579   1HB   GLN  77          HB2       GLN  77  -4.260   4.420   5.877
  580   2HB   GLN  77          HB1       GLN  77  -4.273   4.604   7.625
  581   1HG   GLN  77          HG2       GLN  77  -6.632   5.644   7.201
  582   2HG   GLN  77          HG1       GLN  77  -6.514   4.757   5.678
  583   1HE2  GLN  77          HE21      GLN  77  -6.451   2.520   5.708
  584   2HE2  GLN  77          HE22      GLN  77  -6.954   1.607   7.085
  585    H    VAL  78           HN       VAL  78  -3.746   6.955   4.255
  586    HA   VAL  78           HA       VAL  78  -1.447   5.675   3.657
  587    HB   VAL  78           HB       VAL  78  -1.342   7.402   1.847
  588   1HG1  VAL  78          HG11      VAL  78  -3.550   6.776   0.823
  589   2HG1  VAL  78          HG12      VAL  78  -3.881   5.927   2.341
  590   3HG1  VAL  78          HG13      VAL  78  -2.517   5.436   1.336
  591   1HG2  VAL  78          HG21      VAL  78  -2.183   9.316   2.829
  592   2HG2  VAL  78          HG22      VAL  78  -3.640   8.482   3.363
  593   3HG2  VAL  78          HG23      VAL  78  -3.393   8.825   1.641
  594    H    LYS  79           HN       LYS  79  -1.820   9.097   4.626
  595    HA   LYS  79           HA       LYS  79   0.826   9.726   3.936
  596   1HB   LYS  79          HB2       LYS  79   0.316  11.805   5.445
  597   2HB   LYS  79          HB1       LYS  79  -0.527  11.589   3.918
  598   1HG   LYS  79          HG2       LYS  79  -2.428  10.581   5.189
  599   2HG   LYS  79          HG1       LYS  79  -1.580  11.001   6.679
  600   1HD   LYS  79          HD2       LYS  79  -1.762  13.318   6.228
  601   2HD   LYS  79          HD1       LYS  79  -2.273  13.027   4.562
  602   1HE   LYS  79          HE2       LYS  79  -4.324  11.951   5.412
  603   2HE   LYS  79          HE1       LYS  79  -3.821  12.335   7.057
  604   1HZ   LYS  79          HZ1       LYS  79  -3.979  14.655   6.578
  605   2HZ   LYS  79          HZ2       LYS  79  -5.434  13.920   6.112
  606   3HZ   LYS  79          HZ3       LYS  79  -4.293  14.359   4.935
  607    H    LYS  80           HN       LYS  80  -0.663   8.706   6.875
  608    HA   LYS  80           HA       LYS  80   1.632   9.390   8.506
  609   1HB   LYS  80          HB2       LYS  80  -0.528   7.694   9.592
  610   2HB   LYS  80          HB1       LYS  80   0.157   9.180  10.219
  611   1HG   LYS  80          HG2       LYS  80  -1.605  10.283   9.548
  612   2HG   LYS  80          HG1       LYS  80  -1.255   9.868   7.881
  613   1HD   LYS  80          HD2       LYS  80  -3.301   8.931   7.983
  614   2HD   LYS  80          HD1       LYS  80  -2.412   7.588   8.704
  615   1HE   LYS  80          HE2       LYS  80  -3.623   9.808  10.336
  616   2HE   LYS  80          HE1       LYS  80  -4.506   8.343   9.920
  617   1HZ   LYS  80          HZ1       LYS  80  -1.913   8.329  11.376
  618   2HZ   LYS  80          HZ2       LYS  80  -2.985   7.033  11.148
  619   3HZ   LYS  80          HZ3       LYS  80  -3.426   8.332  12.143
  620    H    ILE  81           HN       ILE  81  -0.089   6.609   7.364
  621    HA   ILE  81           HA       ILE  81   1.725   4.755   8.548
  622    HB   ILE  81           HB       ILE  81  -0.149   4.257   6.230
  623   1HG1  ILE  81          HG12      ILE  81  -1.383   5.151   8.146
  624   2HG1  ILE  81          HG11      ILE  81  -1.724   3.436   7.957
  625   1HG2  ILE  81          HG21      ILE  81   1.619   2.543   6.637
  626   2HG2  ILE  81          HG22      ILE  81   0.006   1.918   6.972
  627   3HG2  ILE  81          HG23      ILE  81   1.063   2.386   8.304
  628   1HD1  ILE  81          HD11      ILE  81  -0.157   2.942   9.768
  629   2HD1  ILE  81          HD12      ILE  81  -1.465   4.006  10.286
  630   3HD1  ILE  81          HD13      ILE  81   0.138   4.669   9.969
  631    H    LEU  82           HN       LEU  82   1.861   6.763   5.774
  632    HA   LEU  82           HA       LEU  82   3.701   5.268   4.242
  633   1HB   LEU  82          HB2       LEU  82   2.654   7.224   3.285
  634   2HB   LEU  82          HB1       LEU  82   3.344   8.259   4.523
  635    HG   LEU  82           HG       LEU  82   5.608   7.685   3.654
  636   1HD1  LEU  82          HD11      LEU  82   5.068   5.589   2.553
  637   2HD1  LEU  82          HD12      LEU  82   5.776   6.728   1.407
  638   3HD1  LEU  82          HD13      LEU  82   4.036   6.440   1.403
  639   1HD2  LEU  82          HD21      LEU  82   5.452   9.144   1.687
  640   2HD2  LEU  82          HD22      LEU  82   4.532   9.779   3.051
  641   3HD2  LEU  82          HD23      LEU  82   3.697   8.985   1.716
  642    H    ALA  83           HN       ALA  83   4.116   7.489   6.987
  643    HA   ALA  83           HA       ALA  83   6.917   7.413   7.073
  644   1HB   ALA  83          HB1       ALA  83   6.704   7.868   9.470
  645   2HB   ALA  83          HB2       ALA  83   4.992   7.451   9.400
  646   3HB   ALA  83          HB3       ALA  83   5.593   8.863   8.532
  647    H    GLU  84           HN       GLU  84   4.487   5.098   7.908
  648    HA   GLU  84           HA       GLU  84   6.224   3.201   9.119
  649   1HB   GLU  84          HB2       GLU  84   3.405   3.383   8.420
  650   2HB   GLU  84          HB1       GLU  84   4.070   1.766   8.249
  651   1HG   GLU  84          HG2       GLU  84   4.853   1.834  10.556
  652   2HG   GLU  84          HG1       GLU  84   4.231   3.478  10.721
  653    H    TYR  85           HN       TYR  85   5.182   3.764   5.752
  654    HA   TYR  85           HA       TYR  85   6.083   1.230   4.918
  655   1HB   TYR  85          HB2       TYR  85   4.884   3.594   3.633
  656   2HB   TYR  85          HB1       TYR  85   5.702   2.417   2.640
  657    HD1  TYR  85           HD1      TYR  85   4.527   0.999   5.509
  658    HD2  TYR  85           HD2      TYR  85   3.380   2.200   1.744
  659    HE1  TYR  85           HE1      TYR  85   2.806  -0.655   5.579
  660    HE2  TYR  85           HE2      TYR  85   1.570   0.569   1.813
  661    HH   TYR  85           HH       TYR  85   0.894  -1.438   2.847
  Start of MODEL    2
    1   1H    MET   1          HT1       MET   1   8.581  -5.309 -11.508
    2   2H    MET   1          HT2       MET   1   8.803  -3.802 -12.256
    3   3H    MET   1          HT3       MET   1   9.474  -4.094 -10.727
    4    HA   MET   1           HA       MET   1  10.217  -5.521 -13.210
    5   1HB   MET   1          HB2       MET   1  11.577  -3.282 -11.709
    6   2HB   MET   1          HB1       MET   1  12.422  -4.317 -12.854
    7   1HG   MET   1          HG2       MET   1  10.045  -2.588 -13.494
    8   2HG   MET   1          HG1       MET   1  11.726  -2.198 -13.851
    9   1HE   MET   1          HE1       MET   1  12.653  -5.028 -16.428
   10   2HE   MET   1          HE2       MET   1  12.839  -5.099 -14.676
   11   3HE   MET   1          HE3       MET   1  13.239  -3.617 -15.544
   12    H    VAL   2           HN       VAL   2  11.478  -4.649  -9.987
   13    HA   VAL   2           HA       VAL   2  12.253  -7.473  -9.645
   14    HB   VAL   2           HB       VAL   2  13.834  -5.080  -8.671
   15   1HG1  VAL   2          HG11      VAL   2  14.025  -6.991  -7.186
   16   2HG1  VAL   2          HG12      VAL   2  15.535  -6.743  -8.063
   17   3HG1  VAL   2          HG13      VAL   2  14.434  -8.034  -8.548
   18   1HG2  VAL   2          HG21      VAL   2  14.448  -7.006 -10.909
   19   2HG2  VAL   2          HG22      VAL   2  15.525  -5.746 -10.310
   20   3HG2  VAL   2          HG23      VAL   2  14.004  -5.309 -11.090
   21    HA   PRO   3           HA       PRO   3   9.553  -6.628  -6.076
   22   1HB   PRO   3          HB2       PRO   3   9.173  -9.273  -5.520
   23   2HB   PRO   3          HB1       PRO   3   8.204  -8.380  -6.696
   24   1HG   PRO   3          HG2       PRO   3  10.525 -10.213  -7.153
   25   2HG   PRO   3          HG1       PRO   3   9.012 -10.070  -8.068
   26   1HD   PRO   3          HD2       PRO   3  11.330  -8.970  -8.923
   27   2HD   PRO   3          HD1       PRO   3   9.752  -8.229  -9.246
   28    H    LYS   4           HN       LYS   4  11.051  -5.823  -4.669
   29    HA   LYS   4           HA       LYS   4  13.386  -7.070  -3.832
   30   1HB   LYS   4          HB2       LYS   4  11.710  -4.938  -2.554
   31   2HB   LYS   4          HB1       LYS   4  13.252  -5.452  -1.888
   32   1HG   LYS   4          HG2       LYS   4  12.832  -4.324  -4.654
   33   2HG   LYS   4          HG1       LYS   4  13.469  -3.435  -3.267
   34   1HD   LYS   4          HD2       LYS   4  15.454  -4.669  -3.241
   35   2HD   LYS   4          HD1       LYS   4  14.766  -5.974  -4.208
   36   1HE   LYS   4          HE2       LYS   4  16.346  -4.623  -5.502
   37   2HE   LYS   4          HE1       LYS   4  14.716  -4.537  -6.161
   38   1HZ   LYS   4          HZ1       LYS   4  16.009  -2.475  -4.458
   39   2HZ   LYS   4          HZ2       LYS   4  14.442  -2.386  -5.085
   40   3HZ   LYS   4          HZ3       LYS   4  15.771  -2.372  -6.134
   41    H    GLY   5           HN       GLY   5  10.292  -6.933  -2.226
   42   1HA   GLY   5          HA2       GLY   5   9.237  -8.926  -1.461
   43   2HA   GLY   5          HA1       GLY   5  10.822  -9.649  -1.271
   44    H    LYS   6           HN       LYS   6  11.118  -6.707   0.053
   45    HA   LYS   6           HA       LYS   6  11.011  -7.554   2.716
   46   1HB   LYS   6          HB2       LYS   6  12.378  -5.660   1.828
   47   2HB   LYS   6          HB1       LYS   6  10.896  -4.726   1.609
   48   1HG   LYS   6          HG2       LYS   6  12.036  -4.094   3.649
   49   2HG   LYS   6          HG1       LYS   6  10.480  -4.852   3.994
   50   1HD   LYS   6          HD2       LYS   6  12.093  -5.744   5.533
   51   2HD   LYS   6          HD1       LYS   6  11.673  -6.997   4.358
   52   1HE   LYS   6          HE2       LYS   6  14.076  -6.952   4.776
   53   2HE   LYS   6          HE1       LYS   6  13.704  -6.533   3.106
   54   1HZ   LYS   6          HZ1       LYS   6  14.222  -4.513   5.220
   55   2HZ   LYS   6          HZ2       LYS   6  14.120  -4.253   3.546
   56   3HZ   LYS   6          HZ3       LYS   6  15.425  -5.122   4.194
   57    H    TYR   7           HN       TYR   7   8.941  -5.417   0.912
   58    HA   TYR   7           HA       TYR   7   6.610  -6.053   2.487
   59   1HB   TYR   7          HB2       TYR   7   7.625  -3.240   1.971
   60   2HB   TYR   7          HB1       TYR   7   6.062  -3.632   2.673
   61    HD1  TYR   7           HD1      TYR   7   7.172  -5.942   4.323
   62    HD2  TYR   7           HD2      TYR   7   8.387  -1.932   3.799
   63    HE1  TYR   7           HE1      TYR   7   8.145  -5.990   6.538
   64    HE2  TYR   7           HE2      TYR   7   9.410  -1.935   6.020
   65    HH   TYR   7           HH       TYR   7   9.226  -3.145   8.137
   66    HA   PRO   8           HA       PRO   8   5.794  -5.497  -2.168
   67   1HB   PRO   8          HB2       PRO   8   4.607  -8.184  -1.771
   68   2HB   PRO   8          HB1       PRO   8   5.612  -7.586  -3.096
   69   1HG   PRO   8          HG2       PRO   8   6.577  -9.299  -1.284
   70   2HG   PRO   8          HG1       PRO   8   7.584  -8.006  -1.965
   71   1HD   PRO   8          HD2       PRO   8   6.227  -8.150   0.702
   72   2HD   PRO   8          HD1       PRO   8   7.837  -7.523   0.288
   73    H    ILE   9           HN       ILE   9   4.273  -3.933  -1.539
   74    HA   ILE   9           HA       ILE   9   2.301  -4.503   0.393
   75    HB   ILE   9           HB       ILE   9   2.185  -2.310   0.551
   76   1HG1  ILE   9          HG12      ILE   9   1.562  -1.997  -2.383
   77   2HG1  ILE   9          HG11      ILE   9   0.357  -2.454  -1.184
   78   1HG2  ILE   9          HG21      ILE   9   3.685  -0.868  -0.714
   79   2HG2  ILE   9          HG22      ILE   9   3.980  -2.185  -1.848
   80   3HG2  ILE   9          HG23      ILE   9   4.485  -2.340  -0.165
   81   1HD1  ILE   9          HD11      ILE   9   0.238  -0.095  -1.678
   82   2HD1  ILE   9          HD12      ILE   9   1.933   0.101  -1.234
   83   3HD1  ILE   9          HD13      ILE   9   0.747  -0.350  -0.009
   84    H    SER  10           HN       SER  10  -0.024  -4.163   0.042
   85    HA   SER  10           HA       SER  10  -0.900  -5.122  -2.577
   86   1HB   SER  10          HB2       SER  10  -1.805  -6.437  -0.022
   87   2HB   SER  10          HB1       SER  10  -2.003  -7.015  -1.680
   88    HG   SER  10           HG       SER  10   0.585  -6.660  -1.266
   89    H    VAL  11           HN       VAL  11  -2.320  -3.695  -3.209
   90    HA   VAL  11           HA       VAL  11  -4.372  -2.728  -1.319
   91    HB   VAL  11           HB       VAL  11  -3.845  -1.279  -3.876
   92   1HG1  VAL  11          HG11      VAL  11  -4.503   0.657  -2.515
   93   2HG1  VAL  11          HG12      VAL  11  -4.668  -0.403  -1.115
   94   3HG1  VAL  11          HG13      VAL  11  -5.720  -0.617  -2.514
   95   1HG2  VAL  11          HG21      VAL  11  -1.605  -1.477  -3.079
   96   2HG2  VAL  11          HG22      VAL  11  -2.094  -1.044  -1.435
   97   3HG2  VAL  11          HG23      VAL  11  -2.171   0.159  -2.727
   98    H    CYS  12           HN       CYS  12  -6.447  -3.470  -1.829
   99    HA   CYS  12           HA       CYS  12  -6.916  -5.000  -4.162
  100   1HB   CYS  12          HB2       CYS  12  -8.342  -5.377  -2.259
  101   2HB   CYS  12          HB1       CYS  12  -8.869  -3.697  -2.258
  102    H    MET  13           HN       MET  13  -7.095  -4.327  -6.152
  103    HA   MET  13           HA       MET  13  -8.503  -1.800  -6.657
  104   1HB   MET  13          HB2       MET  13  -5.981  -1.847  -7.158
  105   2HB   MET  13          HB1       MET  13  -6.387  -2.929  -8.483
  106   1HG   MET  13          HG2       MET  13  -7.772  -1.236  -9.497
  107   2HG   MET  13          HG1       MET  13  -7.507  -0.158  -8.129
  108   1HE   MET  13          HE1       MET  13  -7.059   0.821 -11.078
  109   2HE   MET  13          HE2       MET  13  -5.528   1.681 -10.910
  110   3HE   MET  13          HE3       MET  13  -6.755   1.808  -9.648
  111    H    GLY  14           HN       GLY  14  -9.382  -4.656  -6.439
  112   1HA   GLY  14          HA2       GLY  14  -9.910  -5.659  -9.051
  113   2HA   GLY  14          HA1       GLY  14 -10.692  -6.178  -7.566
  114    H    THR  15           HN       THR  15 -12.353  -6.205  -9.540
  115    HA   THR  15           HA       THR  15 -13.488  -3.714 -10.268
  116    HB   THR  15           HB       THR  15 -13.742  -5.651 -11.715
  117    HG1  THR  15           HG1      THR  15 -15.496  -4.672 -12.352
  118   1HG2  THR  15          HG21      THR  15 -15.236  -7.496 -11.178
  119   2HG2  THR  15          HG22      THR  15 -15.552  -6.801  -9.588
  120   3HG2  THR  15          HG23      THR  15 -13.939  -7.394  -9.987
  121    H    ALA  16           HN       ALA  16 -14.341  -6.084  -7.760
  122    HA   ALA  16           HA       ALA  16 -16.870  -4.896  -7.178
  123   1HB   ALA  16          HB1       ALA  16 -16.403  -7.264  -6.774
  124   2HB   ALA  16          HB2       ALA  16 -16.970  -6.447  -5.318
  125   3HB   ALA  16          HB3       ALA  16 -15.257  -6.817  -5.509
  126    H    CYS  17           HN       CYS  17 -13.850  -4.994  -5.280
  127    HA   CYS  17           HA       CYS  17 -14.805  -3.332  -3.231
  128   1HB   CYS  17          HB2       CYS  17 -11.993  -3.960  -4.086
  129   2HB   CYS  17          HB1       CYS  17 -12.394  -3.095  -2.630
  130    H    PHE  18           HN       PHE  18 -13.374  -2.591  -6.300
  131    HA   PHE  18           HA       PHE  18 -12.380  -0.018  -5.862
  132   1HB   PHE  18          HB2       PHE  18 -11.983  -1.462  -7.867
  133   2HB   PHE  18          HB1       PHE  18 -13.610  -1.084  -8.412
  134    HD1  PHE  18           HD1      PHE  18 -10.258   0.303  -7.788
  135    HD2  PHE  18           HD2      PHE  18 -14.104   0.965  -9.482
  136    HE1  PHE  18           HE1      PHE  18  -9.405   2.309  -8.924
  137    HE2  PHE  18           HE2      PHE  18 -13.259   2.973 -10.625
  138    HZ   PHE  18           HZ       PHE  18 -10.875   3.599 -10.405
  139    H    VAL  19           HN       VAL  19 -15.666  -1.099  -6.275
  140    HA   VAL  19           HA       VAL  19 -16.710   1.304  -7.371
  141    HB   VAL  19           HB       VAL  19 -18.910   0.410  -7.039
  142   1HG1  VAL  19          HG11      VAL  19 -18.709  -1.724  -8.213
  143   2HG1  VAL  19          HG12      VAL  19 -16.986  -1.766  -7.833
  144   3HG1  VAL  19          HG13      VAL  19 -17.627  -0.501  -8.881
  145   1HG2  VAL  19          HG21      VAL  19 -17.626  -1.712  -5.325
  146   2HG2  VAL  19          HG22      VAL  19 -19.315  -1.688  -5.835
  147   3HG2  VAL  19          HG23      VAL  19 -18.694  -0.425  -4.771
  148    H    LYS  20           HN       LYS  20 -15.848   0.458  -4.189
  149    HA   LYS  20           HA       LYS  20 -17.819   2.104  -2.866
  150   1HB   LYS  20          HB2       LYS  20 -15.283   1.006  -1.656
  151   2HB   LYS  20          HB1       LYS  20 -16.767   1.450  -0.829
  152   1HG   LYS  20          HG2       LYS  20 -16.442  -0.874  -2.715
  153   2HG   LYS  20          HG1       LYS  20 -16.459  -0.970  -0.955
  154   1HD   LYS  20          HD2       LYS  20 -18.756  -0.064  -0.960
  155   2HD   LYS  20          HD1       LYS  20 -18.724  -0.057  -2.725
  156   1HE   LYS  20          HE2       LYS  20 -18.349  -2.489  -2.710
  157   2HE   LYS  20          HE1       LYS  20 -18.435  -2.480  -0.950
  158   1HZ   LYS  20          HZ1       LYS  20 -20.620  -1.756  -2.828
  159   2HZ   LYS  20          HZ2       LYS  20 -20.720  -1.625  -1.142
  160   3HZ   LYS  20          HZ3       LYS  20 -20.534  -3.149  -1.866
  161    H    GLY  21           HN       GLY  21 -15.585   3.092  -4.827
  162   1HA   GLY  21          HA2       GLY  21 -14.744   5.263  -5.076
  163   2HA   GLY  21          HA1       GLY  21 -15.063   5.554  -3.366
  164    H    ALA  22           HN       ALA  22 -13.346   2.776  -4.566
  165    HA   ALA  22           HA       ALA  22 -11.277   3.199  -2.655
  166   1HB   ALA  22          HB1       ALA  22 -10.337   1.112  -3.524
  167   2HB   ALA  22          HB2       ALA  22 -11.500   1.144  -4.850
  168   3HB   ALA  22          HB3       ALA  22 -12.061   0.959  -3.188
  169    H    ASP  23           HN       ASP  23 -11.723   4.147  -5.908
  170    HA   ASP  23           HA       ASP  23  -9.127   4.009  -6.897
  171   1HB   ASP  23          HB2       ASP  23  -9.777   5.740  -8.501
  172   2HB   ASP  23          HB1       ASP  23 -11.052   4.538  -8.325
  173    H    LYS  24           HN       LYS  24 -10.676   6.561  -4.945
  174    HA   LYS  24           HA       LYS  24  -8.572   8.412  -5.265
  175   1HB   LYS  24          HB2       LYS  24 -10.468   8.156  -2.917
  176   2HB   LYS  24          HB1       LYS  24  -9.530   9.581  -3.341
  177   1HG   LYS  24          HG2       LYS  24 -11.751   8.374  -4.975
  178   2HG   LYS  24          HG1       LYS  24 -11.855   9.830  -3.983
  179   1HD   LYS  24          HD2       LYS  24 -10.044  10.814  -5.381
  180   2HD   LYS  24          HD1       LYS  24 -10.156   9.408  -6.433
  181   1HE   LYS  24          HE2       LYS  24 -12.378  11.362  -5.840
  182   2HE   LYS  24          HE1       LYS  24 -11.440  11.283  -7.330
  183   1HZ   LYS  24          HZ1       LYS  24 -13.531  10.172  -7.637
  184   2HZ   LYS  24          HZ2       LYS  24 -13.269   9.187  -6.284
  185   3HZ   LYS  24          HZ3       LYS  24 -12.294   9.011  -7.654
  186    H    VAL  25           HN       VAL  25  -9.202   6.002  -2.741
  187    HA   VAL  25           HA       VAL  25  -7.047   6.837  -1.116
  188    HB   VAL  25           HB       VAL  25  -7.383   4.585  -0.079
  189   1HG1  VAL  25          HG11      VAL  25  -8.430   6.602   0.795
  190   2HG1  VAL  25          HG12      VAL  25  -9.510   5.219   0.969
  191   3HG1  VAL  25          HG13      VAL  25  -9.774   6.386  -0.326
  192   1HG2  VAL  25          HG21      VAL  25  -9.432   3.368  -0.588
  193   2HG2  VAL  25          HG22      VAL  25  -8.302   3.369  -1.944
  194   3HG2  VAL  25          HG23      VAL  25  -9.702   4.441  -1.963
  195    H    VAL  26           HN       VAL  26  -7.448   4.323  -3.557
  196    HA   VAL  26           HA       VAL  26  -4.855   3.264  -3.156
  197    HB   VAL  26           HB       VAL  26  -5.066   2.067  -5.230
  198   1HG1  VAL  26          HG11      VAL  26  -7.708   2.178  -3.792
  199   2HG1  VAL  26          HG12      VAL  26  -6.316   1.188  -3.355
  200   3HG1  VAL  26          HG13      VAL  26  -7.179   0.883  -4.863
  201   1HG2  VAL  26          HG21      VAL  26  -7.005   2.401  -6.724
  202   2HG2  VAL  26          HG22      VAL  26  -5.893   3.771  -6.688
  203   3HG2  VAL  26          HG23      VAL  26  -7.418   3.847  -5.803
  204    H    HIS  27           HN       HIS  27  -6.127   5.923  -5.183
  205    HA   HIS  27           HA       HIS  27  -3.758   6.298  -6.683
  206   1HB   HIS  27          HB2       HIS  27  -5.995   7.448  -7.120
  207   2HB   HIS  27          HB1       HIS  27  -5.553   8.558  -5.817
  208    HD1  HIS  27           HD1      HIS  27  -3.186   9.875  -6.239
  209    HD2  HIS  27           HD2      HIS  27  -4.981   8.120  -9.556
  210    HE1  HIS  27           HE1      HIS  27  -2.049  10.882  -8.230
  211    HE2  HIS  27           HE2      HIS  27  -2.995   9.649 -10.211
  212    H    ALA  28           HN       ALA  28  -4.821   7.468  -3.613
  213    HA   ALA  28           HA       ALA  28  -2.681   9.161  -3.010
  214   1HB   ALA  28          HB1       ALA  28  -3.289   8.817  -0.663
  215   2HB   ALA  28          HB2       ALA  28  -4.301   7.446  -1.118
  216   3HB   ALA  28          HB3       ALA  28  -4.725   9.072  -1.654
  217    H    PHE  29           HN       PHE  29  -3.194   5.718  -2.481
  218    HA   PHE  29           HA       PHE  29  -0.818   5.067  -1.174
  219   1HB   PHE  29          HB2       PHE  29  -3.034   3.712  -2.272
  220   2HB   PHE  29          HB1       PHE  29  -1.604   2.983  -3.000
  221    HD1  PHE  29           HD1      PHE  29   0.335   3.177  -0.841
  222    HD2  PHE  29           HD2      PHE  29  -3.795   2.173  -0.739
  223    HE1  PHE  29           HE1      PHE  29   0.707   1.874   1.198
  224    HE2  PHE  29           HE2      PHE  29  -3.431   0.860   1.305
  225    HZ   PHE  29           HZ       PHE  29  -1.175   0.709   2.278
  226    H    LYS  30           HN       LYS  30  -1.538   5.195  -4.650
  227    HA   LYS  30           HA       LYS  30   0.845   4.137  -5.593
  228   1HB   LYS  30          HB2       LYS  30  -1.276   4.820  -6.901
  229   2HB   LYS  30          HB1       LYS  30  -0.528   6.410  -6.992
  230   1HG   LYS  30          HG2       LYS  30   1.419   5.422  -8.107
  231   2HG   LYS  30          HG1       LYS  30   0.645   3.838  -8.036
  232   1HD   LYS  30          HD2       LYS  30   0.213   4.629 -10.206
  233   2HD   LYS  30          HD1       LYS  30  -1.286   4.907  -9.318
  234   1HE   LYS  30          HE2       LYS  30  -0.794   6.854 -10.646
  235   2HE   LYS  30          HE1       LYS  30  -0.571   7.252  -8.942
  236   1HZ   LYS  30          HZ1       LYS  30   1.225   8.135 -10.297
  237   2HZ   LYS  30          HZ2       LYS  30   1.599   6.579 -10.863
  238   3HZ   LYS  30          HZ3       LYS  30   1.817   6.962  -9.225
  239    H    GLU  31           HN       GLU  31   0.014   7.454  -4.899
  240    HA   GLU  31           HA       GLU  31   2.693   8.357  -5.541
  241   1HB   GLU  31          HB2       GLU  31   1.858  10.613  -5.057
  242   2HB   GLU  31          HB1       GLU  31   0.805   9.769  -6.179
  243   1HG   GLU  31          HG2       GLU  31  -0.734   9.264  -4.341
  244   2HG   GLU  31          HG1       GLU  31   0.317  10.147  -3.235
  245    H    GLN  32           HN       GLN  32   0.990   7.333  -2.813
  246    HA   GLN  32           HA       GLN  32   2.386   8.643  -0.784
  247   1HB   GLN  32          HB2       GLN  32   1.033   7.517   0.541
  248   2HB   GLN  32          HB1       GLN  32   0.279   6.911  -0.895
  249   1HG   GLN  32          HG2       GLN  32   0.660   4.927   0.052
  250   2HG   GLN  32          HG1       GLN  32   2.237   5.164  -0.704
  251   1HE2  GLN  32          HE21      GLN  32   1.217   7.044   1.993
  252   2HE2  GLN  32          HE22      GLN  32   2.312   6.376   3.116
  253    H    LEU  33           HN       LEU  33   3.116   5.816  -2.720
  254    HA   LEU  33           HA       LEU  33   5.362   4.873  -1.354
  255   1HB   LEU  33          HB2       LEU  33   4.269   4.066  -3.571
  256   2HB   LEU  33          HB1       LEU  33   5.414   5.172  -4.322
  257    HG   LEU  33           HG       LEU  33   6.038   2.812  -2.593
  258   1HD1  LEU  33          HD11      LEU  33   7.171   1.977  -4.572
  259   2HD1  LEU  33          HD12      LEU  33   6.559   3.378  -5.473
  260   3HD1  LEU  33          HD13      LEU  33   5.432   2.186  -4.806
  261   1HD2  LEU  33          HD21      LEU  33   8.002   4.681  -3.879
  262   2HD2  LEU  33          HD22      LEU  33   8.387   3.195  -3.004
  263   3HD2  LEU  33          HD23      LEU  33   7.666   4.559  -2.148
  264    H    LYS  34           HN       LYS  34   5.133   7.150  -3.889
  265    HA   LYS  34           HA       LYS  34   6.071   9.074  -4.417
  266   1HB   LYS  34          HB2       LYS  34   6.810  10.609  -2.724
  267   2HB   LYS  34          HB1       LYS  34   5.416   9.723  -2.136
  268   1HG   LYS  34          HG2       LYS  34   6.780   9.787  -0.282
  269   2HG   LYS  34          HG1       LYS  34   7.173   8.199  -0.969
  270   1HD   LYS  34          HD2       LYS  34   9.149   9.202  -2.056
  271   2HD   LYS  34          HD1       LYS  34   8.765  10.753  -1.301
  272   1HE   LYS  34          HE2       LYS  34   9.030   9.771   0.901
  273   2HE   LYS  34          HE1       LYS  34   9.325   8.185   0.185
  274   1HZ   LYS  34          HZ1       LYS  34  11.351   9.400   0.889
  275   2HZ   LYS  34          HZ2       LYS  34  11.044  10.560  -0.308
  276   3HZ   LYS  34          HZ3       LYS  34  11.356   8.950  -0.744
  277    H    ILE  35           HN       ILE  35   7.960   6.721  -3.061
  278    HA   ILE  35           HA       ILE  35   9.882   5.778  -3.638
  279    HB   ILE  35           HB       ILE  35  10.174   6.991  -6.273
  280   1HG1  ILE  35          HG12      ILE  35   7.680   5.411  -5.771
  281   2HG1  ILE  35          HG11      ILE  35   7.638   7.172  -5.791
  282   1HG2  ILE  35          HG21      ILE  35  10.049   4.619  -6.893
  283   2HG2  ILE  35          HG22      ILE  35   9.559   4.235  -5.237
  284   3HG2  ILE  35          HG23      ILE  35  11.172   4.886  -5.557
  285   1HD1  ILE  35          HD11      ILE  35   8.475   5.372  -8.057
  286   2HD1  ILE  35          HD12      ILE  35   8.452   7.136  -8.098
  287   3HD1  ILE  35          HD13      ILE  35   6.945   6.238  -7.921
  288    H    ASP  36           HN       ASP  36  11.951   6.447  -5.192
  289    HA   ASP  36           HA       ASP  36  13.111   8.953  -4.394
  290   1HB   ASP  36          HB2       ASP  36  13.319   7.359  -2.387
  291   2HB   ASP  36          HB1       ASP  36  14.393   6.403  -3.394
  292    H    ILE  37           HN       ILE  37  13.652   5.650  -5.314
  293    HA   ILE  37           HA       ILE  37  14.804   6.258  -7.863
  294    HB   ILE  37           HB       ILE  37  16.857   4.928  -7.335
  295   1HG1  ILE  37          HG12      ILE  37  15.711   5.354  -4.633
  296   2HG1  ILE  37          HG11      ILE  37  16.208   3.845  -5.388
  297   1HG2  ILE  37          HG21      ILE  37  16.626   7.587  -5.942
  298   2HG2  ILE  37          HG22      ILE  37  17.033   7.340  -7.641
  299   3HG2  ILE  37          HG23      ILE  37  18.135   6.786  -6.380
  300   1HD1  ILE  37          HD11      ILE  37  18.553   4.523  -5.214
  301   2HD1  ILE  37          HD12      ILE  37  17.764   4.464  -3.638
  302   3HD1  ILE  37          HD13      ILE  37  18.057   6.018  -4.421
  303    H    GLY  38           HN       GLY  38  12.831   4.473  -6.173
  304   1HA   GLY  38          HA2       GLY  38  12.978   2.046  -7.560
  305   2HA   GLY  38          HA1       GLY  38  13.903   1.894  -6.056
  306    H    ASP  39           HN       ASP  39  12.816   2.965  -4.228
  307    HA   ASP  39           HA       ASP  39  10.001   3.023  -3.958
  308   1HB   ASP  39          HB2       ASP  39  11.459   0.716  -2.708
  309   2HB   ASP  39          HB1       ASP  39   9.864   1.265  -2.249
  310    H    VAL  40           HN       VAL  40   9.720   4.509  -2.833
  311    HA   VAL  40           HA       VAL  40   9.612   5.948  -1.159
  312    HB   VAL  40           HB       VAL  40   8.775   4.307   0.169
  313   1HG1  VAL  40          HG11      VAL  40   9.777   2.437   1.157
  314   2HG1  VAL  40          HG12      VAL  40  11.396   3.008   0.750
  315   3HG1  VAL  40          HG13      VAL  40  10.306   2.466  -0.526
  316   1HG2  VAL  40          HG21      VAL  40  11.172   5.147   1.711
  317   2HG2  VAL  40          HG22      VAL  40   9.615   4.643   2.372
  318   3HG2  VAL  40          HG23      VAL  40   9.743   6.149   1.460
  319    H    THR  41           HN       THR  41  12.318   4.152  -0.224
  320    HA   THR  41           HA       THR  41  14.167   6.359  -0.529
  321    HB   THR  41           HB       THR  41  13.724   5.228   2.236
  322    HG1  THR  41           HG1      THR  41  13.244   7.850   1.190
  323   1HG2  THR  41          HG21      THR  41  15.395   6.893   2.937
  324   2HG2  THR  41          HG22      THR  41  15.641   7.347   1.249
  325   3HG2  THR  41          HG23      THR  41  16.073   5.728   1.799
  326    HA   PRO  42           HA       PRO  42  16.634   2.608   0.508
  327   1HB   PRO  42          HB2       PRO  42  14.925   0.322   1.078
  328   2HB   PRO  42          HB1       PRO  42  16.219   1.013   2.058
  329   1HG   PRO  42          HG2       PRO  42  13.595   1.214   2.717
  330   2HG   PRO  42          HG1       PRO  42  14.802   2.435   3.159
  331   1HD   PRO  42          HD2       PRO  42  12.817   2.464   0.922
  332   2HD   PRO  42          HD1       PRO  42  13.315   3.780   2.001
  333    H    ASP  43           HN       ASP  43  14.029   2.612  -1.665
  334    HA   ASP  43           HA       ASP  43  14.260   2.260  -3.908
  335   1HB   ASP  43          HB2       ASP  43  16.661   2.505  -3.870
  336   2HB   ASP  43          HB1       ASP  43  16.869   0.947  -3.089
  337    H    GLY  44           HN       GLY  44  13.371   0.586  -1.521
  338   1HA   GLY  44          HA2       GLY  44  11.709  -1.083  -2.703
  339   2HA   GLY  44          HA1       GLY  44  13.185  -2.048  -2.789
  340    H    ARG  45           HN       ARG  45  11.439  -0.062  -0.505
  341    HA   ARG  45           HA       ARG  45  11.834  -2.052   1.572
  342   1HB   ARG  45          HB2       ARG  45  12.148   0.423   1.983
  343   2HB   ARG  45          HB1       ARG  45  10.436   0.617   1.740
  344   1HG   ARG  45          HG2       ARG  45   9.959  -0.772   3.657
  345   2HG   ARG  45          HG1       ARG  45  11.671  -1.156   3.838
  346   1HD   ARG  45          HD2       ARG  45  11.806   1.521   3.953
  347   2HD   ARG  45          HD1       ARG  45  10.178   1.287   4.591
  348    HE   ARG  45           HE       ARG  45  12.454  -0.187   5.738
  349   1HH1  ARG  45          HH11      ARG  45   9.791   2.075   6.120
  350   2HH1  ARG  45          HH12      ARG  45   9.967   2.152   7.851
  351   1HH2  ARG  45          HH21      ARG  45  12.683  -0.064   7.984
  352   2HH2  ARG  45          HH22      ARG  45  11.618   0.951   8.913
  353    H    PHE  46           HN       PHE  46   9.112  -0.031   0.478
  354    HA   PHE  46           HA       PHE  46   7.495  -2.434   0.441
  355   1HB   PHE  46          HB2       PHE  46   5.616  -1.107   0.729
  356   2HB   PHE  46          HB1       PHE  46   6.787  -0.564   1.885
  357    HD1  PHE  46           HD1      PHE  46   8.317   1.438   0.164
  358    HD2  PHE  46           HD2      PHE  46   4.169   0.603   0.516
  359    HE1  PHE  46           HE1      PHE  46   7.762   3.825  -0.297
  360    HE2  PHE  46           HE2      PHE  46   3.634   2.920   0.043
  361    HZ   PHE  46           HZ       PHE  46   5.433   4.523  -0.354
  362    H    SER  47           HN       SER  47   6.885  -3.304  -1.336
  363    HA   SER  47           HA       SER  47   7.238  -1.871  -3.890
  364   1HB   SER  47          HB2       SER  47   6.898  -4.856  -3.531
  365   2HB   SER  47          HB1       SER  47   7.572  -3.996  -4.916
  366    HG   SER  47           HG       SER  47   9.423  -3.647  -3.836
  367    H    ILE  48           HN       ILE  48   5.304  -0.842  -4.071
  368    HA   ILE  48           HA       ILE  48   2.849  -1.789  -3.124
  369    HB   ILE  48           HB       ILE  48   1.853   0.056  -4.477
  370   1HG1  ILE  48          HG12      ILE  48   3.947   1.578  -5.339
  371   2HG1  ILE  48          HG11      ILE  48   4.516  -0.037  -5.744
  372   1HG2  ILE  48          HG21      ILE  48   2.981   1.874  -3.292
  373   2HG2  ILE  48          HG22      ILE  48   4.320   0.792  -2.912
  374   3HG2  ILE  48          HG23      ILE  48   2.718   0.481  -2.242
  375   1HD1  ILE  48          HD11      ILE  48   1.894   1.141  -6.611
  376   2HD1  ILE  48          HD12      ILE  48   2.552  -0.429  -7.075
  377   3HD1  ILE  48          HD13      ILE  48   3.356   1.051  -7.594
  378    H    ASP  49           HN       ASP  49   1.560  -3.431  -3.861
  379    HA   ASP  49           HA       ASP  49   0.751  -3.185  -6.647
  380   1HB   ASP  49          HB2       ASP  49   2.796  -4.783  -6.543
  381   2HB   ASP  49          HB1       ASP  49   1.637  -5.930  -5.885
  382    H    THR  50           HN       THR  50  -1.230  -3.767  -6.983
  383    HA   THR  50           HA       THR  50  -3.136  -4.502  -5.185
  384    HB   THR  50           HB       THR  50  -3.726  -3.682  -7.367
  385    HG1  THR  50           HG1      THR  50  -5.008  -5.450  -6.069
  386   1HG2  THR  50          HG21      THR  50  -3.663  -5.107  -9.356
  387   2HG2  THR  50          HG22      THR  50  -2.844  -6.367  -8.432
  388   3HG2  THR  50          HG23      THR  50  -2.041  -4.823  -8.722
  389    H    LEU  51           HN       LEU  51  -0.992  -6.806  -6.864
  390    HA   LEU  51           HA       LEU  51  -2.888  -8.759  -7.284
  391   1HB   LEU  51          HB2       LEU  51   0.088  -8.962  -7.096
  392   2HB   LEU  51          HB1       LEU  51  -0.918 -10.324  -7.545
  393    HG   LEU  51           HG       LEU  51  -0.688  -7.708  -9.033
  394   1HD1  LEU  51          HD11      LEU  51   1.235  -9.141  -9.337
  395   2HD1  LEU  51          HD12      LEU  51   0.257  -9.125 -10.805
  396   3HD1  LEU  51          HD13      LEU  51   0.187 -10.509  -9.713
  397   1HD2  LEU  51          HD21      LEU  51  -2.972  -8.600  -9.122
  398   2HD2  LEU  51          HD22      LEU  51  -2.338 -10.146  -9.688
  399   3HD2  LEU  51          HD23      LEU  51  -2.166  -8.700 -10.686
  400    H    ARG  52           HN       ARG  52  -0.788  -8.672  -4.357
  401    HA   ARG  52           HA       ARG  52  -1.618 -11.200  -3.392
  402   1HB   ARG  52          HB2       ARG  52  -0.527  -8.741  -2.106
  403   2HB   ARG  52          HB1       ARG  52  -1.235  -9.976  -1.080
  404   1HG   ARG  52          HG2       ARG  52   0.985 -10.499  -3.042
  405   2HG   ARG  52          HG1       ARG  52   1.235 -10.111  -1.338
  406   1HD   ARG  52          HD2       ARG  52  -0.304 -12.067  -0.830
  407   2HD   ARG  52          HD1       ARG  52  -0.118 -12.517  -2.525
  408    HE   ARG  52           HE       ARG  52   2.174 -12.279  -0.670
  409   1HH1  ARG  52          HH11      ARG  52   0.391 -14.012  -3.156
  410   2HH1  ARG  52          HH12      ARG  52   1.571 -15.290  -3.284
  411   1HH2  ARG  52          HH21      ARG  52   3.722 -13.923  -0.859
  412   2HH2  ARG  52          HH22      ARG  52   3.491 -15.222  -1.993
  413    H    CYS  53           HN       CYS  53  -2.729  -8.007  -2.590
  414    HA   CYS  53           HA       CYS  53  -5.010  -8.722  -1.119
  415   1HB   CYS  53          HB2       CYS  53  -3.760  -6.569  -0.937
  416   2HB   CYS  53          HB1       CYS  53  -4.434  -6.094  -2.492
  417    H    VAL  54           HN       VAL  54  -7.284  -7.693  -1.957
  418    HA   VAL  54           HA       VAL  54  -9.113  -8.508  -3.030
  419    HB   VAL  54           HB       VAL  54  -7.397  -9.271  -5.403
  420   1HG1  VAL  54          HG11      VAL  54  -9.467  -8.919  -6.672
  421   2HG1  VAL  54          HG12      VAL  54 -10.311  -8.527  -5.174
  422   3HG1  VAL  54          HG13      VAL  54  -9.666 -10.150  -5.423
  423   1HG2  VAL  54          HG21      VAL  54  -6.922  -6.941  -4.934
  424   2HG2  VAL  54          HG22      VAL  54  -8.646  -6.586  -4.835
  425   3HG2  VAL  54          HG23      VAL  54  -7.934  -7.071  -6.373
  426    H    GLY  55           HN       GLY  55  -7.208  -9.964  -1.437
  427   1HA   GLY  55          HA2       GLY  55  -7.748 -12.718  -2.307
  428   2HA   GLY  55          HA1       GLY  55  -6.332 -12.242  -1.389
  429    H    GLY  56           HN       GLY  56  -9.933 -11.903  -1.025
  430   1HA   GLY  56          HA2       GLY  56 -11.263 -12.680   0.695
  431   2HA   GLY  56          HA1       GLY  56  -9.959 -13.785   1.081
  432    H    CYS  57           HN       CYS  57 -10.722 -10.252   1.513
  433    HA   CYS  57           HA       CYS  57  -9.196 -10.415   4.072
  434   1HB   CYS  57          HB2       CYS  57  -9.081  -7.961   2.442
  435   2HB   CYS  57          HB1       CYS  57  -7.895  -8.627   3.515
  436    H    ALA  58           HN       ALA  58 -11.644  -8.916   2.063
  437    HA   ALA  58           HA       ALA  58 -11.748  -6.358   3.006
  438   1HB   ALA  58          HB1       ALA  58 -12.868  -7.148   0.997
  439   2HB   ALA  58          HB2       ALA  58 -13.952  -6.209   2.024
  440   3HB   ALA  58          HB3       ALA  58 -14.071  -7.968   1.992
  441    H    LEU  59           HN       LEU  59 -13.286  -9.146   4.648
  442    HA   LEU  59           HA       LEU  59 -14.882  -7.397   6.281
  443   1HB   LEU  59          HB2       LEU  59 -14.171 -10.301   6.441
  444   2HB   LEU  59          HB1       LEU  59 -14.960  -9.513   7.790
  445    HG   LEU  59           HG       LEU  59 -16.625 -10.626   6.474
  446   1HD1  LEU  59          HD11      LEU  59 -18.099  -8.773   5.911
  447   2HD1  LEU  59          HD12      LEU  59 -16.734  -7.659   5.970
  448   3HD1  LEU  59          HD13      LEU  59 -17.263  -8.485   7.435
  449   1HD2  LEU  59          HD21      LEU  59 -15.626  -9.029   4.120
  450   2HD2  LEU  59          HD22      LEU  59 -17.037 -10.087   4.131
  451   3HD2  LEU  59          HD23      LEU  59 -15.424 -10.764   4.356
  452    H    ALA  60           HN       ALA  60 -11.642  -7.660   6.170
  453    HA   ALA  60           HA       ALA  60 -11.425  -6.600   8.917
  454   1HB   ALA  60          HB1       ALA  60  -9.010  -7.024   8.732
  455   2HB   ALA  60          HB2       ALA  60  -9.252  -7.693   7.119
  456   3HB   ALA  60          HB3       ALA  60  -9.934  -8.511   8.524
  457    HA   PRO  61           HA       PRO  61 -10.045  -2.863   6.659
  458   1HB   PRO  61          HB2       PRO  61  -8.413  -1.739   8.523
  459   2HB   PRO  61          HB1       PRO  61 -10.171  -1.579   8.586
  460   1HG   PRO  61          HG2       PRO  61  -8.371  -3.387  10.141
  461   2HG   PRO  61          HG1       PRO  61  -9.831  -2.531  10.668
  462   1HD   PRO  61          HD2       PRO  61  -9.766  -5.195  10.018
  463   2HD   PRO  61          HD1       PRO  61 -11.219  -4.183   9.904
  464    H    ILE  62           HN       ILE  62  -8.499  -3.164   5.118
  465    HA   ILE  62           HA       ILE  62  -6.090  -4.606   5.948
  466    HB   ILE  62           HB       ILE  62  -5.878  -5.053   3.397
  467   1HG1  ILE  62          HG12      ILE  62  -8.299  -5.504   2.535
  468   2HG1  ILE  62          HG11      ILE  62  -8.768  -4.277   3.706
  469   1HG2  ILE  62          HG21      ILE  62  -7.880  -6.464   5.147
  470   2HG2  ILE  62          HG22      ILE  62  -6.137  -6.735   5.119
  471   3HG2  ILE  62          HG23      ILE  62  -7.114  -7.136   3.708
  472   1HD1  ILE  62          HD11      ILE  62  -8.522  -3.294   1.527
  473   2HD1  ILE  62          HD12      ILE  62  -6.880  -3.922   1.391
  474   3HD1  ILE  62          HD13      ILE  62  -7.254  -2.686   2.592
  475    H    VAL  63           HN       VAL  63  -4.160  -3.553   5.945
  476    HA   VAL  63           HA       VAL  63  -3.655  -2.186   3.391
  477    HB   VAL  63           HB       VAL  63  -2.194  -1.385   5.911
  478   1HG1  VAL  63          HG11      VAL  63  -2.607  -0.005   3.269
  479   2HG1  VAL  63          HG12      VAL  63  -1.148  -0.849   3.790
  480   3HG1  VAL  63          HG13      VAL  63  -1.663   0.618   4.622
  481   1HG2  VAL  63          HG21      VAL  63  -4.642  -0.009   4.807
  482   2HG2  VAL  63          HG22      VAL  63  -3.612   0.593   6.106
  483   3HG2  VAL  63          HG23      VAL  63  -4.544  -0.887   6.334
  484    H    MET  64           HN       MET  64  -2.125  -3.531   2.325
  485    HA   MET  64           HA       MET  64  -0.585  -5.235   4.170
  486   1HB   MET  64          HB2       MET  64  -2.335  -6.221   2.607
  487   2HB   MET  64          HB1       MET  64  -1.247  -5.809   1.290
  488   1HG   MET  64          HG2       MET  64   0.397  -7.300   2.039
  489   2HG   MET  64          HG1       MET  64  -0.398  -7.472   3.605
  490   1HE   MET  64          HE1       MET  64   0.599  -9.952   1.800
  491   2HE   MET  64          HE2       MET  64  -0.767 -11.055   1.971
  492   3HE   MET  64          HE3       MET  64  -0.178 -10.158   3.370
  493    H    VAL  65           HN       VAL  65   1.605  -5.001   4.205
  494    HA   VAL  65           HA       VAL  65   2.836  -4.657   1.540
  495    HB   VAL  65           HB       VAL  65   4.943  -4.098   2.970
  496   1HG1  VAL  65          HG11      VAL  65   4.466  -1.712   2.867
  497   2HG1  VAL  65          HG12      VAL  65   2.750  -2.057   2.644
  498   3HG1  VAL  65          HG13      VAL  65   3.914  -2.530   1.404
  499   1HG2  VAL  65          HG21      VAL  65   4.028  -4.527   5.117
  500   2HG2  VAL  65          HG22      VAL  65   2.701  -3.399   4.828
  501   3HG2  VAL  65          HG23      VAL  65   4.354  -2.796   4.990
  502    H    GLY  66           HN       GLY  66   3.620  -6.622   0.910
  503   1HA   GLY  66          HA2       GLY  66   4.509  -8.715   1.043
  504   2HA   GLY  66          HA1       GLY  66   5.275  -8.172   2.552
  505    H    GLU  67           HN       GLU  67   4.663 -10.570   2.824
  506    HA   GLU  67           HA       GLU  67   2.068 -10.910   4.011
  507   1HB   GLU  67          HB2       GLU  67   4.626 -12.516   4.219
  508   2HB   GLU  67          HB1       GLU  67   3.136 -12.964   5.037
  509   1HG   GLU  67          HG2       GLU  67   3.269 -14.260   3.068
  510   2HG   GLU  67          HG1       GLU  67   2.030 -13.040   2.802
  511    H    LYS  68           HN       LYS  68   3.297  -8.546   4.762
  512    HA   LYS  68           HA       LYS  68   4.164  -8.984   7.524
  513   1HB   LYS  68          HB2       LYS  68   4.526  -6.398   6.022
  514   2HB   LYS  68          HB1       LYS  68   5.415  -6.977   7.419
  515   1HG   LYS  68          HG2       LYS  68   5.725  -7.854   4.528
  516   2HG   LYS  68          HG1       LYS  68   6.908  -7.060   5.560
  517   1HD   LYS  68          HD2       LYS  68   7.043  -9.027   6.988
  518   2HD   LYS  68          HD1       LYS  68   5.813  -9.838   6.014
  519   1HE   LYS  68          HE2       LYS  68   7.293  -9.718   4.065
  520   2HE   LYS  68          HE1       LYS  68   8.522  -8.923   5.049
  521   1HZ   LYS  68          HZ1       LYS  68   7.496 -11.693   5.343
  522   2HZ   LYS  68          HZ2       LYS  68   8.511 -10.941   6.474
  523   3HZ   LYS  68          HZ3       LYS  68   9.059 -11.213   4.892
  524    H    VAL  69           HN       VAL  69   1.958  -7.413   5.399
  525    HA   VAL  69           HA       VAL  69   0.023  -6.225   5.643
  526    HB   VAL  69           HB       VAL  69  -0.265  -8.208   7.893
  527   1HG1  VAL  69          HG11      VAL  69  -1.808  -6.346   8.259
  528   2HG1  VAL  69          HG12      VAL  69  -2.681  -7.792   7.746
  529   3HG1  VAL  69          HG13      VAL  69  -2.384  -6.487   6.598
  530   1HG2  VAL  69          HG21      VAL  69  -1.613  -9.421   6.236
  531   2HG2  VAL  69          HG22      VAL  69   0.043  -9.175   5.679
  532   3HG2  VAL  69          HG23      VAL  69  -1.260  -8.165   5.044
  533    H    TYR  70           HN       TYR  70  -0.282  -4.201   6.183
  534    HA   TYR  70           HA       TYR  70   0.522  -3.299   8.865
  535   1HB   TYR  70          HB2       TYR  70   1.152  -2.063   6.182
  536   2HB   TYR  70          HB1       TYR  70   1.168  -1.113   7.667
  537    HD1  TYR  70           HD1      TYR  70   2.134  -4.617   7.603
  538    HD2  TYR  70           HD2      TYR  70   3.556  -0.622   7.534
  539    HE1  TYR  70           HE1      TYR  70   4.361  -5.430   8.017
  540    HE2  TYR  70           HE2      TYR  70   5.804  -1.424   7.989
  541    HH   TYR  70           HH       TYR  70   6.880  -3.409   9.048
  542    H    GLY  71           HN       GLY  71  -0.075  -0.757   8.809
  543   1HA   GLY  71          HA2       GLY  71  -2.827  -0.407   7.884
  544   2HA   GLY  71          HA1       GLY  71  -2.432  -0.096   9.575
  545    H    ASN  72           HN       ASN  72  -0.662   0.590   6.560
  546    HA   ASN  72           HA       ASN  72  -0.180   3.286   7.424
  547   1HB   ASN  72          HB2       ASN  72   1.677   2.842   6.249
  548   2HB   ASN  72          HB1       ASN  72   0.938   1.545   5.333
  549   1HD2  ASN  72          HD21      ASN  72   1.706   4.891   5.469
  550   2HD2  ASN  72          HD22      ASN  72   1.260   5.277   3.840
  551    H    VAL  73           HN       VAL  73  -2.711   1.798   6.162
  552    HA   VAL  73           HA       VAL  73  -4.789   2.481   5.698
  553    HB   VAL  73           HB       VAL  73  -4.323   5.378   5.952
  554   1HG1  VAL  73          HG11      VAL  73  -6.544   4.358   5.854
  555   2HG1  VAL  73          HG12      VAL  73  -6.290   5.193   7.385
  556   3HG1  VAL  73          HG13      VAL  73  -6.185   3.435   7.314
  557   1HG2  VAL  73          HG21      VAL  73  -3.851   3.542   8.312
  558   2HG2  VAL  73          HG22      VAL  73  -4.050   5.294   8.404
  559   3HG2  VAL  73          HG23      VAL  73  -2.658   4.606   7.562
  560    H    THR  74           HN       THR  74  -5.709   4.911   4.405
  561    HA   THR  74           HA       THR  74  -4.526   4.514   1.772
  562    HB   THR  74           HB       THR  74  -6.650   3.928   0.727
  563    HG1  THR  74           HG1      THR  74  -7.857   3.457   3.226
  564   1HG2  THR  74          HG21      THR  74  -5.207   2.130   1.574
  565   2HG2  THR  74          HG22      THR  74  -6.912   1.690   1.662
  566   3HG2  THR  74          HG23      THR  74  -6.054   2.195   3.123
  567    HA   PRO  75           HA       PRO  75  -7.302   8.303   1.314
  568   1HB   PRO  75          HB2       PRO  75  -8.697   9.173   3.595
  569   2HB   PRO  75          HB1       PRO  75  -9.348   8.238   2.249
  570   1HG   PRO  75          HG2       PRO  75  -9.032   7.354   4.902
  571   2HG   PRO  75          HG1       PRO  75  -9.402   6.347   3.493
  572   1HD   PRO  75          HD2       PRO  75  -6.796   6.814   4.858
  573   2HD   PRO  75          HD1       PRO  75  -7.396   5.362   4.029
  574    H    GLY  76           HN       GLY  76  -4.952   9.037   1.503
  575   1HA   GLY  76          HA2       GLY  76  -3.736  10.996   1.766
  576   2HA   GLY  76          HA1       GLY  76  -5.034  11.624   2.765
  577    H    GLN  77           HN       GLN  77  -4.732   9.041   4.378
  578    HA   GLN  77           HA       GLN  77  -3.155  10.303   6.439
  579   1HB   GLN  77          HB2       GLN  77  -4.306   7.504   6.475
  580   2HB   GLN  77          HB1       GLN  77  -3.941   8.529   7.855
  581   1HG   GLN  77          HG2       GLN  77  -5.756  10.035   7.208
  582   2HG   GLN  77          HG1       GLN  77  -6.126   8.986   5.840
  583   1HE2  GLN  77          HE21      GLN  77  -6.964   6.905   6.243
  584   2HE2  GLN  77          HE22      GLN  77  -7.762   6.546   7.738
  585    H    VAL  78           HN       VAL  78  -2.945   8.140   3.974
  586    HA   VAL  78           HA       VAL  78  -1.056   6.304   4.396
  587    HB   VAL  78           HB       VAL  78  -0.514   6.791   1.960
  588   1HG1  VAL  78          HG11      VAL  78  -3.346   6.315   2.769
  589   2HG1  VAL  78          HG12      VAL  78  -2.094   5.092   2.545
  590   3HG1  VAL  78          HG13      VAL  78  -2.703   6.007   1.156
  591   1HG2  VAL  78          HG21      VAL  78  -2.423   8.964   2.546
  592   2HG2  VAL  78          HG22      VAL  78  -2.403   8.233   0.937
  593   3HG2  VAL  78          HG23      VAL  78  -0.949   8.992   1.582
  594    H    LYS  79           HN       LYS  79  -0.405   9.664   3.239
  595    HA   LYS  79           HA       LYS  79   2.295   9.160   2.694
  596   1HB   LYS  79          HB2       LYS  79   0.905  11.786   3.265
  597   2HB   LYS  79          HB1       LYS  79   2.509  11.627   2.560
  598   1HG   LYS  79          HG2       LYS  79   1.647  10.659   0.585
  599   2HG   LYS  79          HG1       LYS  79   0.055  10.432   1.310
  600   1HD   LYS  79          HD2       LYS  79   1.346  13.105   0.763
  601   2HD   LYS  79          HD1       LYS  79   0.130  12.336  -0.260
  602   1HE   LYS  79          HE2       LYS  79  -1.378  12.289   1.757
  603   2HE   LYS  79          HE1       LYS  79  -0.190  13.302   2.572
  604   1HZ   LYS  79          HZ1       LYS  79  -1.703  13.985   0.116
  605   2HZ   LYS  79          HZ2       LYS  79  -0.480  14.947   0.785
  606   3HZ   LYS  79          HZ3       LYS  79  -1.912  14.665   1.655
  607    H    LYS  80           HN       LYS  80   0.638  10.125   5.530
  608    HA   LYS  80           HA       LYS  80   2.971  11.016   6.993
  609   1HB   LYS  80          HB2       LYS  80   0.337  10.359   8.240
  610   2HB   LYS  80          HB1       LYS  80   1.390  11.734   8.511
  611   1HG   LYS  80          HG2       LYS  80   0.374  12.979   6.993
  612   2HG   LYS  80          HG1       LYS  80   0.286  11.680   5.818
  613   1HD   LYS  80          HD2       LYS  80  -1.917  11.807   6.201
  614   2HD   LYS  80          HD1       LYS  80  -1.541  10.862   7.638
  615   1HE   LYS  80          HE2       LYS  80  -1.770  13.869   7.505
  616   2HE   LYS  80          HE1       LYS  80  -2.960  12.767   8.197
  617   1HZ   LYS  80          HZ1       LYS  80  -1.541  13.818   9.879
  618   2HZ   LYS  80          HZ2       LYS  80  -0.174  13.105   9.182
  619   3HZ   LYS  80          HZ3       LYS  80  -1.377  12.131   9.880
  620    H    ILE  81           HN       ILE  81   0.593   8.497   7.143
  621    HA   ILE  81           HA       ILE  81   1.992   6.894   9.014
  622    HB   ILE  81           HB       ILE  81  -0.032   5.996   6.965
  623   1HG1  ILE  81          HG12      ILE  81  -0.832   7.877   8.407
  624   2HG1  ILE  81          HG11      ILE  81  -1.720   6.379   8.672
  625   1HG2  ILE  81          HG21      ILE  81   0.811   4.825   9.635
  626   2HG2  ILE  81          HG22      ILE  81   1.198   4.162   8.045
  627   3HG2  ILE  81          HG23      ILE  81  -0.475   4.197   8.603
  628   1HD1  ILE  81          HD11      ILE  81   0.463   7.492  10.412
  629   2HD1  ILE  81          HD12      ILE  81  -0.347   5.946  10.658
  630   3HD1  ILE  81          HD13      ILE  81  -1.263   7.452  10.780
  631    H    LEU  82           HN       LEU  82   2.714   7.625   5.793
  632    HA   LEU  82           HA       LEU  82   3.943   5.314   4.836
  633   1HB   LEU  82          HB2       LEU  82   3.835   7.272   3.457
  634   2HB   LEU  82          HB1       LEU  82   4.772   8.207   4.604
  635    HG   LEU  82           HG       LEU  82   6.755   6.845   4.090
  636   1HD1  LEU  82          HD11      LEU  82   6.746   5.318   2.200
  637   2HD1  LEU  82          HD12      LEU  82   5.011   5.565   1.994
  638   3HD1  LEU  82          HD13      LEU  82   5.623   4.779   3.449
  639   1HD2  LEU  82          HD21      LEU  82   7.140   7.742   1.846
  640   2HD2  LEU  82          HD22      LEU  82   6.356   8.928   2.889
  641   3HD2  LEU  82          HD23      LEU  82   5.412   8.059   1.677
  642    H    ALA  83           HN       ALA  83   4.823   7.363   7.479
  643    HA   ALA  83           HA       ALA  83   7.399   6.508   8.029
  644   1HB   ALA  83          HB1       ALA  83   5.976   8.199   9.269
  645   2HB   ALA  83          HB2       ALA  83   6.997   7.154  10.265
  646   3HB   ALA  83          HB3       ALA  83   5.269   6.827  10.128
  647    H    GLU  84           HN       GLU  84   4.489   4.680   8.028
  648    HA   GLU  84           HA       GLU  84   5.217   2.436   9.564
  649   1HB   GLU  84          HB2       GLU  84   2.981   3.359   8.419
  650   2HB   GLU  84          HB1       GLU  84   3.478   2.235   7.145
  651   1HG   GLU  84          HG2       GLU  84   1.882   1.304   8.746
  652   2HG   GLU  84          HG1       GLU  84   3.409   0.422   8.682
  653    H    TYR  85           HN       TYR  85   5.332   3.270   6.161
  654    HA   TYR  85           HA       TYR  85   6.230   0.652   5.465
  655   1HB   TYR  85          HB2       TYR  85   5.107   2.987   3.993
  656   2HB   TYR  85          HB1       TYR  85   5.794   1.616   3.172
  657    HD1  TYR  85           HD1      TYR  85   4.773   0.044   5.763
  658    HD2  TYR  85           HD2      TYR  85   3.148   2.197   2.627
  659    HE1  TYR  85           HE1      TYR  85   2.879  -1.413   5.815
  660    HE2  TYR  85           HE2      TYR  85   1.201   0.767   2.701
  661    HH   TYR  85           HH       TYR  85   0.496  -1.403   3.387
  Start of MODEL    3
    1   1H    MET   1          HT1       MET   1  11.484   4.839 -10.562
    2   2H    MET   1          HT2       MET   1  11.170   3.603  -9.447
    3   3H    MET   1          HT3       MET   1   9.895   4.316 -10.301
    4    HA   MET   1           HA       MET   1  10.605   3.404 -12.335
    5   1HB   MET   1          HB2       MET   1  12.932   2.249 -10.780
    6   2HB   MET   1          HB1       MET   1  12.575   1.936 -12.471
    7   1HG   MET   1          HG2       MET   1  12.916   4.325 -12.959
    8   2HG   MET   1          HG1       MET   1  13.347   4.586 -11.272
    9   1HE   MET   1          HE1       MET   1  15.471   3.324 -10.109
   10   2HE   MET   1          HE2       MET   1  16.590   2.306 -11.015
   11   3HE   MET   1          HE3       MET   1  14.929   1.775 -10.754
   12    H    VAL   2           HN       VAL   2  11.975   0.771 -10.679
   13    HA   VAL   2           HA       VAL   2   9.321  -0.387 -10.139
   14    HB   VAL   2           HB       VAL   2  11.749  -1.909 -11.126
   15   1HG1  VAL   2          HG11      VAL   2  10.173  -3.778 -11.377
   16   2HG1  VAL   2          HG12      VAL   2   8.903  -2.788 -10.655
   17   3HG1  VAL   2          HG13      VAL   2  10.315  -3.247  -9.702
   18   1HG2  VAL   2          HG21      VAL   2  10.499  -2.209 -13.220
   19   2HG2  VAL   2          HG22      VAL   2  10.871  -0.514 -12.910
   20   3HG2  VAL   2          HG23      VAL   2   9.244  -1.128 -12.616
   21    HA   PRO   3           HA       PRO   3  11.275  -0.446  -6.087
   22   1HB   PRO   3          HB2       PRO   3   8.747  -1.689  -5.248
   23   2HB   PRO   3          HB1       PRO   3   9.492  -0.183  -4.705
   24   1HG   PRO   3          HG2       PRO   3   7.283  -0.205  -6.244
   25   2HG   PRO   3          HG1       PRO   3   8.517   1.063  -6.379
   26   1HD   PRO   3          HD2       PRO   3   8.045  -1.322  -8.129
   27   2HD   PRO   3          HD1       PRO   3   8.481   0.339  -8.583
   28    H    LYS   4           HN       LYS   4  12.189  -2.017  -4.788
   29    HA   LYS   4           HA       LYS   4  12.927  -4.414  -5.859
   30   1HB   LYS   4          HB2       LYS   4  14.019  -3.302  -3.985
   31   2HB   LYS   4          HB1       LYS   4  12.657  -3.692  -2.959
   32   1HG   LYS   4          HG2       LYS   4  13.146  -6.060  -3.178
   33   2HG   LYS   4          HG1       LYS   4  14.508  -5.685  -4.244
   34   1HD   LYS   4          HD2       LYS   4  14.274  -4.484  -1.519
   35   2HD   LYS   4          HD1       LYS   4  14.995  -6.080  -1.750
   36   1HE   LYS   4          HE2       LYS   4  15.904  -3.519  -3.061
   37   2HE   LYS   4          HE1       LYS   4  16.683  -4.294  -1.685
   38   1HZ   LYS   4          HZ1       LYS   4  17.039  -6.261  -3.117
   39   2HZ   LYS   4          HZ2       LYS   4  17.856  -4.878  -3.657
   40   3HZ   LYS   4          HZ3       LYS   4  16.439  -5.380  -4.439
   41    H    GLY   5           HN       GLY   5  10.967  -4.331  -2.994
   42   1HA   GLY   5          HA2       GLY   5   8.658  -5.353  -3.193
   43   2HA   GLY   5          HA1       GLY   5   9.488  -6.662  -4.003
   44    H    LYS   6           HN       LYS   6  10.816  -5.016  -1.279
   45    HA   LYS   6           HA       LYS   6  11.148  -7.186   0.399
   46   1HB   LYS   6          HB2       LYS   6  12.040  -4.771   0.528
   47   2HB   LYS   6          HB1       LYS   6  10.510  -4.389   1.309
   48   1HG   LYS   6          HG2       LYS   6  12.289  -4.741   2.890
   49   2HG   LYS   6          HG1       LYS   6  11.011  -5.937   3.094
   50   1HD   LYS   6          HD2       LYS   6  12.325  -7.564   1.863
   51   2HD   LYS   6          HD1       LYS   6  13.593  -6.368   1.598
   52   1HE   LYS   6          HE2       LYS   6  14.194  -7.868   3.421
   53   2HE   LYS   6          HE1       LYS   6  13.974  -6.221   4.006
   54   1HZ   LYS   6          HZ1       LYS   6  11.989  -8.423   4.236
   55   2HZ   LYS   6          HZ2       LYS   6  11.772  -6.839   4.792
   56   3HZ   LYS   6          HZ3       LYS   6  12.957  -7.819   5.492
   57    H    TYR   7           HN       TYR   7   8.695  -4.675   0.630
   58    HA   TYR   7           HA       TYR   7   6.799  -6.630   1.675
   59   1HB   TYR   7          HB2       TYR   7   6.618  -3.638   1.927
   60   2HB   TYR   7          HB1       TYR   7   5.771  -4.866   2.866
   61    HD1  TYR   7           HD1      TYR   7   7.975  -6.671   3.486
   62    HD2  TYR   7           HD2      TYR   7   7.799  -2.440   3.492
   63    HE1  TYR   7           HE1      TYR   7   9.726  -6.631   5.134
   64    HE2  TYR   7           HE2      TYR   7   9.586  -2.349   5.143
   65    HH   TYR   7           HH       TYR   7  10.552  -3.841   6.908
   66    HA   PRO   8           HA       PRO   8   4.955  -5.681  -2.541
   67   1HB   PRO   8          HB2       PRO   8   3.740  -8.237  -1.537
   68   2HB   PRO   8          HB1       PRO   8   4.196  -7.790  -3.191
   69   1HG   PRO   8          HG2       PRO   8   5.743  -9.420  -1.824
   70   2HG   PRO   8          HG1       PRO   8   6.480  -8.107  -2.762
   71   1HD   PRO   8          HD2       PRO   8   6.014  -8.298   0.187
   72   2HD   PRO   8          HD1       PRO   8   7.410  -7.642  -0.694
   73    H    ILE   9           HN       ILE   9   3.684  -3.900  -1.750
   74    HA   ILE   9           HA       ILE   9   1.806  -4.369   0.356
   75    HB   ILE   9           HB       ILE   9   2.362  -2.210   0.604
   76   1HG1  ILE   9          HG12      ILE   9   0.115  -2.052  -1.415
   77   2HG1  ILE   9          HG11      ILE   9  -0.005  -2.054   0.341
   78   1HG2  ILE   9          HG21      ILE   9   3.949  -2.131  -1.182
   79   2HG2  ILE   9          HG22      ILE   9   2.956  -0.674  -1.231
   80   3HG2  ILE   9          HG23      ILE   9   2.664  -1.980  -2.380
   81   1HD1  ILE   9          HD11      ILE   9   1.039   0.130  -1.431
   82   2HD1  ILE   9          HD12      ILE   9   1.206   0.132   0.327
   83   3HD1  ILE   9          HD13      ILE   9  -0.398   0.153  -0.407
   84    H    SER  10           HN       SER  10  -0.091  -5.114   0.217
   85    HA   SER  10           HA       SER  10  -1.180  -5.633  -2.448
   86   1HB   SER  10          HB2       SER  10  -1.886  -6.982   0.161
   87   2HB   SER  10          HB1       SER  10  -2.240  -7.549  -1.477
   88    HG   SER  10           HG       SER  10   0.429  -7.054  -0.909
   89    H    VAL  11           HN       VAL  11  -2.678  -4.286  -3.051
   90    HA   VAL  11           HA       VAL  11  -4.669  -3.361  -1.083
   91    HB   VAL  11           HB       VAL  11  -4.438  -1.829  -3.589
   92   1HG1  VAL  11          HG11      VAL  11  -4.604  -1.056  -0.681
   93   2HG1  VAL  11          HG12      VAL  11  -5.956  -1.209  -1.804
   94   3HG1  VAL  11          HG13      VAL  11  -4.743   0.048  -2.049
   95   1HG2  VAL  11          HG21      VAL  11  -2.232  -1.706  -1.529
   96   2HG2  VAL  11          HG22      VAL  11  -2.479  -0.541  -2.833
   97   3HG2  VAL  11          HG23      VAL  11  -2.075  -2.217  -3.214
   98    H    CYS  12           HN       CYS  12  -6.711  -4.151  -1.462
   99    HA   CYS  12           HA       CYS  12  -7.265  -5.730  -3.748
  100   1HB   CYS  12          HB2       CYS  12  -8.488  -6.198  -1.729
  101   2HB   CYS  12          HB1       CYS  12  -9.140  -4.561  -1.689
  102    H    MET  13           HN       MET  13  -7.748  -5.131  -5.702
  103    HA   MET  13           HA       MET  13  -9.243  -2.631  -6.108
  104   1HB   MET  13          HB2       MET  13  -7.130  -3.845  -7.903
  105   2HB   MET  13          HB1       MET  13  -8.128  -2.463  -8.330
  106   1HG   MET  13          HG2       MET  13  -7.167  -1.169  -6.527
  107   2HG   MET  13          HG1       MET  13  -6.223  -2.562  -6.001
  108   1HE   MET  13          HE1       MET  13  -3.960  -1.219  -6.049
  109   2HE   MET  13          HE2       MET  13  -4.863   0.230  -6.490
  110   3HE   MET  13          HE3       MET  13  -3.435  -0.235  -7.416
  111    H    GLY  14           HN       GLY  14 -10.084  -5.458  -5.677
  112   1HA   GLY  14          HA2       GLY  14 -10.898  -6.583  -8.162
  113   2HA   GLY  14          HA1       GLY  14 -11.502  -7.035  -6.576
  114    H    THR  15           HN       THR  15 -13.387  -7.189  -8.295
  115    HA   THR  15           HA       THR  15 -14.580  -4.804  -9.198
  116    HB   THR  15           HB       THR  15 -15.059  -6.847 -10.348
  117    HG1  THR  15           HG1      THR  15 -16.999  -6.168 -10.776
  118   1HG2  THR  15          HG21      THR  15 -16.336  -7.821  -7.790
  119   2HG2  THR  15          HG22      THR  15 -14.866  -8.447  -8.537
  120   3HG2  THR  15          HG23      THR  15 -16.420  -8.646  -9.346
  121    H    ALA  16           HN       ALA  16 -15.245  -6.796  -6.336
  122    HA   ALA  16           HA       ALA  16 -17.596  -5.348  -5.607
  123   1HB   ALA  16          HB1       ALA  16 -17.238  -7.694  -4.982
  124   2HB   ALA  16          HB2       ALA  16 -17.568  -6.671  -3.584
  125   3HB   ALA  16          HB3       ALA  16 -15.920  -7.197  -3.921
  126    H    CYS  17           HN       CYS  17 -14.337  -5.494  -4.235
  127    HA   CYS  17           HA       CYS  17 -14.833  -3.671  -2.153
  128   1HB   CYS  17          HB2       CYS  17 -12.259  -4.566  -3.419
  129   2HB   CYS  17          HB1       CYS  17 -12.359  -3.649  -1.942
  130    H    PHE  18           HN       PHE  18 -13.802  -3.237  -5.447
  131    HA   PHE  18           HA       PHE  18 -12.620  -0.708  -5.356
  132   1HB   PHE  18          HB2       PHE  18 -12.578  -2.244  -7.304
  133   2HB   PHE  18          HB1       PHE  18 -14.275  -1.894  -7.593
  134    HD1  PHE  18           HD1      PHE  18 -10.910  -0.354  -7.479
  135    HD2  PHE  18           HD2      PHE  18 -14.920  -0.050  -8.867
  136    HE1  PHE  18           HE1      PHE  18 -10.274   1.567  -8.882
  137    HE2  PHE  18           HE2      PHE  18 -14.291   1.868 -10.274
  138    HZ   PHE  18           HZ       PHE  18 -11.949   2.642 -10.319
  139    H    VAL  19           HN       VAL  19 -15.933  -1.622  -5.102
  140    HA   VAL  19           HA       VAL  19 -17.132   0.680  -6.234
  141    HB   VAL  19           HB       VAL  19 -18.328  -1.283  -4.267
  142   1HG1  VAL  19          HG11      VAL  19 -20.480  -0.609  -5.224
  143   2HG1  VAL  19          HG12      VAL  19 -19.656   0.588  -6.224
  144   3HG1  VAL  19          HG13      VAL  19 -19.651   0.754  -4.469
  145   1HG2  VAL  19          HG21      VAL  19 -19.219  -2.414  -6.261
  146   2HG2  VAL  19          HG22      VAL  19 -17.456  -2.439  -6.210
  147   3HG2  VAL  19          HG23      VAL  19 -18.291  -1.314  -7.281
  148    H    LYS  20           HN       LYS  20 -15.716   0.102  -3.141
  149    HA   LYS  20           HA       LYS  20 -17.281   2.083  -1.734
  150   1HB   LYS  20          HB2       LYS  20 -14.722   0.669  -0.949
  151   2HB   LYS  20          HB1       LYS  20 -15.657   1.714   0.109
  152   1HG   LYS  20          HG2       LYS  20 -16.568  -0.906  -1.066
  153   2HG   LYS  20          HG1       LYS  20 -16.078  -0.614   0.604
  154   1HD   LYS  20          HD2       LYS  20 -17.952   1.160   0.601
  155   2HD   LYS  20          HD1       LYS  20 -18.532   0.322  -0.839
  156   1HE   LYS  20          HE2       LYS  20 -18.185  -0.803   1.933
  157   2HE   LYS  20          HE1       LYS  20 -19.689  -0.567   1.047
  158   1HZ   LYS  20          HZ1       LYS  20 -17.551  -2.547   0.489
  159   2HZ   LYS  20          HZ2       LYS  20 -18.796  -2.202  -0.609
  160   3HZ   LYS  20          HZ3       LYS  20 -19.166  -2.845   0.917
  161    H    GLY  21           HN       GLY  21 -15.271   2.577  -4.148
  162   1HA   GLY  21          HA2       GLY  21 -14.420   4.643  -4.839
  163   2HA   GLY  21          HA1       GLY  21 -14.569   5.228  -3.183
  164    H    ALA  22           HN       ALA  22 -12.942   2.271  -4.120
  165    HA   ALA  22           HA       ALA  22 -10.815   2.916  -2.343
  166   1HB   ALA  22          HB1       ALA  22 -11.659   0.643  -2.587
  167   2HB   ALA  22          HB2       ALA  22  -9.932   0.720  -2.937
  168   3HB   ALA  22          HB3       ALA  22 -11.096   0.605  -4.257
  169    H    ASP  23           HN       ASP  23 -11.280   3.423  -5.703
  170    HA   ASP  23           HA       ASP  23  -8.679   3.105  -6.662
  171   1HB   ASP  23          HB2       ASP  23 -10.629   3.424  -8.131
  172   2HB   ASP  23          HB1       ASP  23 -10.752   5.102  -7.596
  173    H    LYS  24           HN       LYS  24 -10.229   5.949  -5.170
  174    HA   LYS  24           HA       LYS  24  -8.084   7.697  -5.803
  175   1HB   LYS  24          HB2       LYS  24 -10.094   7.955  -3.555
  176   2HB   LYS  24          HB1       LYS  24  -9.111   9.252  -4.224
  177   1HG   LYS  24          HG2       LYS  24 -10.251   9.106  -6.326
  178   2HG   LYS  24          HG1       LYS  24 -11.158   7.695  -5.780
  179   1HD   LYS  24          HD2       LYS  24 -12.679   9.417  -5.505
  180   2HD   LYS  24          HD1       LYS  24 -11.990   9.253  -3.893
  181   1HE   LYS  24          HE2       LYS  24 -11.026  11.256  -5.929
  182   2HE   LYS  24          HE1       LYS  24 -12.251  11.616  -4.717
  183   1HZ   LYS  24          HZ1       LYS  24 -10.588  11.016  -3.003
  184   2HZ   LYS  24          HZ2       LYS  24 -10.147  12.371  -3.926
  185   3HZ   LYS  24          HZ3       LYS  24  -9.417  10.873  -4.221
  186    H    VAL  25           HN       VAL  25  -8.773   5.722  -2.951
  187    HA   VAL  25           HA       VAL  25  -6.649   6.821  -1.421
  188    HB   VAL  25           HB       VAL  25  -7.012   4.711  -0.077
  189   1HG1  VAL  25          HG11      VAL  25  -9.262   6.666  -0.491
  190   2HG1  VAL  25          HG12      VAL  25  -7.880   6.878   0.585
  191   3HG1  VAL  25          HG13      VAL  25  -9.079   5.631   0.926
  192   1HG2  VAL  25          HG21      VAL  25  -9.426   4.495  -1.832
  193   2HG2  VAL  25          HG22      VAL  25  -9.144   3.577  -0.355
  194   3HG2  VAL  25          HG23      VAL  25  -8.094   3.344  -1.752
  195    H    VAL  26           HN       VAL  26  -6.992   3.986  -3.491
  196    HA   VAL  26           HA       VAL  26  -4.373   3.053  -2.931
  197    HB   VAL  26           HB       VAL  26  -4.510   1.614  -4.841
  198   1HG1  VAL  26          HG11      VAL  26  -7.221   1.862  -3.558
  199   2HG1  VAL  26          HG12      VAL  26  -5.851   0.928  -2.955
  200   3HG1  VAL  26          HG13      VAL  26  -6.639   0.464  -4.463
  201   1HG2  VAL  26          HG21      VAL  26  -6.371   1.753  -6.464
  202   2HG2  VAL  26          HG22      VAL  26  -5.273   3.132  -6.529
  203   3HG2  VAL  26          HG23      VAL  26  -6.840   3.291  -5.734
  204    H    HIS  27           HN       HIS  27  -5.663   5.443  -5.203
  205    HA   HIS  27           HA       HIS  27  -3.275   5.861  -6.640
  206   1HB   HIS  27          HB2       HIS  27  -5.512   6.847  -7.247
  207   2HB   HIS  27          HB1       HIS  27  -5.284   7.996  -5.924
  208    HD1  HIS  27           HD1      HIS  27  -3.420   9.799  -6.231
  209    HD2  HIS  27           HD2      HIS  27  -4.021   7.347  -9.534
  210    HE1  HIS  27           HE1      HIS  27  -2.136  10.863  -8.106
  211    HE2  HIS  27           HE2      HIS  27  -2.369   9.273 -10.048
  212    H    ALA  28           HN       ALA  28  -4.462   7.089  -3.636
  213    HA   ALA  28           HA       ALA  28  -2.420   8.869  -3.006
  214   1HB   ALA  28          HB1       ALA  28  -2.979   8.485  -0.657
  215   2HB   ALA  28          HB2       ALA  28  -3.910   7.057  -1.108
  216   3HB   ALA  28          HB3       ALA  28  -4.433   8.653  -1.641
  217    H    PHE  29           HN       PHE  29  -2.614   5.352  -2.460
  218    HA   PHE  29           HA       PHE  29  -0.191   4.878  -1.260
  219   1HB   PHE  29          HB2       PHE  29  -1.857   3.327  -3.215
  220   2HB   PHE  29          HB1       PHE  29  -0.330   2.701  -2.627
  221    HD1  PHE  29           HD1      PHE  29  -0.160   3.201   0.082
  222    HD2  PHE  29           HD2      PHE  29  -3.648   2.356  -2.187
  223    HE1  PHE  29           HE1      PHE  29  -1.246   2.340   2.091
  224    HE2  PHE  29           HE2      PHE  29  -4.752   1.483  -0.170
  225    HZ   PHE  29           HZ       PHE  29  -3.548   1.474   1.978
  226    H    LYS  30           HN       LYS  30  -0.942   5.017  -4.728
  227    HA   LYS  30           HA       LYS  30   1.539   4.469  -5.791
  228   1HB   LYS  30          HB2       LYS  30  -0.411   4.691  -7.194
  229   2HB   LYS  30          HB1       LYS  30  -0.553   6.393  -6.785
  230   1HG   LYS  30          HG2       LYS  30   0.340   6.143  -9.008
  231   2HG   LYS  30          HG1       LYS  30   1.567   6.831  -7.945
  232   1HD   LYS  30          HD2       LYS  30   2.665   4.688  -7.756
  233   2HD   LYS  30          HD1       LYS  30   1.387   3.915  -8.699
  234   1HE   LYS  30          HE2       LYS  30   1.985   5.239 -10.641
  235   2HE   LYS  30          HE1       LYS  30   3.204   6.103  -9.706
  236   1HZ   LYS  30          HZ1       LYS  30   3.290   3.162 -10.087
  237   2HZ   LYS  30          HZ2       LYS  30   4.534   4.189  -9.565
  238   3HZ   LYS  30          HZ3       LYS  30   4.015   4.239 -11.174
  239    H    GLU  31           HN       GLU  31   0.304   7.590  -4.839
  240    HA   GLU  31           HA       GLU  31   2.792   8.932  -5.508
  241   1HB   GLU  31          HB2       GLU  31   0.349  10.008  -4.093
  242   2HB   GLU  31          HB1       GLU  31   1.653  10.967  -4.781
  243   1HG   GLU  31          HG2       GLU  31  -0.161   9.176  -6.376
  244   2HG   GLU  31          HG1       GLU  31  -0.403  10.908  -6.158
  245    H    GLN  32           HN       GLN  32   1.296   7.676  -2.701
  246    HA   GLN  32           HA       GLN  32   2.866   9.073  -0.844
  247   1HB   GLN  32          HB2       GLN  32   1.774   7.906   0.746
  248   2HB   GLN  32          HB1       GLN  32   0.628   7.755  -0.561
  249   1HG   GLN  32          HG2       GLN  32   0.967   5.567  -0.816
  250   2HG   GLN  32          HG1       GLN  32   2.682   5.697  -0.430
  251   1HE2  GLN  32          HE21      GLN  32   2.364   7.043   2.035
  252   2HE2  GLN  32          HE22      GLN  32   1.662   5.943   3.161
  253    H    LEU  33           HN       LEU  33   3.417   6.316  -2.892
  254    HA   LEU  33           HA       LEU  33   5.617   5.196  -1.610
  255   1HB   LEU  33          HB2       LEU  33   4.546   4.624  -3.919
  256   2HB   LEU  33          HB1       LEU  33   5.698   5.800  -4.542
  257    HG   LEU  33           HG       LEU  33   6.135   3.110  -3.445
  258   1HD1  LEU  33          HD11      LEU  33   7.621   2.817  -5.166
  259   2HD1  LEU  33          HD12      LEU  33   7.863   4.554  -5.376
  260   3HD1  LEU  33          HD13      LEU  33   6.330   3.801  -5.873
  261   1HD2  LEU  33          HD21      LEU  33   7.417   4.278  -1.853
  262   2HD2  LEU  33          HD22      LEU  33   8.113   5.302  -3.111
  263   3HD2  LEU  33          HD23      LEU  33   8.525   3.585  -3.042
  264    H    LYS  34           HN       LYS  34   5.462   7.687  -3.988
  265    HA   LYS  34           HA       LYS  34   6.337   9.760  -4.127
  266   1HB   LYS  34          HB2       LYS  34   6.623  10.963  -2.177
  267   2HB   LYS  34          HB1       LYS  34   5.668   9.591  -1.640
  268   1HG   LYS  34          HG2       LYS  34   7.218   9.801   0.046
  269   2HG   LYS  34          HG1       LYS  34   7.929   8.538  -0.966
  270   1HD   LYS  34          HD2       LYS  34   9.329  10.315  -2.040
  271   2HD   LYS  34          HD1       LYS  34   8.687  11.465  -0.866
  272   1HE   LYS  34          HE2       LYS  34  10.329   8.999  -0.289
  273   2HE   LYS  34          HE1       LYS  34  10.837  10.678  -0.116
  274   1HZ   LYS  34          HZ1       LYS  34   8.857   9.201   1.521
  275   2HZ   LYS  34          HZ2       LYS  34   8.975  10.886   1.556
  276   3HZ   LYS  34          HZ3       LYS  34  10.296   9.934   2.030
  277    H    ILE  35           HN       ILE  35   8.201   7.245  -2.998
  278    HA   ILE  35           HA       ILE  35  10.067   6.288  -3.646
  279    HB   ILE  35           HB       ILE  35  10.507   7.719  -6.124
  280   1HG1  ILE  35          HG12      ILE  35   7.927   6.234  -5.911
  281   2HG1  ILE  35          HG11      ILE  35   7.951   7.979  -5.662
  282   1HG2  ILE  35          HG21      ILE  35  10.177   5.389  -6.954
  283   2HG2  ILE  35          HG22      ILE  35   9.757   4.927  -5.295
  284   3HG2  ILE  35          HG23      ILE  35  11.377   5.526  -5.669
  285   1HD1  ILE  35          HD11      ILE  35   7.315   7.440  -7.931
  286   2HD1  ILE  35          HD12      ILE  35   8.795   6.506  -8.148
  287   3HD1  ILE  35          HD13      ILE  35   8.879   8.251  -7.917
  288    H    ASP  36           HN       ASP  36  12.232   6.899  -4.969
  289    HA   ASP  36           HA       ASP  36  13.559   9.193  -3.864
  290   1HB   ASP  36          HB2       ASP  36  13.335   7.439  -1.990
  291   2HB   ASP  36          HB1       ASP  36  14.439   6.454  -2.936
  292    H    ILE  37           HN       ILE  37  13.675   5.966  -5.109
  293    HA   ILE  37           HA       ILE  37  15.407   6.575  -7.334
  294    HB   ILE  37           HB       ILE  37  17.076   4.828  -6.577
  295   1HG1  ILE  37          HG12      ILE  37  15.643   5.457  -4.052
  296   2HG1  ILE  37          HG11      ILE  37  15.931   3.880  -4.780
  297   1HG2  ILE  37          HG21      ILE  37  18.482   6.423  -5.345
  298   2HG2  ILE  37          HG22      ILE  37  17.089   7.497  -5.195
  299   3HG2  ILE  37          HG23      ILE  37  17.757   7.133  -6.788
  300   1HD1  ILE  37          HD11      ILE  37  17.320   4.144  -2.822
  301   2HD1  ILE  37          HD12      ILE  37  18.006   5.635  -3.471
  302   3HD1  ILE  37          HD13      ILE  37  18.328   4.094  -4.268
  303    H    GLY  38           HN       GLY  38  12.999   4.869  -6.054
  304   1HA   GLY  38          HA2       GLY  38  12.957   2.555  -7.583
  305   2HA   GLY  38          HA1       GLY  38  13.852   2.197  -6.087
  306    H    ASP  39           HN       ASP  39  12.864   3.476  -4.252
  307    HA   ASP  39           HA       ASP  39  10.116   3.916  -4.078
  308   1HB   ASP  39          HB2       ASP  39   9.378   1.911  -3.678
  309   2HB   ASP  39          HB1       ASP  39  10.987   1.230  -3.771
  310    H    VAL  40           HN       VAL  40   9.737   5.151  -2.715
  311    HA   VAL  40           HA       VAL  40   9.834   6.626  -1.024
  312    HB   VAL  40           HB       VAL  40   8.639   4.815  -0.078
  313   1HG1  VAL  40          HG11      VAL  40  11.116   3.708   1.148
  314   2HG1  VAL  40          HG12      VAL  40  10.371   3.052  -0.309
  315   3HG1  VAL  40          HG13      VAL  40   9.480   3.055   1.215
  316   1HG2  VAL  40          HG21      VAL  40   9.010   5.192   2.266
  317   2HG2  VAL  40          HG22      VAL  40   9.095   6.695   1.341
  318   3HG2  VAL  40          HG23      VAL  40  10.577   5.899   1.884
  319    H    THR  41           HN       THR  41  12.183   4.331  -0.132
  320    HA   THR  41           HA       THR  41  14.267   6.319   0.129
  321    HB   THR  41           HB       THR  41  13.445   4.781   2.594
  322    HG1  THR  41           HG1      THR  41  12.857   7.354   1.663
  323   1HG2  THR  41          HG21      THR  41  15.139   6.155   3.722
  324   2HG2  THR  41          HG22      THR  41  15.578   6.881   2.176
  325   3HG2  THR  41          HG23      THR  41  15.854   5.161   2.453
  326    HA   PRO  42           HA       PRO  42  16.295   2.256   0.504
  327   1HB   PRO  42          HB2       PRO  42  14.669   0.044   1.283
  328   2HB   PRO  42          HB1       PRO  42  15.875   0.898   2.249
  329   1HG   PRO  42          HG2       PRO  42  13.160   0.961   2.728
  330   2HG   PRO  42          HG1       PRO  42  14.307   2.202   3.264
  331   1HD   PRO  42          HD2       PRO  42  12.530   2.193   0.852
  332   2HD   PRO  42          HD1       PRO  42  12.869   3.513   1.993
  333    H    ASP  43           HN       ASP  43  13.669   2.493  -1.568
  334    HA   ASP  43           HA       ASP  43  14.123   2.246  -3.832
  335   1HB   ASP  43          HB2       ASP  43  16.514   1.953  -3.467
  336   2HB   ASP  43          HB1       ASP  43  16.262   0.302  -2.923
  337    H    GLY  44           HN       GLY  44  13.064   0.210  -1.537
  338   1HA   GLY  44          HA2       GLY  44  11.023  -0.696  -3.102
  339   2HA   GLY  44          HA1       GLY  44  12.220  -1.989  -3.158
  340    H    ARG  45           HN       ARG  45  11.062   0.195  -0.581
  341    HA   ARG  45           HA       ARG  45  10.686  -1.964   1.244
  342   1HB   ARG  45          HB2       ARG  45  10.383   0.946   1.215
  343   2HB   ARG  45          HB1       ARG  45   9.128   0.122   2.136
  344   1HG   ARG  45          HG2       ARG  45  10.932  -1.086   3.369
  345   2HG   ARG  45          HG1       ARG  45  12.099  -0.050   2.546
  346   1HD   ARG  45          HD2       ARG  45  10.800   1.914   3.478
  347   2HD   ARG  45          HD1       ARG  45   9.951   0.750   4.494
  348    HE   ARG  45           HE       ARG  45  12.704   0.353   4.807
  349   1HH1  ARG  45          HH11      ARG  45  10.192   2.650   5.623
  350   2HH1  ARG  45          HH12      ARG  45  11.111   3.382   6.909
  351   1HH2  ARG  45          HH21      ARG  45  13.908   1.292   6.514
  352   2HH2  ARG  45          HH22      ARG  45  13.203   2.591   7.440
  353    H    PHE  46           HN       PHE  46   8.441   0.162  -0.607
  354    HA   PHE  46           HA       PHE  46   6.614  -2.089  -0.497
  355   1HB   PHE  46          HB2       PHE  46   4.791  -0.735  -0.050
  356   2HB   PHE  46          HB1       PHE  46   6.009  -0.376   1.135
  357    HD1  PHE  46           HD1      PHE  46   7.593   1.816  -0.291
  358    HD2  PHE  46           HD2      PHE  46   3.412   0.996  -0.115
  359    HE1  PHE  46           HE1      PHE  46   7.057   4.269  -0.477
  360    HE2  PHE  46           HE2      PHE  46   2.907   3.356  -0.301
  361    HZ   PHE  46           HZ       PHE  46   4.718   4.979  -0.459
  362    H    SER  47           HN       SER  47   6.075  -2.838  -2.277
  363    HA   SER  47           HA       SER  47   5.864  -1.138  -4.679
  364   1HB   SER  47          HB2       SER  47   6.222  -3.279  -5.954
  365   2HB   SER  47          HB1       SER  47   7.613  -2.806  -4.975
  366    HG   SER  47           HG       SER  47   5.620  -4.679  -4.191
  367    H    ILE  48           HN       ILE  48   3.836  -0.669  -4.983
  368    HA   ILE  48           HA       ILE  48   1.775  -2.049  -3.603
  369    HB   ILE  48           HB       ILE  48   0.282  -0.356  -4.648
  370   1HG1  ILE  48          HG12      ILE  48   2.013   1.527  -5.684
  371   2HG1  ILE  48          HG11      ILE  48   2.625   0.017  -6.357
  372   1HG2  ILE  48          HG21      ILE  48   2.805   0.754  -3.430
  373   2HG2  ILE  48          HG22      ILE  48   1.409   0.137  -2.549
  374   3HG2  ILE  48          HG23      ILE  48   1.257   1.590  -3.536
  375   1HD1  ILE  48          HD11      ILE  48   0.998   1.101  -7.808
  376   2HD1  ILE  48          HD12      ILE  48  -0.211   0.971  -6.527
  377   3HD1  ILE  48          HD13      ILE  48   0.460  -0.487  -7.261
  378    H    ASP  49           HN       ASP  49   0.787  -3.870  -4.277
  379    HA   ASP  49           HA       ASP  49  -0.517  -3.718  -6.843
  380   1HB   ASP  49          HB2       ASP  49   0.269  -5.736  -7.831
  381   2HB   ASP  49          HB1       ASP  49   1.678  -4.774  -7.410
  382    H    THR  50           HN       THR  50  -2.297  -4.723  -6.962
  383    HA   THR  50           HA       THR  50  -3.951  -5.543  -5.030
  384    HB   THR  50           HB       THR  50  -3.896  -6.671  -7.821
  385    HG1  THR  50           HG1      THR  50  -4.817  -4.182  -6.775
  386   1HG2  THR  50          HG21      THR  50  -6.169  -6.136  -5.905
  387   2HG2  THR  50          HG22      THR  50  -5.569  -7.722  -6.392
  388   3HG2  THR  50          HG23      THR  50  -6.344  -6.668  -7.577
  389    H    LEU  51           HN       LEU  51  -1.564  -7.816  -6.496
  390    HA   LEU  51           HA       LEU  51  -3.399  -9.865  -6.785
  391   1HB   LEU  51          HB2       LEU  51  -0.413 -10.026  -6.551
  392   2HB   LEU  51          HB1       LEU  51  -1.434 -11.352  -7.076
  393    HG   LEU  51           HG       LEU  51  -1.135  -8.692  -8.474
  394   1HD1  LEU  51          HD11      LEU  51  -0.162 -11.448  -9.215
  395   2HD1  LEU  51          HD12      LEU  51   0.839 -10.090  -8.696
  396   3HD1  LEU  51          HD13      LEU  51  -0.039 -10.005 -10.223
  397   1HD2  LEU  51          HD21      LEU  51  -3.381  -9.588  -8.747
  398   2HD2  LEU  51          HD22      LEU  51  -2.717 -11.145  -9.239
  399   3HD2  LEU  51          HD23      LEU  51  -2.474  -9.723 -10.253
  400    H    ARG  52           HN       ARG  52  -1.187  -9.515  -3.963
  401    HA   ARG  52           HA       ARG  52  -1.858 -12.021  -2.830
  402   1HB   ARG  52          HB2       ARG  52   0.066 -10.570  -2.160
  403   2HB   ARG  52          HB1       ARG  52  -1.074  -9.509  -1.349
  404   1HG   ARG  52          HG2       ARG  52  -0.057 -10.911   0.280
  405   2HG   ARG  52          HG1       ARG  52  -1.736 -11.420   0.091
  406   1HD   ARG  52          HD2       ARG  52  -1.094 -13.315  -1.205
  407   2HD   ARG  52          HD1       ARG  52   0.568 -12.739  -1.334
  408    HE   ARG  52           HE       ARG  52   0.660 -13.065   1.164
  409   1HH1  ARG  52          HH11      ARG  52  -1.414 -14.993  -0.911
  410   2HH1  ARG  52          HH12      ARG  52  -1.506 -16.321   0.210
  411   1HH2  ARG  52          HH21      ARG  52   0.578 -14.818   2.612
  412   2HH2  ARG  52          HH22      ARG  52  -0.408 -16.208   2.231
  413    H    CYS  53           HN       CYS  53  -2.965  -8.831  -1.980
  414    HA   CYS  53           HA       CYS  53  -5.148  -9.547  -0.365
  415   1HB   CYS  53          HB2       CYS  53  -3.948  -7.377  -0.247
  416   2HB   CYS  53          HB1       CYS  53  -4.697  -6.924  -1.776
  417    H    VAL  54           HN       VAL  54  -7.446  -8.352  -1.111
  418    HA   VAL  54           HA       VAL  54  -9.374  -8.952  -2.161
  419    HB   VAL  54           HB       VAL  54  -7.785 -10.142  -4.446
  420   1HG1  VAL  54          HG11      VAL  54  -9.795  -9.700  -5.760
  421   2HG1  VAL  54          HG12      VAL  54 -10.592  -9.042  -4.331
  422   3HG1  VAL  54          HG13      VAL  54 -10.151 -10.750  -4.388
  423   1HG2  VAL  54          HG21      VAL  54  -7.070  -7.833  -4.160
  424   2HG2  VAL  54          HG22      VAL  54  -8.752  -7.301  -4.174
  425   3HG2  VAL  54          HG23      VAL  54  -8.041  -8.017  -5.622
  426    H    GLY  55           HN       GLY  55  -7.768 -10.538  -0.395
  427   1HA   GLY  55          HA2       GLY  55  -8.859 -13.198  -1.013
  428   2HA   GLY  55          HA1       GLY  55  -7.485 -12.909   0.044
  429    H    GLY  56           HN       GLY  56 -10.870 -11.647  -0.161
  430   1HA   GLY  56          HA2       GLY  56 -12.592 -11.847   1.355
  431   2HA   GLY  56          HA1       GLY  56 -11.746 -13.245   1.980
  432    H    CYS  57           HN       CYS  57 -11.371  -9.613   2.191
  433    HA   CYS  57           HA       CYS  57 -10.426 -10.097   4.982
  434   1HB   CYS  57          HB2       CYS  57  -9.226  -7.919   3.407
  435   2HB   CYS  57          HB1       CYS  57  -8.503  -8.936   4.611
  436    H    ALA  58           HN       ALA  58 -11.877  -8.031   2.562
  437    HA   ALA  58           HA       ALA  58 -11.321  -5.516   3.407
  438   1HB   ALA  58          HB1       ALA  58 -13.202  -4.765   2.092
  439   2HB   ALA  58          HB2       ALA  58 -13.866  -6.398   2.084
  440   3HB   ALA  58          HB3       ALA  58 -12.335  -6.065   1.275
  441    H    LEU  59           HN       LEU  59 -13.771  -7.557   4.966
  442    HA   LEU  59           HA       LEU  59 -15.117  -5.326   6.164
  443   1HB   LEU  59          HB2       LEU  59 -15.027  -8.217   7.024
  444   2HB   LEU  59          HB1       LEU  59 -16.119  -7.008   7.669
  445    HG   LEU  59           HG       LEU  59 -16.077  -7.996   4.814
  446   1HD1  LEU  59          HD11      LEU  59 -16.919  -9.672   6.360
  447   2HD1  LEU  59          HD12      LEU  59 -18.231  -9.014   5.382
  448   3HD1  LEU  59          HD13      LEU  59 -18.032  -8.493   7.056
  449   1HD2  LEU  59          HD21      LEU  59 -18.149  -6.702   4.567
  450   2HD2  LEU  59          HD22      LEU  59 -16.768  -5.666   4.935
  451   3HD2  LEU  59          HD23      LEU  59 -17.936  -6.061   6.196
  452    H    ALA  60           HN       ALA  60 -12.036  -6.309   6.606
  453    HA   ALA  60           HA       ALA  60 -11.958  -4.909   9.202
  454   1HB   ALA  60          HB1       ALA  60  -9.866  -6.686   7.920
  455   2HB   ALA  60          HB2       ALA  60 -10.871  -7.099   9.310
  456   3HB   ALA  60          HB3       ALA  60  -9.672  -5.814   9.440
  457    HA   PRO  61           HA       PRO  61  -9.771  -1.787   6.710
  458   1HB   PRO  61          HB2       PRO  61  -7.930  -1.160   8.878
  459   2HB   PRO  61          HB1       PRO  61  -9.204  -0.152   8.193
  460   1HG   PRO  61          HG2       PRO  61  -9.312  -1.210  10.709
  461   2HG   PRO  61          HG1       PRO  61 -10.747  -0.822   9.746
  462   1HD   PRO  61          HD2       PRO  61  -9.467  -3.472  10.263
  463   2HD   PRO  61          HD1       PRO  61 -11.188  -3.057  10.107
  464    H    ILE  62           HN       ILE  62  -8.366  -2.552   5.223
  465    HA   ILE  62           HA       ILE  62  -6.099  -4.163   6.155
  466    HB   ILE  62           HB       ILE  62  -7.823  -4.368   3.749
  467   1HG1  ILE  62          HG12      ILE  62  -7.363  -6.792   4.106
  468   2HG1  ILE  62          HG11      ILE  62  -6.326  -6.362   5.460
  469   1HG2  ILE  62          HG21      ILE  62  -5.705  -3.889   2.683
  470   2HG2  ILE  62          HG22      ILE  62  -6.112  -5.592   2.473
  471   3HG2  ILE  62          HG23      ILE  62  -4.902  -5.115   3.665
  472   1HD1  ILE  62          HD11      ILE  62  -8.242  -5.391   6.611
  473   2HD1  ILE  62          HD12      ILE  62  -8.505  -7.090   6.216
  474   3HD1  ILE  62          HD13      ILE  62  -9.277  -5.829   5.252
  475    H    VAL  63           HN       VAL  63  -4.079  -3.279   6.009
  476    HA   VAL  63           HA       VAL  63  -3.537  -2.247   3.314
  477    HB   VAL  63           HB       VAL  63  -1.866  -1.258   5.611
  478   1HG1  VAL  63          HG11      VAL  63  -2.501  -0.159   2.880
  479   2HG1  VAL  63          HG12      VAL  63  -1.027  -1.007   3.349
  480   3HG1  VAL  63          HG13      VAL  63  -1.398   0.570   4.048
  481   1HG2  VAL  63          HG21      VAL  63  -3.172   0.810   5.720
  482   2HG2  VAL  63          HG22      VAL  63  -4.135  -0.584   6.212
  483   3HG2  VAL  63          HG23      VAL  63  -4.357   0.121   4.609
  484    H    MET  64           HN       MET  64  -2.162  -3.818   2.392
  485    HA   MET  64           HA       MET  64  -0.563  -5.303   4.374
  486   1HB   MET  64          HB2       MET  64  -2.328  -6.479   2.946
  487   2HB   MET  64          HB1       MET  64  -1.267  -6.178   1.574
  488   1HG   MET  64          HG2       MET  64   0.433  -7.529   2.466
  489   2HG   MET  64          HG1       MET  64  -0.368  -7.587   4.038
  490   1HE   MET  64          HE1       MET  64  -0.636 -11.316   2.816
  491   2HE   MET  64          HE2       MET  64  -0.191 -10.268   4.162
  492   3HE   MET  64          HE3       MET  64   0.715 -10.194   2.652
  493    H    VAL  65           HN       VAL  65   1.657  -5.061   4.267
  494    HA   VAL  65           HA       VAL  65   2.726  -4.770   1.521
  495    HB   VAL  65           HB       VAL  65   4.888  -4.129   2.905
  496   1HG1  VAL  65          HG11      VAL  65   2.731  -2.098   2.406
  497   2HG1  VAL  65          HG12      VAL  65   3.868  -2.707   1.201
  498   3HG1  VAL  65          HG13      VAL  65   4.459  -1.780   2.582
  499   1HG2  VAL  65          HG21      VAL  65   3.965  -4.382   5.075
  500   2HG2  VAL  65          HG22      VAL  65   2.646  -3.275   4.692
  501   3HG2  VAL  65          HG23      VAL  65   4.300  -2.669   4.807
  502    H    GLY  66           HN       GLY  66   3.541  -6.724   0.912
  503   1HA   GLY  66          HA2       GLY  66   4.368  -8.842   1.058
  504   2HA   GLY  66          HA1       GLY  66   5.349  -8.215   2.401
  505    H    GLU  67           HN       GLU  67   4.944 -10.416   3.136
  506    HA   GLU  67           HA       GLU  67   2.415 -10.961   4.403
  507   1HB   GLU  67          HB2       GLU  67   5.132 -12.197   4.924
  508   2HB   GLU  67          HB1       GLU  67   3.591 -12.826   5.488
  509   1HG   GLU  67          HG2       GLU  67   4.438 -12.579   2.611
  510   2HG   GLU  67          HG1       GLU  67   4.447 -14.060   3.567
  511    H    LYS  68           HN       LYS  68   3.444  -8.396   4.943
  512    HA   LYS  68           HA       LYS  68   4.416  -8.542   7.701
  513   1HB   LYS  68          HB2       LYS  68   4.597  -6.148   5.865
  514   2HB   LYS  68          HB1       LYS  68   5.474  -6.417   7.364
  515   1HG   LYS  68          HG2       LYS  68   5.863  -8.044   4.849
  516   2HG   LYS  68          HG1       LYS  68   6.885  -6.676   5.311
  517   1HD   LYS  68          HD2       LYS  68   7.535  -7.835   7.351
  518   2HD   LYS  68          HD1       LYS  68   6.422  -9.157   6.994
  519   1HE   LYS  68          HE2       LYS  68   7.719  -9.638   4.947
  520   2HE   LYS  68          HE1       LYS  68   8.866  -8.378   5.408
  521   1HZ   LYS  68          HZ1       LYS  68   9.681 -10.525   6.088
  522   2HZ   LYS  68          HZ2       LYS  68   8.251 -10.852   6.935
  523   3HZ   LYS  68          HZ3       LYS  68   9.288  -9.620   7.469
  524    H    VAL  69           HN       VAL  69   1.900  -7.553   5.648
  525    HA   VAL  69           HA       VAL  69   0.026  -6.226   5.861
  526    HB   VAL  69           HB       VAL  69  -1.510  -7.047   7.639
  527   1HG1  VAL  69          HG11      VAL  69  -1.673  -9.303   6.726
  528   2HG1  VAL  69          HG12      VAL  69  -0.052  -9.152   6.051
  529   3HG1  VAL  69          HG13      VAL  69  -1.354  -8.120   5.459
  530   1HG2  VAL  69          HG21      VAL  69   0.123  -7.523   9.400
  531   2HG2  VAL  69          HG22      VAL  69   0.822  -8.805   8.410
  532   3HG2  VAL  69          HG23      VAL  69  -0.831  -8.953   9.008
  533    H    TYR  70           HN       TYR  70  -0.123  -4.110   6.212
  534    HA   TYR  70           HA       TYR  70   0.710  -3.083   8.841
  535   1HB   TYR  70          HB2       TYR  70   1.205  -1.925   6.087
  536   2HB   TYR  70          HB1       TYR  70   1.247  -0.924   7.543
  537    HD1  TYR  70           HD1      TYR  70   2.368  -4.452   7.592
  538    HD2  TYR  70           HD2      TYR  70   3.533  -0.373   7.353
  539    HE1  TYR  70           HE1      TYR  70   4.676  -5.082   8.011
  540    HE2  TYR  70           HE2      TYR  70   5.824  -0.986   7.806
  541    HH   TYR  70           HH       TYR  70   6.886  -4.316   7.782
  542    H    GLY  71           HN       GLY  71   0.048  -0.661   8.947
  543   1HA   GLY  71          HA2       GLY  71  -2.743  -0.307   8.132
  544   2HA   GLY  71          HA1       GLY  71  -2.274  -0.068   9.817
  545    H    ASN  72           HN       ASN  72  -0.641   0.739   6.784
  546    HA   ASN  72           HA       ASN  72  -0.062   3.401   7.714
  547   1HB   ASN  72          HB2       ASN  72   1.615   3.341   6.196
  548   2HB   ASN  72          HB1       ASN  72   1.158   1.671   5.893
  549   1HD2  ASN  72          HD21      ASN  72   0.970   4.928   4.785
  550   2HD2  ASN  72          HD22      ASN  72   0.326   4.574   3.214
  551    H    VAL  73           HN       VAL  73  -2.671   1.958   6.522
  552    HA   VAL  73           HA       VAL  73  -4.744   2.633   6.022
  553    HB   VAL  73           HB       VAL  73  -4.320   5.529   6.310
  554   1HG1  VAL  73          HG11      VAL  73  -6.270   5.268   7.788
  555   2HG1  VAL  73          HG12      VAL  73  -6.152   3.517   7.620
  556   3HG1  VAL  73          HG13      VAL  73  -6.531   4.513   6.216
  557   1HG2  VAL  73          HG21      VAL  73  -4.056   5.389   8.778
  558   2HG2  VAL  73          HG22      VAL  73  -2.639   4.806   7.897
  559   3HG2  VAL  73          HG23      VAL  73  -3.763   3.652   8.617
  560    H    THR  74           HN       THR  74  -5.745   4.955   4.692
  561    HA   THR  74           HA       THR  74  -4.398   4.655   2.119
  562    HB   THR  74           HB       THR  74  -6.304   3.897   0.931
  563    HG1  THR  74           HG1      THR  74  -7.943   3.827   3.241
  564   1HG2  THR  74          HG21      THR  74  -5.173   2.131   2.169
  565   2HG2  THR  74          HG22      THR  74  -6.908   1.812   2.103
  566   3HG2  THR  74          HG23      THR  74  -6.182   2.451   3.582
  567    HA   PRO  75           HA       PRO  75  -7.204   8.424   1.596
  568   1HB   PRO  75          HB2       PRO  75  -8.728   9.178   3.859
  569   2HB   PRO  75          HB1       PRO  75  -9.303   8.336   2.420
  570   1HG   PRO  75          HG2       PRO  75  -9.183   7.264   4.992
  571   2HG   PRO  75          HG1       PRO  75  -9.350   6.339   3.491
  572   1HD   PRO  75          HD2       PRO  75  -6.903   6.884   5.120
  573   2HD   PRO  75          HD1       PRO  75  -7.376   5.408   4.247
  574    H    GLY  76           HN       GLY  76  -5.011   9.322   1.794
  575   1HA   GLY  76          HA2       GLY  76  -3.872  11.296   2.208
  576   2HA   GLY  76          HA1       GLY  76  -5.131  11.743   3.347
  577    H    GLN  77           HN       GLN  77  -4.712   9.078   4.692
  578    HA   GLN  77           HA       GLN  77  -2.969  10.186   6.717
  579   1HB   GLN  77          HB2       GLN  77  -4.307   7.471   6.654
  580   2HB   GLN  77          HB1       GLN  77  -3.705   8.320   8.069
  581   1HG   GLN  77          HG2       GLN  77  -5.413  10.018   7.802
  582   2HG   GLN  77          HG1       GLN  77  -6.005   9.205   6.351
  583   1HE2  GLN  77          HE21      GLN  77  -6.967   7.141   6.563
  584   2HE2  GLN  77          HE22      GLN  77  -7.673   6.658   8.074
  585    H    VAL  78           HN       VAL  78  -2.915   8.227   4.097
  586    HA   VAL  78           HA       VAL  78  -1.106   6.259   4.410
  587    HB   VAL  78           HB       VAL  78  -0.547   7.060   1.959
  588   1HG1  VAL  78          HG11      VAL  78  -1.750   5.039   2.439
  589   2HG1  VAL  78          HG12      VAL  78  -2.634   5.943   1.193
  590   3HG1  VAL  78          HG13      VAL  78  -3.183   5.976   2.872
  591   1HG2  VAL  78          HG21      VAL  78  -3.209   8.304   2.207
  592   2HG2  VAL  78          HG22      VAL  78  -1.938   8.599   1.013
  593   3HG2  VAL  78          HG23      VAL  78  -1.787   9.240   2.655
  594    H    LYS  79           HN       LYS  79  -0.407   9.677   3.546
  595    HA   LYS  79           HA       LYS  79   2.279   9.104   2.905
  596   1HB   LYS  79          HB2       LYS  79   2.497  11.658   2.998
  597   2HB   LYS  79          HB1       LYS  79   1.399  10.970   1.812
  598   1HG   LYS  79          HG2       LYS  79  -0.501  11.472   3.263
  599   2HG   LYS  79          HG1       LYS  79   0.600  12.149   4.468
  600   1HD   LYS  79          HD2       LYS  79   1.284  13.880   2.922
  601   2HD   LYS  79          HD1       LYS  79   0.305  13.164   1.641
  602   1HE   LYS  79          HE2       LYS  79  -1.718  13.605   2.931
  603   2HE   LYS  79          HE1       LYS  79  -0.750  14.287   4.235
  604   1HZ   LYS  79          HZ1       LYS  79  -0.845  15.372   1.471
  605   2HZ   LYS  79          HZ2       LYS  79  -0.057  16.063   2.805
  606   3HZ   LYS  79          HZ3       LYS  79  -1.750  15.973   2.773
  607    H    LYS  80           HN       LYS  80   0.683  10.209   5.806
  608    HA   LYS  80           HA       LYS  80   3.272  10.684   7.063
  609   1HB   LYS  80          HB2       LYS  80   1.339  11.215   8.947
  610   2HB   LYS  80          HB1       LYS  80   2.091  12.401   7.898
  611   1HG   LYS  80          HG2       LYS  80  -0.144  12.827   7.589
  612   2HG   LYS  80          HG1       LYS  80   0.196  11.753   6.232
  613   1HD   LYS  80          HD2       LYS  80  -1.764  10.890   7.091
  614   2HD   LYS  80          HD1       LYS  80  -0.528   9.885   7.843
  615   1HE   LYS  80          HE2       LYS  80  -2.111  10.461   9.534
  616   2HE   LYS  80          HE1       LYS  80  -0.623  11.351   9.853
  617   1HZ   LYS  80          HZ1       LYS  80  -1.611  13.319   8.894
  618   2HZ   LYS  80          HZ2       LYS  80  -2.610  12.718  10.126
  619   3HZ   LYS  80          HZ3       LYS  80  -3.025  12.465   8.502
  620    H    ILE  81           HN       ILE  81   0.546   8.547   7.211
  621    HA   ILE  81           HA       ILE  81   1.682   7.056   9.377
  622    HB   ILE  81           HB       ILE  81  -0.379   6.162   7.355
  623   1HG1  ILE  81          HG12      ILE  81  -1.142   8.126   8.604
  624   2HG1  ILE  81          HG11      ILE  81  -2.014   6.695   9.142
  625   1HG2  ILE  81          HG21      ILE  81  -0.963   4.504   9.102
  626   2HG2  ILE  81          HG22      ILE  81   0.395   5.071  10.071
  627   3HG2  ILE  81          HG23      ILE  81   0.686   4.292   8.514
  628   1HD1  ILE  81          HD11      ILE  81   0.290   8.000  10.568
  629   2HD1  ILE  81          HD12      ILE  81  -0.572   6.560  11.105
  630   3HD1  ILE  81          HD13      ILE  81  -1.412   8.109  11.014
  631    H    LEU  82           HN       LEU  82   2.410   7.481   6.112
  632    HA   LEU  82           HA       LEU  82   3.681   5.074   5.381
  633   1HB   LEU  82          HB2       LEU  82   3.345   6.975   3.854
  634   2HB   LEU  82          HB1       LEU  82   4.444   7.958   4.801
  635    HG   LEU  82           HG       LEU  82   6.227   6.185   4.203
  636   1HD1  LEU  82          HD11      LEU  82   4.178   5.642   2.071
  637   2HD1  LEU  82          HD12      LEU  82   4.691   4.518   3.328
  638   3HD1  LEU  82          HD13      LEU  82   5.836   5.039   2.091
  639   1HD2  LEU  82          HD21      LEU  82   6.747   7.349   2.135
  640   2HD2  LEU  82          HD22      LEU  82   6.192   8.487   3.363
  641   3HD2  LEU  82          HD23      LEU  82   5.105   7.991   2.065
  642    H    ALA  83           HN       ALA  83   4.534   7.398   7.852
  643    HA   ALA  83           HA       ALA  83   7.118   6.609   8.413
  644   1HB   ALA  83          HB1       ALA  83   6.623   6.928  10.759
  645   2HB   ALA  83          HB2       ALA  83   4.896   6.755  10.446
  646   3HB   ALA  83          HB3       ALA  83   5.771   8.147   9.809
  647    H    GLU  84           HN       GLU  84   4.222   4.698   8.507
  648    HA   GLU  84           HA       GLU  84   5.197   2.328   9.652
  649   1HB   GLU  84          HB2       GLU  84   3.031   3.011   7.700
  650   2HB   GLU  84          HB1       GLU  84   3.387   1.346   8.100
  651   1HG   GLU  84          HG2       GLU  84   2.748   3.409  10.179
  652   2HG   GLU  84          HG1       GLU  84   1.506   2.453   9.369
  653    H    TYR  85           HN       TYR  85   5.052   3.484   6.287
  654    HA   TYR  85           HA       TYR  85   6.274   1.073   5.376
  655   1HB   TYR  85          HB2       TYR  85   4.921   3.384   4.057
  656   2HB   TYR  85          HB1       TYR  85   5.792   2.169   3.154
  657    HD1  TYR  85           HD1      TYR  85   4.664   0.575   5.825
  658    HD2  TYR  85           HD2      TYR  85   3.316   2.242   2.300
  659    HE1  TYR  85           HE1      TYR  85   2.911  -1.067   5.787
  660    HE2  TYR  85           HE2      TYR  85   1.501   0.631   2.277
  661    HH   TYR  85           HH       TYR  85   0.853  -1.469   3.084
  Start of MODEL    4
    1   1H    MET   1          HT1       MET   1   9.489  -9.065 -13.440
    2   2H    MET   1          HT2       MET   1  10.968  -8.267 -13.656
    3   3H    MET   1          HT3       MET   1   9.530  -7.375 -13.570
    4    HA   MET   1           HA       MET   1  10.676  -8.993 -11.372
    5   1HB   MET   1          HB2       MET   1  11.960  -6.920 -11.957
    6   2HB   MET   1          HB1       MET   1  10.500  -5.985 -11.666
    7   1HG   MET   1          HG2       MET   1  11.858  -5.814  -9.736
    8   2HG   MET   1          HG1       MET   1  10.494  -6.856  -9.333
    9   1HE   MET   1          HE1       MET   1  13.738  -7.710 -11.413
   10   2HE   MET   1          HE2       MET   1  14.780  -8.362 -10.148
   11   3HE   MET   1          HE3       MET   1  14.316  -6.661 -10.118
   12    H    VAL   2           HN       VAL   2   8.981  -9.825 -10.308
   13    HA   VAL   2           HA       VAL   2   6.441  -8.419 -10.273
   14    HB   VAL   2           HB       VAL   2   7.171 -11.015  -8.906
   15   1HG1  VAL   2          HG11      VAL   2   5.250  -9.903  -7.887
   16   2HG1  VAL   2          HG12      VAL   2   4.751 -11.357  -8.753
   17   3HG1  VAL   2          HG13      VAL   2   4.482  -9.767  -9.467
   18   1HG2  VAL   2          HG21      VAL   2   7.388 -11.162 -11.340
   19   2HG2  VAL   2          HG22      VAL   2   5.751 -10.531 -11.526
   20   3HG2  VAL   2          HG23      VAL   2   6.013 -12.098 -10.763
   21    HA   PRO   3           HA       PRO   3   7.567  -7.908  -5.628
   22   1HB   PRO   3          HB2       PRO   3  10.304  -8.883  -5.305
   23   2HB   PRO   3          HB1       PRO   3   8.861  -9.299  -4.378
   24   1HG   PRO   3          HG2       PRO   3  10.070 -11.052  -6.042
   25   2HG   PRO   3          HG1       PRO   3   8.316 -11.054  -5.767
   26   1HD   PRO   3          HD2       PRO   3   9.876  -9.906  -8.057
   27   2HD   PRO   3          HD1       PRO   3   8.364 -10.840  -8.083
   28    H    LYS   4           HN       LYS   4   7.728  -5.786  -5.918
   29    HA   LYS   4           HA       LYS   4   9.746  -4.487  -7.402
   30   1HB   LYS   4          HB2       LYS   4   7.816  -3.387  -5.361
   31   2HB   LYS   4          HB1       LYS   4   8.873  -2.393  -6.342
   32   1HG   LYS   4          HG2       LYS   4   6.729  -2.334  -7.344
   33   2HG   LYS   4          HG1       LYS   4   7.741  -3.352  -8.369
   34   1HD   LYS   4          HD2       LYS   4   6.764  -5.345  -7.423
   35   2HD   LYS   4          HD1       LYS   4   5.842  -4.385  -6.266
   36   1HE   LYS   4          HE2       LYS   4   4.540  -3.415  -8.044
   37   2HE   LYS   4          HE1       LYS   4   5.535  -4.220  -9.258
   38   1HZ   LYS   4          HZ1       LYS   4   3.854  -5.625  -7.241
   39   2HZ   LYS   4          HZ2       LYS   4   4.744  -6.342  -8.495
   40   3HZ   LYS   4          HZ3       LYS   4   3.417  -5.355  -8.861
   41    H    GLY   5           HN       GLY   5   9.115  -4.604  -3.965
   42   1HA   GLY   5          HA2       GLY   5  12.010  -4.441  -3.502
   43   2HA   GLY   5          HA1       GLY   5  10.864  -3.544  -2.512
   44    H    LYS   6           HN       LYS   6  11.040  -4.474  -0.590
   45    HA   LYS   6           HA       LYS   6  11.407  -7.276  -0.265
   46   1HB   LYS   6          HB2       LYS   6  11.135  -4.930   1.560
   47   2HB   LYS   6          HB1       LYS   6  11.332  -6.584   2.141
   48   1HG   LYS   6          HG2       LYS   6  13.416  -6.781   0.908
   49   2HG   LYS   6          HG1       LYS   6  13.192  -5.135   0.306
   50   1HD   LYS   6          HD2       LYS   6  13.218  -4.329   2.601
   51   2HD   LYS   6          HD1       LYS   6  13.548  -5.960   3.175
   52   1HE   LYS   6          HE2       LYS   6  15.290  -4.332   1.327
   53   2HE   LYS   6          HE1       LYS   6  15.607  -4.658   3.029
   54   1HZ   LYS   6          HZ1       LYS   6  15.380  -6.763   0.941
   55   2HZ   LYS   6          HZ2       LYS   6  15.853  -6.973   2.557
   56   3HZ   LYS   6          HZ3       LYS   6  16.849  -6.111   1.486
   57    H    TYR   7           HN       TYR   7   8.851  -4.947   0.467
   58    HA   TYR   7           HA       TYR   7   7.151  -7.172   1.283
   59   1HB   TYR   7          HB2       TYR   7   6.744  -4.272   1.939
   60   2HB   TYR   7          HB1       TYR   7   6.117  -5.691   2.783
   61    HD1  TYR   7           HD1      TYR   7   8.468  -7.352   3.070
   62    HD2  TYR   7           HD2      TYR   7   8.023  -3.156   3.443
   63    HE1  TYR   7           HE1      TYR   7  10.349  -7.312   4.613
   64    HE2  TYR   7           HE2      TYR   7   9.907  -3.066   4.943
   65    HH   TYR   7           HH       TYR   7  12.119  -5.512   5.331
   66    HA   PRO   8           HA       PRO   8   4.890  -6.108  -2.625
   67   1HB   PRO   8          HB2       PRO   8   3.541  -8.509  -1.429
   68   2HB   PRO   8          HB1       PRO   8   3.885  -8.153  -3.130
   69   1HG   PRO   8          HG2       PRO   8   5.395  -9.873  -1.815
   70   2HG   PRO   8          HG1       PRO   8   6.146  -8.693  -2.907
   71   1HD   PRO   8          HD2       PRO   8   6.033  -8.713   0.078
   72   2HD   PRO   8          HD1       PRO   8   7.335  -8.171  -0.999
   73    H    ILE   9           HN       ILE   9   3.907  -4.220  -1.850
   74    HA   ILE   9           HA       ILE   9   2.034  -4.369   0.308
   75    HB   ILE   9           HB       ILE   9   2.776  -2.278   0.489
   76   1HG1  ILE   9          HG12      ILE   9   0.636  -2.020  -1.610
   77   2HG1  ILE   9          HG11      ILE   9   0.533  -1.708   0.116
   78   1HG2  ILE   9          HG21      ILE   9   3.745  -0.940  -1.303
   79   2HG2  ILE   9          HG22      ILE   9   3.293  -2.185  -2.469
   80   3HG2  ILE   9          HG23      ILE   9   4.466  -2.545  -1.201
   81   1HD1  ILE   9          HD11      ILE   9   2.032   0.263  -0.245
   82   2HD1  ILE   9          HD12      ILE   9   0.445   0.372  -1.010
   83   3HD1  ILE   9          HD13      ILE   9   1.865  -0.018  -1.986
   84    H    SER  10           HN       SER  10   0.133  -5.043   0.165
   85    HA   SER  10           HA       SER  10  -1.134  -5.325  -2.441
   86   1HB   SER  10          HB2       SER  10  -2.006  -6.407   0.245
   87   2HB   SER  10          HB1       SER  10  -2.571  -6.921  -1.354
   88    HG   SER  10           HG       SER  10   0.073  -7.068  -1.341
   89    H    VAL  11           HN       VAL  11  -2.805  -4.156  -3.070
   90    HA   VAL  11           HA       VAL  11  -3.742  -2.102  -1.175
   91    HB   VAL  11           HB       VAL  11  -3.466  -1.821  -4.165
   92   1HG1  VAL  11          HG11      VAL  11  -3.734   0.586  -3.681
   93   2HG1  VAL  11          HG12      VAL  11  -4.077   0.183  -1.999
   94   3HG1  VAL  11          HG13      VAL  11  -5.167  -0.359  -3.275
   95   1HG2  VAL  11          HG21      VAL  11  -1.596  -0.213  -3.343
   96   2HG2  VAL  11          HG22      VAL  11  -1.280  -1.946  -3.470
   97   3HG2  VAL  11          HG23      VAL  11  -1.628  -1.229  -1.886
   98    H    CYS  12           HN       CYS  12  -5.841  -1.912  -0.789
   99    HA   CYS  12           HA       CYS  12  -7.663  -3.871  -1.652
  100   1HB   CYS  12          HB2       CYS  12  -7.937  -2.837   0.489
  101   2HB   CYS  12          HB1       CYS  12  -7.988  -1.233  -0.223
  102    H    MET  13           HN       MET  13  -8.447  -4.017  -3.621
  103    HA   MET  13           HA       MET  13  -9.780  -1.662  -4.766
  104   1HB   MET  13          HB2       MET  13  -8.292  -3.822  -6.270
  105   2HB   MET  13          HB1       MET  13  -9.322  -2.617  -7.030
  106   1HG   MET  13          HG2       MET  13  -7.860  -0.847  -6.146
  107   2HG   MET  13          HG1       MET  13  -6.805  -2.084  -5.469
  108   1HE   MET  13          HE1       MET  13  -8.718  -2.198  -8.913
  109   2HE   MET  13          HE2       MET  13  -7.513  -1.499  -9.995
  110   3HE   MET  13          HE3       MET  13  -8.261  -0.503  -8.747
  111    H    GLY  14           HN       GLY  14 -10.830  -3.798  -2.993
  112   1HA   GLY  14          HA2       GLY  14 -11.843  -5.959  -4.527
  113   2HA   GLY  14          HA1       GLY  14 -12.326  -5.550  -2.892
  114    H    THR  15           HN       THR  15 -14.305  -6.547  -4.212
  115    HA   THR  15           HA       THR  15 -15.597  -4.904  -6.105
  116    HB   THR  15           HB       THR  15 -16.033  -7.269  -6.087
  117    HG1  THR  15           HG1      THR  15 -18.556  -6.876  -5.544
  118   1HG2  THR  15          HG21      THR  15 -17.343  -6.868  -3.393
  119   2HG2  THR  15          HG22      THR  15 -15.825  -7.717  -3.691
  120   3HG2  THR  15          HG23      THR  15 -17.338  -8.364  -4.326
  121    H    ALA  16           HN       ALA  16 -16.222  -5.398  -2.649
  122    HA   ALA  16           HA       ALA  16 -18.317  -3.483  -2.489
  123   1HB   ALA  16          HB1       ALA  16 -16.544  -4.562  -0.299
  124   2HB   ALA  16          HB2       ALA  16 -18.053  -5.291  -0.849
  125   3HB   ALA  16          HB3       ALA  16 -18.069  -3.705  -0.077
  126    H    CYS  17           HN       CYS  17 -14.909  -3.472  -1.683
  127    HA   CYS  17           HA       CYS  17 -14.804  -0.983  -0.435
  128   1HB   CYS  17          HB2       CYS  17 -12.691  -2.581  -1.844
  129   2HB   CYS  17          HB1       CYS  17 -12.368  -1.222  -0.810
  130    H    PHE  18           HN       PHE  18 -14.373  -1.889  -3.823
  131    HA   PHE  18           HA       PHE  18 -13.170   0.474  -4.745
  132   1HB   PHE  18          HB2       PHE  18 -13.315  -1.686  -6.003
  133   2HB   PHE  18          HB1       PHE  18 -15.013  -1.344  -6.311
  134    HD1  PHE  18           HD1      PHE  18 -11.645   0.203  -6.737
  135    HD2  PHE  18           HD2      PHE  18 -15.585  -0.284  -8.273
  136    HE1  PHE  18           HE1      PHE  18 -11.012   1.461  -8.754
  137    HE2  PHE  18           HE2      PHE  18 -14.958   0.975 -10.289
  138    HZ   PHE  18           HZ       PHE  18 -12.670   1.850 -10.531
  139    H    VAL  19           HN       VAL  19 -16.479  -0.338  -4.085
  140    HA   VAL  19           HA       VAL  19 -17.677   1.819  -5.517
  141    HB   VAL  19           HB       VAL  19 -18.853   0.233  -3.225
  142   1HG1  VAL  19          HG11      VAL  19 -20.104   2.256  -3.750
  143   2HG1  VAL  19          HG12      VAL  19 -21.009   0.820  -4.226
  144   3HG1  VAL  19          HG13      VAL  19 -20.178   1.784  -5.447
  145   1HG2  VAL  19          HG21      VAL  19 -18.077  -1.280  -4.956
  146   2HG2  VAL  19          HG22      VAL  19 -18.918  -0.338  -6.186
  147   3HG2  VAL  19          HG23      VAL  19 -19.839  -1.208  -4.960
  148    H    LYS  20           HN       LYS  20 -16.098   1.527  -2.504
  149    HA   LYS  20           HA       LYS  20 -17.472   3.702  -1.187
  150   1HB   LYS  20          HB2       LYS  20 -15.014   2.119  -0.435
  151   2HB   LYS  20          HB1       LYS  20 -15.775   3.324   0.592
  152   1HG   LYS  20          HG2       LYS  20 -17.731   1.995   0.837
  153   2HG   LYS  20          HG1       LYS  20 -17.194   0.868  -0.410
  154   1HD   LYS  20          HD2       LYS  20 -16.864  -0.027   1.864
  155   2HD   LYS  20          HD1       LYS  20 -15.345   0.152   0.985
  156   1HE   LYS  20          HE2       LYS  20 -14.992   0.926   3.215
  157   2HE   LYS  20          HE1       LYS  20 -15.012   2.331   2.153
  158   1HZ   LYS  20          HZ1       LYS  20 -16.272   2.783   4.127
  159   2HZ   LYS  20          HZ2       LYS  20 -17.234   1.404   3.895
  160   3HZ   LYS  20          HZ3       LYS  20 -17.340   2.702   2.809
  161    H    GLY  21           HN       GLY  21 -15.604   3.943  -3.717
  162   1HA   GLY  21          HA2       GLY  21 -14.562   5.888  -4.510
  163   2HA   GLY  21          HA1       GLY  21 -14.486   6.488  -2.855
  164    H    ALA  22           HN       ALA  22 -13.357   3.346  -3.956
  165    HA   ALA  22           HA       ALA  22 -11.007   3.645  -2.385
  166   1HB   ALA  22          HB1       ALA  22 -10.446   1.399  -3.137
  167   2HB   ALA  22          HB2       ALA  22 -11.721   1.478  -4.351
  168   3HB   ALA  22          HB3       ALA  22 -12.135   1.494  -2.638
  169    H    ASP  23           HN       ASP  23 -11.739   4.304  -5.678
  170    HA   ASP  23           HA       ASP  23  -9.269   3.895  -6.891
  171   1HB   ASP  23          HB2       ASP  23 -11.276   4.477  -8.169
  172   2HB   ASP  23          HB1       ASP  23 -11.307   6.079  -7.425
  173    H    LYS  24           HN       LYS  24 -10.477   6.759  -5.150
  174    HA   LYS  24           HA       LYS  24  -8.173   8.300  -5.760
  175   1HB   LYS  24          HB2       LYS  24 -10.397   8.653  -3.761
  176   2HB   LYS  24          HB1       LYS  24  -9.042   9.770  -3.838
  177   1HG   LYS  24          HG2       LYS  24 -10.791  10.728  -5.105
  178   2HG   LYS  24          HG1       LYS  24  -9.596  10.132  -6.257
  179   1HD   LYS  24          HD2       LYS  24 -11.044   8.009  -6.347
  180   2HD   LYS  24          HD1       LYS  24 -12.292   8.998  -5.586
  181   1HE   LYS  24          HE2       LYS  24 -12.624   9.065  -7.957
  182   2HE   LYS  24          HE1       LYS  24 -12.028  10.640  -7.436
  183   1HZ   LYS  24          HZ1       LYS  24 -10.917   9.894  -9.447
  184   2HZ   LYS  24          HZ2       LYS  24 -10.382   8.487  -8.659
  185   3HZ   LYS  24          HZ3       LYS  24  -9.810  10.003  -8.166
  186    H    VAL  25           HN       VAL  25  -9.015   6.243  -3.011
  187    HA   VAL  25           HA       VAL  25  -6.864   7.168  -1.404
  188    HB   VAL  25           HB       VAL  25  -7.321   5.010  -0.171
  189   1HG1  VAL  25          HG11      VAL  25  -9.539   7.014  -0.504
  190   2HG1  VAL  25          HG12      VAL  25  -8.145   7.183   0.562
  191   3HG1  VAL  25          HG13      VAL  25  -9.346   5.931   0.873
  192   1HG2  VAL  25          HG21      VAL  25  -8.412   3.780  -1.951
  193   2HG2  VAL  25          HG22      VAL  25  -9.727   4.957  -1.946
  194   3HG2  VAL  25          HG23      VAL  25  -9.453   3.934  -0.535
  195    H    VAL  26           HN       VAL  26  -7.323   4.456  -3.616
  196    HA   VAL  26           HA       VAL  26  -4.763   3.366  -3.082
  197    HB   VAL  26           HB       VAL  26  -4.967   2.012  -5.034
  198   1HG1  VAL  26          HG11      VAL  26  -7.162   0.973  -4.719
  199   2HG1  VAL  26          HG12      VAL  26  -7.688   2.378  -3.797
  200   3HG1  VAL  26          HG13      VAL  26  -6.388   1.359  -3.183
  201   1HG2  VAL  26          HG21      VAL  26  -6.761   2.326  -6.694
  202   2HG2  VAL  26          HG22      VAL  26  -5.600   3.654  -6.662
  203   3HG2  VAL  26          HG23      VAL  26  -7.180   3.848  -5.903
  204    H    HIS  27           HN       HIS  27  -5.922   5.912  -5.263
  205    HA   HIS  27           HA       HIS  27  -3.536   6.252  -6.715
  206   1HB   HIS  27          HB2       HIS  27  -5.705   7.399  -7.261
  207   2HB   HIS  27          HB1       HIS  27  -5.415   8.467  -5.886
  208    HD1  HIS  27           HD1      HIS  27  -3.477  10.191  -6.103
  209    HD2  HIS  27           HD2      HIS  27  -4.185   7.945  -9.529
  210    HE1  HIS  27           HE1      HIS  27  -2.096  11.256  -7.904
  211    HE2  HIS  27           HE2      HIS  27  -2.751  10.039 -10.022
  212    H    ALA  28           HN       ALA  28  -4.585   7.447  -3.640
  213    HA   ALA  28           HA       ALA  28  -2.419   9.073  -2.997
  214   1HB   ALA  28          HB1       ALA  28  -3.948   7.272  -1.116
  215   2HB   ALA  28          HB2       ALA  28  -4.420   8.906  -1.581
  216   3HB   ALA  28          HB3       ALA  28  -2.942   8.645  -0.654
  217    H    PHE  29           HN       PHE  29  -2.877   5.584  -2.461
  218    HA   PHE  29           HA       PHE  29  -0.462   4.851  -1.376
  219   1HB   PHE  29          HB2       PHE  29  -2.561   3.580  -3.006
  220   2HB   PHE  29          HB1       PHE  29  -0.995   2.790  -3.060
  221    HD1  PHE  29           HD1      PHE  29   0.113   2.752  -0.569
  222    HD2  PHE  29           HD2      PHE  29  -4.024   2.665  -1.532
  223    HE1  PHE  29           HE1      PHE  29  -0.353   1.650   1.558
  224    HE2  PHE  29           HE2      PHE  29  -4.502   1.550   0.607
  225    HZ   PHE  29           HZ       PHE  29  -2.663   1.037   2.159
  226    H    LYS  30           HN       LYS  30  -1.315   5.175  -4.797
  227    HA   LYS  30           HA       LYS  30   0.994   4.306  -6.000
  228   1HB   LYS  30          HB2       LYS  30  -0.848   4.780  -7.373
  229   2HB   LYS  30          HB1       LYS  30  -1.018   6.401  -6.727
  230   1HG   LYS  30          HG2       LYS  30  -0.217   6.458  -9.004
  231   2HG   LYS  30          HG1       LYS  30   1.001   7.090  -7.900
  232   1HD   LYS  30          HD2       LYS  30   2.269   5.064  -8.038
  233   2HD   LYS  30          HD1       LYS  30   0.990   4.268  -8.961
  234   1HE   LYS  30          HE2       LYS  30   2.875   5.034 -10.367
  235   2HE   LYS  30          HE1       LYS  30   1.332   5.756 -10.819
  236   1HZ   LYS  30          HZ1       LYS  30   2.006   7.726  -9.461
  237   2HZ   LYS  30          HZ2       LYS  30   2.953   7.457 -10.840
  238   3HZ   LYS  30          HZ3       LYS  30   3.549   7.034  -9.312
  239    H    GLU  31           HN       GLU  31   0.265   7.598  -5.067
  240    HA   GLU  31           HA       GLU  31   2.984   8.459  -5.661
  241   1HB   GLU  31          HB2       GLU  31   0.697  10.039  -4.487
  242   2HB   GLU  31          HB1       GLU  31   2.178  10.699  -5.159
  243   1HG   GLU  31          HG2       GLU  31   0.013   9.252  -6.660
  244   2HG   GLU  31          HG1       GLU  31   0.390  10.973  -6.733
  245    H    GLN  32           HN       GLN  32   1.273   7.377  -2.967
  246    HA   GLN  32           HA       GLN  32   2.801   8.628  -0.972
  247   1HB   GLN  32          HB2       GLN  32   1.421   7.638   0.428
  248   2HB   GLN  32          HB1       GLN  32   0.499   7.221  -0.996
  249   1HG   GLN  32          HG2       GLN  32   0.695   5.100  -0.459
  250   2HG   GLN  32          HG1       GLN  32   2.435   5.253  -0.726
  251   1HE2  GLN  32          HE21      GLN  32   0.745   6.992   1.741
  252   2HE2  GLN  32          HE22      GLN  32   1.459   6.183   3.084
  253    H    LEU  33           HN       LEU  33   3.304   5.855  -3.018
  254    HA   LEU  33           HA       LEU  33   5.482   4.622  -1.813
  255   1HB   LEU  33          HB2       LEU  33   4.460   4.353  -4.229
  256   2HB   LEU  33          HB1       LEU  33   5.668   5.545  -4.659
  257    HG   LEU  33           HG       LEU  33   6.115   2.783  -3.606
  258   1HD1  LEU  33          HD11      LEU  33   6.889   4.159  -6.149
  259   2HD1  LEU  33          HD12      LEU  33   5.676   2.890  -5.956
  260   3HD1  LEU  33          HD13      LEU  33   7.385   2.528  -5.694
  261   1HD2  LEU  33          HD21      LEU  33   8.251   4.842  -4.121
  262   2HD2  LEU  33          HD22      LEU  33   8.513   3.160  -3.657
  263   3HD2  LEU  33          HD23      LEU  33   7.748   4.278  -2.529
  264    H    LYS  34           HN       LYS  34   5.485   7.263  -4.032
  265    HA   LYS  34           HA       LYS  34   6.495   9.258  -4.194
  266   1HB   LYS  34          HB2       LYS  34   6.935  10.506  -2.296
  267   2HB   LYS  34          HB1       LYS  34   5.800   9.290  -1.720
  268   1HG   LYS  34          HG2       LYS  34   7.329   8.284  -0.386
  269   2HG   LYS  34          HG1       LYS  34   8.668   8.613  -1.483
  270   1HD   LYS  34          HD2       LYS  34   8.756  10.916  -0.730
  271   2HD   LYS  34          HD1       LYS  34   7.352  10.653   0.308
  272   1HE   LYS  34          HE2       LYS  34   9.855   9.004   0.588
  273   2HE   LYS  34          HE1       LYS  34   9.684  10.573   1.388
  274   1HZ   LYS  34          HZ1       LYS  34   9.042   8.824   2.881
  275   2HZ   LYS  34          HZ2       LYS  34   7.935   8.201   1.762
  276   3HZ   LYS  34          HZ3       LYS  34   7.663   9.719   2.466
  277    H    ILE  35           HN       ILE  35   8.227   6.718  -2.884
  278    HA   ILE  35           HA       ILE  35  10.192   5.782  -3.260
  279    HB   ILE  35           HB       ILE  35  10.844   7.051  -5.785
  280   1HG1  ILE  35          HG12      ILE  35   8.311   5.475  -5.735
  281   2HG1  ILE  35          HG11      ILE  35   8.248   7.232  -5.619
  282   1HG2  ILE  35          HG21      ILE  35  10.636   4.626  -6.437
  283   2HG2  ILE  35          HG22      ILE  35  10.124   4.311  -4.770
  284   3HG2  ILE  35          HG23      ILE  35  11.745   4.939  -5.103
  285   1HD1  ILE  35          HD11      ILE  35   9.370   7.405  -7.774
  286   2HD1  ILE  35          HD12      ILE  35   7.893   6.449  -7.902
  287   3HD1  ILE  35          HD13      ILE  35   9.463   5.646  -7.873
  288    H    ASP  36           HN       ASP  36  12.446   6.446  -4.491
  289    HA   ASP  36           HA       ASP  36  13.573   8.815  -3.307
  290   1HB   ASP  36          HB2       ASP  36  13.353   7.068  -1.451
  291   2HB   ASP  36          HB1       ASP  36  14.494   6.094  -2.363
  292    H    ILE  37           HN       ILE  37  14.205   5.560  -4.318
  293    HA   ILE  37           HA       ILE  37  15.446   6.113  -6.772
  294    HB   ILE  37           HB       ILE  37  17.606   4.945  -6.017
  295   1HG1  ILE  37          HG12      ILE  37  17.012   6.338  -3.454
  296   2HG1  ILE  37          HG11      ILE  37  16.454   4.695  -3.760
  297   1HG2  ILE  37          HG21      ILE  37  18.757   7.066  -5.583
  298   2HG2  ILE  37          HG22      ILE  37  17.193   7.854  -5.379
  299   3HG2  ILE  37          HG23      ILE  37  17.643   7.184  -6.946
  300   1HD1  ILE  37          HD11      ILE  37  18.559   4.730  -2.514
  301   2HD1  ILE  37          HD12      ILE  37  19.318   5.636  -3.822
  302   3HD1  ILE  37          HD13      ILE  37  18.768   3.984  -4.097
  303    H    GLY  38           HN       GLY  38  13.474   4.414  -5.354
  304   1HA   GLY  38          HA2       GLY  38  14.026   1.844  -6.352
  305   2HA   GLY  38          HA1       GLY  38  14.519   1.934  -4.645
  306    H    ASP  39           HN       ASP  39  13.033   2.927  -3.235
  307    HA   ASP  39           HA       ASP  39  10.245   2.973  -3.668
  308   1HB   ASP  39          HB2       ASP  39  11.419   0.605  -2.250
  309   2HB   ASP  39          HB1       ASP  39   9.799   1.193  -1.947
  310    H    VAL  40           HN       VAL  40   9.683   4.456  -2.634
  311    HA   VAL  40           HA       VAL  40   9.216   5.977  -1.094
  312    HB   VAL  40           HB       VAL  40   8.205   4.160  -0.006
  313   1HG1  VAL  40          HG11      VAL  40  10.671   3.593   1.573
  314   2HG1  VAL  40          HG12      VAL  40  10.123   2.630   0.201
  315   3HG1  VAL  40          HG13      VAL  40   9.124   2.751   1.649
  316   1HG2  VAL  40          HG21      VAL  40   9.681   5.840   1.950
  317   2HG2  VAL  40          HG22      VAL  40   8.214   4.923   2.289
  318   3HG2  VAL  40          HG23      VAL  40   8.176   6.259   1.135
  319    H    THR  41           HN       THR  41  11.747   4.237   0.311
  320    HA   THR  41           HA       THR  41  13.625   6.378   0.406
  321    HB   THR  41           HB       THR  41  12.417   5.642   3.078
  322    HG1  THR  41           HG1      THR  41  11.791   7.588   1.283
  323   1HG2  THR  41          HG21      THR  41  14.815   6.066   3.218
  324   2HG2  THR  41          HG22      THR  41  13.909   7.377   3.973
  325   3HG2  THR  41          HG23      THR  41  14.605   7.599   2.368
  326    HA   PRO  42           HA       PRO  42  15.558   2.702   2.442
  327   1HB   PRO  42          HB2       PRO  42  13.515   0.631   2.851
  328   2HB   PRO  42          HB1       PRO  42  14.732   1.242   3.977
  329   1HG   PRO  42          HG2       PRO  42  12.126   1.843   4.247
  330   2HG   PRO  42          HG1       PRO  42  13.405   3.004   4.661
  331   1HD   PRO  42          HD2       PRO  42  11.730   2.842   2.180
  332   2HD   PRO  42          HD1       PRO  42  12.184   4.266   3.139
  333    H    ASP  43           HN       ASP  43  13.518   2.558  -0.293
  334    HA   ASP  43           HA       ASP  43  14.554   2.185  -2.323
  335   1HB   ASP  43          HB2       ASP  43  16.796   2.048  -1.398
  336   2HB   ASP  43          HB1       ASP  43  16.470   0.449  -0.743
  337    H    GLY  44           HN       GLY  44  13.370  -0.022  -0.033
  338   1HA   GLY  44          HA2       GLY  44  11.739  -1.120  -2.062
  339   2HA   GLY  44          HA1       GLY  44  12.949  -2.301  -1.556
  340    H    ARG  45           HN       ARG  45  11.123   0.082   0.339
  341    HA   ARG  45           HA       ARG  45  10.170  -1.845   2.198
  342   1HB   ARG  45          HB2       ARG  45   9.897   1.035   1.647
  343   2HB   ARG  45          HB1       ARG  45   8.503   0.292   2.408
  344   1HG   ARG  45          HG2       ARG  45  11.283  -0.015   3.493
  345   2HG   ARG  45          HG1       ARG  45  10.206   1.301   3.968
  346   1HD   ARG  45          HD2       ARG  45   8.710  -0.138   5.014
  347   2HD   ARG  45          HD1       ARG  45   9.299  -1.547   4.133
  348    HE   ARG  45           HE       ARG  45  11.380  -1.293   5.504
  349   1HH1  ARG  45          HH11      ARG  45   8.348   0.032   6.670
  350   2HH1  ARG  45          HH12      ARG  45   8.716  -0.253   8.340
  351   1HH2  ARG  45          HH21      ARG  45  11.881  -1.651   7.688
  352   2HH2  ARG  45          HH22      ARG  45  10.753  -1.199   8.929
  353    H    PHE  46           HN       PHE  46   9.106  -0.427  -0.750
  354    HA   PHE  46           HA       PHE  46   6.425  -1.477  -0.534
  355   1HB   PHE  46          HB2       PHE  46   7.873   0.424  -2.340
  356   2HB   PHE  46          HB1       PHE  46   6.311  -0.224  -2.781
  357    HD1  PHE  46           HD1      PHE  46   8.095   2.279  -1.089
  358    HD2  PHE  46           HD2      PHE  46   4.353   0.252  -1.144
  359    HE1  PHE  46           HE1      PHE  46   7.027   4.226  -0.025
  360    HE2  PHE  46           HE2      PHE  46   3.293   2.155  -0.009
  361    HZ   PHE  46           HZ       PHE  46   4.626   4.146   0.553
  362    H    SER  47           HN       SER  47   5.571  -2.917  -1.953
  363    HA   SER  47           HA       SER  47   6.789  -3.298  -4.537
  364   1HB   SER  47          HB2       SER  47   7.766  -5.187  -3.341
  365   2HB   SER  47          HB1       SER  47   6.199  -5.615  -2.660
  366    HG   SER  47           HG       SER  47   5.489  -6.198  -4.705
  367    H    ILE  48           HN       ILE  48   4.978  -1.828  -4.701
  368    HA   ILE  48           HA       ILE  48   2.426  -2.414  -3.735
  369    HB   ILE  48           HB       ILE  48   1.653  -0.576  -5.231
  370   1HG1  ILE  48          HG12      ILE  48   3.933   0.658  -6.096
  371   2HG1  ILE  48          HG11      ILE  48   4.292  -1.034  -6.432
  372   1HG2  ILE  48          HG21      ILE  48   4.134   0.019  -3.639
  373   2HG2  ILE  48          HG22      ILE  48   2.492  -0.094  -3.007
  374   3HG2  ILE  48          HG23      ILE  48   2.916   1.195  -4.134
  375   1HD1  ILE  48          HD11      ILE  48   2.282  -1.235  -7.722
  376   2HD1  ILE  48          HD12      ILE  48   3.260   0.106  -8.326
  377   3HD1  ILE  48          HD13      ILE  48   1.837   0.425  -7.329
  378    H    ASP  49           HN       ASP  49   1.183  -4.096  -4.322
  379    HA   ASP  49           HA       ASP  49   0.107  -3.925  -6.963
  380   1HB   ASP  49          HB2       ASP  49   0.420  -6.324  -7.568
  381   2HB   ASP  49          HB1       ASP  49   1.887  -5.360  -7.610
  382    H    THR  50           HN       THR  50  -1.844  -4.581  -7.148
  383    HA   THR  50           HA       THR  50  -3.732  -5.190  -5.369
  384    HB   THR  50           HB       THR  50  -3.685  -6.641  -7.988
  385    HG1  THR  50           HG1      THR  50  -3.129  -4.755  -8.823
  386   1HG2  THR  50          HG21      THR  50  -5.824  -5.117  -6.493
  387   2HG2  THR  50          HG22      THR  50  -5.670  -6.873  -6.578
  388   3HG2  THR  50          HG23      THR  50  -6.038  -5.949  -8.034
  389    H    LEU  51           HN       LEU  51  -1.350  -7.631  -6.471
  390    HA   LEU  51           HA       LEU  51  -3.195  -9.612  -7.007
  391   1HB   LEU  51          HB2       LEU  51  -0.326  -9.988  -6.188
  392   2HB   LEU  51          HB1       LEU  51  -1.310 -11.153  -7.054
  393    HG   LEU  51           HG       LEU  51  -0.471  -8.443  -8.090
  394   1HD1  LEU  51          HD11      LEU  51   0.431 -11.221  -8.838
  395   2HD1  LEU  51          HD12      LEU  51   1.386 -10.004  -7.991
  396   3HD1  LEU  51          HD13      LEU  51   0.895  -9.734  -9.663
  397   1HD2  LEU  51          HD21      LEU  51  -1.428  -9.208 -10.215
  398   2HD2  LEU  51          HD22      LEU  51  -2.649  -9.079  -8.949
  399   3HD2  LEU  51          HD23      LEU  51  -2.026 -10.662  -9.415
  400    H    ARG  52           HN       ARG  52  -1.391  -9.297  -3.908
  401    HA   ARG  52           HA       ARG  52  -2.500 -11.651  -2.770
  402   1HB   ARG  52          HB2       ARG  52  -1.676  -9.164  -1.268
  403   2HB   ARG  52          HB1       ARG  52  -1.771 -10.800  -0.637
  404   1HG   ARG  52          HG2       ARG  52   0.114  -9.997  -2.832
  405   2HG   ARG  52          HG1       ARG  52   0.532  -9.935  -1.120
  406   1HD   ARG  52          HD2       ARG  52   0.122 -12.332  -0.927
  407   2HD   ARG  52          HD1       ARG  52  -0.337 -12.400  -2.630
  408    HE   ARG  52           HE       ARG  52   1.904 -12.095  -3.242
  409   1HH1  ARG  52          HH11      ARG  52   1.483 -12.233   0.251
  410   2HH1  ARG  52          HH12      ARG  52   3.193 -12.362   0.576
  411   1HH2  ARG  52          HH21      ARG  52   4.137 -12.288  -2.814
  412   2HH2  ARG  52          HH22      ARG  52   4.700 -12.390  -1.172
  413    H    CYS  53           HN       CYS  53  -3.295  -8.304  -2.398
  414    HA   CYS  53           HA       CYS  53  -5.588  -8.579  -0.804
  415   1HB   CYS  53          HB2       CYS  53  -4.115  -6.600  -0.817
  416   2HB   CYS  53          HB1       CYS  53  -4.720  -6.194  -2.422
  417    H    VAL  54           HN       VAL  54  -7.687  -7.395  -1.484
  418    HA   VAL  54           HA       VAL  54  -9.682  -7.649  -2.527
  419    HB   VAL  54           HB       VAL  54  -8.195  -8.435  -5.047
  420   1HG1  VAL  54          HG11      VAL  54 -10.599  -8.850  -5.114
  421   2HG1  VAL  54          HG12      VAL  54 -10.162  -7.524  -6.191
  422   3HG1  VAL  54          HG13      VAL  54 -10.912  -7.181  -4.633
  423   1HG2  VAL  54          HG21      VAL  54  -8.253  -6.074  -5.687
  424   2HG2  VAL  54          HG22      VAL  54  -7.298  -6.319  -4.224
  425   3HG2  VAL  54          HG23      VAL  54  -8.930  -5.660  -4.110
  426    H    GLY  55           HN       GLY  55  -8.145  -9.711  -1.228
  427   1HA   GLY  55          HA2       GLY  55  -9.415 -12.097  -2.382
  428   2HA   GLY  55          HA1       GLY  55  -7.917 -12.126  -1.467
  429    H    GLY  56           HN       GLY  56 -11.311 -10.921  -0.943
  430   1HA   GLY  56          HA2       GLY  56 -12.758 -11.493   0.764
  431   2HA   GLY  56          HA1       GLY  56 -11.777 -12.926   0.987
  432    H    CYS  57           HN       CYS  57 -11.578  -9.381   1.767
  433    HA   CYS  57           HA       CYS  57 -10.011 -10.161   4.184
  434   1HB   CYS  57          HB2       CYS  57  -9.496  -7.578   2.852
  435   2HB   CYS  57          HB1       CYS  57  -8.402  -8.605   3.720
  436    H    ALA  58           HN       ALA  58 -12.226  -8.059   2.541
  437    HA   ALA  58           HA       ALA  58 -11.827  -5.620   3.637
  438   1HB   ALA  58          HB1       ALA  58 -14.062  -5.051   2.903
  439   2HB   ALA  58          HB2       ALA  58 -14.469  -6.765   2.776
  440   3HB   ALA  58          HB3       ALA  58 -13.242  -6.067   1.716
  441    H    LEU  59           HN       LEU  59 -13.583  -8.239   5.333
  442    HA   LEU  59           HA       LEU  59 -14.855  -6.369   7.111
  443   1HB   LEU  59          HB2       LEU  59 -14.303  -9.314   7.483
  444   2HB   LEU  59          HB1       LEU  59 -15.321  -8.342   8.526
  445    HG   LEU  59           HG       LEU  59 -15.849  -8.967   5.620
  446   1HD1  LEU  59          HD11      LEU  59 -17.732 -10.249   6.494
  447   2HD1  LEU  59          HD12      LEU  59 -17.234  -9.873   8.140
  448   3HD1  LEU  59          HD13      LEU  59 -16.203 -10.866   7.113
  449   1HD2  LEU  59          HD21      LEU  59 -17.991  -7.843   5.977
  450   2HD2  LEU  59          HD22      LEU  59 -16.639  -6.733   6.214
  451   3HD2  LEU  59          HD23      LEU  59 -17.489  -7.400   7.609
  452    H    ALA  60           HN       ALA  60 -11.642  -7.138   6.790
  453    HA   ALA  60           HA       ALA  60 -11.190  -5.836   9.402
  454   1HB   ALA  60          HB1       ALA  60  -9.965  -7.957   9.203
  455   2HB   ALA  60          HB2       ALA  60  -8.858  -6.584   9.230
  456   3HB   ALA  60          HB3       ALA  60  -9.225  -7.392   7.706
  457    HA   PRO  61           HA       PRO  61  -9.582  -2.573   6.637
  458   1HB   PRO  61          HB2       PRO  61  -7.709  -1.640   8.634
  459   2HB   PRO  61          HB1       PRO  61  -9.176  -0.846   8.058
  460   1HG   PRO  61          HG2       PRO  61  -8.863  -1.867  10.591
  461   2HG   PRO  61          HG1       PRO  61 -10.427  -1.633   9.795
  462   1HD   PRO  61          HD2       PRO  61  -8.841  -4.136  10.167
  463   2HD   PRO  61          HD1       PRO  61 -10.602  -3.897  10.189
  464    H    ILE  62           HN       ILE  62  -8.141  -3.229   5.092
  465    HA   ILE  62           HA       ILE  62  -5.698  -4.544   6.061
  466    HB   ILE  62           HB       ILE  62  -7.058  -5.959   4.600
  467   1HG1  ILE  62          HG12      ILE  62  -4.459  -5.078   3.324
  468   2HG1  ILE  62          HG11      ILE  62  -4.615  -6.234   4.642
  469   1HG2  ILE  62          HG21      ILE  62  -6.559  -3.871   2.487
  470   2HG2  ILE  62          HG22      ILE  62  -8.112  -4.258   3.228
  471   3HG2  ILE  62          HG23      ILE  62  -7.294  -5.451   2.217
  472   1HD1  ILE  62          HD11      ILE  62  -4.247  -7.348   2.515
  473   2HD1  ILE  62          HD12      ILE  62  -5.694  -6.587   1.856
  474   3HD1  ILE  62          HD13      ILE  62  -5.833  -7.748   3.174
  475    H    VAL  63           HN       VAL  63  -3.803  -3.487   5.898
  476    HA   VAL  63           HA       VAL  63  -3.323  -2.242   3.282
  477    HB   VAL  63           HB       VAL  63  -2.027  -1.231   5.832
  478   1HG1  VAL  63          HG11      VAL  63  -2.090  -0.148   3.024
  479   2HG1  VAL  63          HG12      VAL  63  -0.710  -0.883   3.842
  480   3HG1  VAL  63          HG13      VAL  63  -1.352   0.659   4.408
  481   1HG2  VAL  63          HG21      VAL  63  -3.427   0.765   5.669
  482   2HG2  VAL  63          HG22      VAL  63  -4.401  -0.683   5.932
  483   3HG2  VAL  63          HG23      VAL  63  -4.310   0.042   4.324
  484    H    MET  64           HN       MET  64  -1.684  -3.524   2.317
  485    HA   MET  64           HA       MET  64  -0.193  -5.130   4.299
  486   1HB   MET  64          HB2       MET  64  -1.958  -6.256   2.826
  487   2HB   MET  64          HB1       MET  64  -0.855  -5.976   1.485
  488   1HG   MET  64          HG2       MET  64   0.861  -7.236   2.665
  489   2HG   MET  64          HG1       MET  64  -0.282  -7.571   3.965
  490   1HE   MET  64          HE1       MET  64  -0.177 -10.156   3.877
  491   2HE   MET  64          HE2       MET  64   1.124 -10.047   2.690
  492   3HE   MET  64          HE3       MET  64  -0.253 -11.108   2.394
  493    H    VAL  65           HN       VAL  65   2.034  -4.894   4.234
  494    HA   VAL  65           HA       VAL  65   3.109  -4.739   1.483
  495    HB   VAL  65           HB       VAL  65   5.318  -4.211   2.856
  496   1HG1  VAL  65          HG11      VAL  65   4.338  -2.749   1.134
  497   2HG1  VAL  65          HG12      VAL  65   5.033  -1.850   2.483
  498   3HG1  VAL  65          HG13      VAL  65   3.283  -2.048   2.364
  499   1HG2  VAL  65          HG21      VAL  65   3.132  -3.173   4.623
  500   2HG2  VAL  65          HG22      VAL  65   4.833  -2.718   4.753
  501   3HG2  VAL  65          HG23      VAL  65   4.341  -4.392   5.029
  502    H    GLY  66           HN       GLY  66   3.723  -6.774   0.913
  503   1HA   GLY  66          HA2       GLY  66   4.443  -8.927   1.054
  504   2HA   GLY  66          HA1       GLY  66   5.581  -8.301   2.261
  505    H    GLU  67           HN       GLU  67   5.278 -10.384   3.187
  506    HA   GLU  67           HA       GLU  67   2.884 -10.822   4.725
  507   1HB   GLU  67          HB2       GLU  67   5.626 -12.086   4.922
  508   2HB   GLU  67          HB1       GLU  67   4.258 -12.553   5.919
  509   1HG   GLU  67          HG2       GLU  67   4.123 -14.141   4.302
  510   2HG   GLU  67          HG1       GLU  67   3.103 -12.899   3.579
  511    H    LYS  68           HN       LYS  68   3.849  -8.236   4.978
  512    HA   LYS  68           HA       LYS  68   4.932  -8.179   7.703
  513   1HB   LYS  68          HB2       LYS  68   4.822  -5.807   5.845
  514   2HB   LYS  68          HB1       LYS  68   5.785  -5.991   7.297
  515   1HG   LYS  68          HG2       LYS  68   6.256  -7.316   4.610
  516   2HG   LYS  68          HG1       LYS  68   7.235  -6.076   5.382
  517   1HD   LYS  68          HD2       LYS  68   6.821  -8.886   6.422
  518   2HD   LYS  68          HD1       LYS  68   8.269  -8.271   5.620
  519   1HE   LYS  68          HE2       LYS  68   8.544  -6.631   7.439
  520   2HE   LYS  68          HE1       LYS  68   7.132  -7.310   8.246
  521   1HZ   LYS  68          HZ1       LYS  68   8.391  -9.491   8.178
  522   2HZ   LYS  68          HZ2       LYS  68   8.952  -8.315   9.260
  523   3HZ   LYS  68          HZ3       LYS  68   9.770  -8.570   7.798
  524    H    VAL  69           HN       VAL  69   2.324  -7.395   5.639
  525    HA   VAL  69           HA       VAL  69   0.388  -6.176   5.855
  526    HB   VAL  69           HB       VAL  69  -1.099  -7.106   7.675
  527   1HG1  VAL  69          HG11      VAL  69  -1.257  -9.277   6.550
  528   2HG1  VAL  69          HG12      VAL  69   0.306  -8.985   5.788
  529   3HG1  VAL  69          HG13      VAL  69  -1.069  -7.946   5.407
  530   1HG2  VAL  69          HG21      VAL  69   1.311  -8.857   8.153
  531   2HG2  VAL  69          HG22      VAL  69  -0.308  -9.149   8.787
  532   3HG2  VAL  69          HG23      VAL  69   0.598  -7.728   9.304
  533    H    TYR  70           HN       TYR  70   0.058  -4.142   6.235
  534    HA   TYR  70           HA       TYR  70   0.786  -3.034   8.862
  535   1HB   TYR  70          HB2       TYR  70   1.245  -1.910   6.089
  536   2HB   TYR  70          HB1       TYR  70   1.193  -0.874   7.518
  537    HD1  TYR  70           HD1      TYR  70   2.523  -4.287   7.492
  538    HD2  TYR  70           HD2      TYR  70   3.475  -0.156   7.467
  539    HE1  TYR  70           HE1      TYR  70   4.845  -4.831   7.899
  540    HE2  TYR  70           HE2      TYR  70   5.803  -0.690   7.898
  541    HH   TYR  70           HH       TYR  70   7.182  -2.407   8.763
  542    H    GLY  71           HN       GLY  71  -0.025  -0.548   8.653
  543   1HA   GLY  71          HA2       GLY  71  -2.811  -0.453   7.791
  544   2HA   GLY  71          HA1       GLY  71  -2.456  -0.151   9.493
  545    H    ASN  72           HN       ASN  72  -0.690   0.727   6.556
  546    HA   ASN  72           HA       ASN  72  -0.281   3.400   7.510
  547   1HB   ASN  72          HB2       ASN  72   1.523   3.298   6.175
  548   2HB   ASN  72          HB1       ASN  72   1.021   1.692   5.669
  549   1HD2  ASN  72          HD21      ASN  72   1.011   5.062   4.909
  550   2HD2  ASN  72          HD22      ASN  72   0.529   4.889   3.254
  551    H    VAL  73           HN       VAL  73  -2.789   1.911   6.143
  552    HA   VAL  73           HA       VAL  73  -4.862   2.560   5.621
  553    HB   VAL  73           HB       VAL  73  -4.592   5.446   5.988
  554   1HG1  VAL  73          HG11      VAL  73  -6.720   4.263   5.872
  555   2HG1  VAL  73          HG12      VAL  73  -6.527   5.044   7.441
  556   3HG1  VAL  73          HG13      VAL  73  -6.276   3.305   7.285
  557   1HG2  VAL  73          HG21      VAL  73  -2.861   4.803   7.565
  558   2HG2  VAL  73          HG22      VAL  73  -3.929   3.597   8.284
  559   3HG2  VAL  73          HG23      VAL  73  -4.308   5.314   8.439
  560    H    THR  74           HN       THR  74  -5.854   4.986   4.479
  561    HA   THR  74           HA       THR  74  -4.654   4.816   1.829
  562    HB   THR  74           HB       THR  74  -6.655   4.128   0.729
  563    HG1  THR  74           HG1      THR  74  -8.574   3.694   2.078
  564   1HG2  THR  74          HG21      THR  74  -6.322   2.506   3.256
  565   2HG2  THR  74          HG22      THR  74  -5.413   2.296   1.755
  566   3HG2  THR  74          HG23      THR  74  -7.144   1.960   1.791
  567    HA   PRO  75           HA       PRO  75  -7.575   8.535   1.687
  568   1HB   PRO  75          HB2       PRO  75  -9.108   9.292   3.744
  569   2HB   PRO  75          HB1       PRO  75  -9.535   7.909   2.732
  570   1HG   PRO  75          HG2       PRO  75  -8.410   7.969   5.477
  571   2HG   PRO  75          HG1       PRO  75  -9.511   6.798   4.735
  572   1HD   PRO  75          HD2       PRO  75  -6.715   6.529   5.061
  573   2HD   PRO  75          HD1       PRO  75  -7.784   5.477   4.114
  574    H    GLY  76           HN       GLY  76  -5.240   9.319   1.880
  575   1HA   GLY  76          HA2       GLY  76  -4.079  11.301   2.234
  576   2HA   GLY  76          HA1       GLY  76  -5.350  11.810   3.333
  577    H    GLN  77           HN       GLN  77  -4.915   9.117   4.734
  578    HA   GLN  77           HA       GLN  77  -3.299  10.304   6.816
  579   1HB   GLN  77          HB2       GLN  77  -4.373   7.474   6.722
  580   2HB   GLN  77          HB1       GLN  77  -3.932   8.405   8.145
  581   1HG   GLN  77          HG2       GLN  77  -5.821   9.939   7.651
  582   2HG   GLN  77          HG1       GLN  77  -6.298   8.847   6.350
  583   1HE2  GLN  77          HE21      GLN  77  -7.041   6.751   6.880
  584   2HE2  GLN  77          HE22      GLN  77  -7.648   6.405   8.465
  585    H    VAL  78           HN       VAL  78  -3.099   8.347   4.206
  586    HA   VAL  78           HA       VAL  78  -1.258   6.446   4.479
  587    HB   VAL  78           HB       VAL  78  -0.686   7.132   2.087
  588   1HG1  VAL  78          HG11      VAL  78  -2.833   6.324   1.234
  589   2HG1  VAL  78          HG12      VAL  78  -3.508   6.545   2.852
  590   3HG1  VAL  78          HG13      VAL  78  -2.223   5.364   2.590
  591   1HG2  VAL  78          HG21      VAL  78  -2.834   9.103   2.698
  592   2HG2  VAL  78          HG22      VAL  78  -2.369   8.644   1.057
  593   3HG2  VAL  78          HG23      VAL  78  -1.203   9.431   2.122
  594    H    LYS  79           HN       LYS  79  -0.576   9.892   3.732
  595    HA   LYS  79           HA       LYS  79   2.100   9.463   3.034
  596   1HB   LYS  79          HB2       LYS  79   0.909  11.995   4.197
  597   2HB   LYS  79          HB1       LYS  79   2.368  11.876   3.225
  598   1HG   LYS  79          HG2       LYS  79   1.086  11.254   1.287
  599   2HG   LYS  79          HG1       LYS  79  -0.397  11.198   2.245
  600   1HD   LYS  79          HD2       LYS  79   1.304  13.654   1.800
  601   2HD   LYS  79          HD1       LYS  79  -0.197  13.289   0.946
  602   1HE   LYS  79          HE2       LYS  79  -1.457  13.415   2.989
  603   2HE   LYS  79          HE1       LYS  79   0.018  13.569   3.941
  604   1HZ   LYS  79          HZ1       LYS  79   0.424  15.710   2.999
  605   2HZ   LYS  79          HZ2       LYS  79  -1.170  15.689   3.579
  606   3HZ   LYS  79          HZ3       LYS  79  -0.872  15.552   1.916
  607    H    LYS  80           HN       LYS  80   0.538  10.216   6.034
  608    HA   LYS  80           HA       LYS  80   3.055  10.673   7.406
  609   1HB   LYS  80          HB2       LYS  80   0.624  10.631   9.014
  610   2HB   LYS  80          HB1       LYS  80   1.784  11.924   8.777
  611   1HG   LYS  80          HG2       LYS  80   0.246  13.001   7.635
  612   2HG   LYS  80          HG1       LYS  80   0.397  11.799   6.366
  613   1HD   LYS  80          HD2       LYS  80  -1.846  11.671   6.769
  614   2HD   LYS  80          HD1       LYS  80  -1.262  10.477   7.929
  615   1HE   LYS  80          HE2       LYS  80  -1.327  12.119   9.718
  616   2HE   LYS  80          HE1       LYS  80  -1.836  13.367   8.584
  617   1HZ   LYS  80          HZ1       LYS  80  -3.722  12.561   9.786
  618   2HZ   LYS  80          HZ2       LYS  80  -3.384  10.953   9.376
  619   3HZ   LYS  80          HZ3       LYS  80  -3.866  12.053   8.177
  620    H    ILE  81           HN       ILE  81   0.361   8.504   7.389
  621    HA   ILE  81           HA       ILE  81   1.439   6.815   9.416
  622    HB   ILE  81           HB       ILE  81  -0.573   6.067   7.280
  623   1HG1  ILE  81          HG12      ILE  81  -1.326   8.033   8.554
  624   2HG1  ILE  81          HG11      ILE  81  -2.275   6.615   8.980
  625   1HG2  ILE  81          HG21      ILE  81  -0.005   4.909  10.025
  626   2HG2  ILE  81          HG22      ILE  81   0.435   4.165   8.487
  627   3HG2  ILE  81          HG23      ILE  81  -1.264   4.366   8.916
  628   1HD1  ILE  81          HD11      ILE  81  -0.950   6.350  11.014
  629   2HD1  ILE  81          HD12      ILE  81  -1.745   7.925  10.942
  630   3HD1  ILE  81          HD13      ILE  81  -0.022   7.788  10.589
  631    H    LEU  82           HN       LEU  82   2.195   7.377   6.149
  632    HA   LEU  82           HA       LEU  82   3.480   4.975   5.378
  633   1HB   LEU  82          HB2       LEU  82   3.113   6.739   3.804
  634   2HB   LEU  82          HB1       LEU  82   3.963   7.904   4.788
  635    HG   LEU  82           HG       LEU  82   6.070   6.596   4.311
  636   1HD1  LEU  82          HD11      LEU  82   6.064   5.181   2.337
  637   2HD1  LEU  82          HD12      LEU  82   4.313   5.345   2.215
  638   3HD1  LEU  82          HD13      LEU  82   5.029   4.517   3.598
  639   1HD2  LEU  82          HD21      LEU  82   4.624   7.820   1.965
  640   2HD2  LEU  82          HD22      LEU  82   6.368   7.622   2.131
  641   3HD2  LEU  82          HD23      LEU  82   5.498   8.712   3.210
  642    H    ALA  83           HN       ALA  83   4.319   7.322   7.839
  643    HA   ALA  83           HA       ALA  83   6.927   6.568   8.390
  644   1HB   ALA  83          HB1       ALA  83   6.416   6.835  10.762
  645   2HB   ALA  83          HB2       ALA  83   4.690   6.746  10.410
  646   3HB   ALA  83          HB3       ALA  83   5.645   8.103   9.810
  647    H    GLU  84           HN       GLU  84   4.034   4.645   8.518
  648    HA   GLU  84           HA       GLU  84   5.000   2.293   9.716
  649   1HB   GLU  84          HB2       GLU  84   2.856   3.000   7.770
  650   2HB   GLU  84          HB1       GLU  84   3.276   1.314   7.967
  651   1HG   GLU  84          HG2       GLU  84   2.547   3.055  10.295
  652   2HG   GLU  84          HG1       GLU  84   1.327   2.234   9.319
  653    H    TYR  85           HN       TYR  85   4.882   3.404   6.361
  654    HA   TYR  85           HA       TYR  85   6.124   1.017   5.440
  655   1HB   TYR  85          HB2       TYR  85   4.723   3.352   4.248
  656   2HB   TYR  85          HB1       TYR  85   5.667   2.286   3.239
  657    HD1  TYR  85           HD1      TYR  85   4.571   0.480   5.813
  658    HD2  TYR  85           HD2      TYR  85   3.255   2.206   2.308
  659    HE1  TYR  85           HE1      TYR  85   2.933  -1.254   5.654
  660    HE2  TYR  85           HE2      TYR  85   1.538   0.489   2.155
  661    HH   TYR  85           HH       TYR  85   1.093  -1.778   2.860
  Start of MODEL    5
    1   1H    MET   1          HT1       MET   1  13.424 -11.373  13.993
    2   2H    MET   1          HT2       MET   1  13.746  -9.877  13.268
    3   3H    MET   1          HT3       MET   1  15.026 -10.923  13.649
    4    HA   MET   1           HA       MET   1  14.077 -12.561  12.074
    5   1HB   MET   1          HB2       MET   1  12.419 -10.173  11.231
    6   2HB   MET   1          HB1       MET   1  12.490 -11.720  10.403
    7   1HG   MET   1          HG2       MET   1  11.535 -12.786  12.423
    8   2HG   MET   1          HG1       MET   1  11.363 -11.185  13.140
    9   1HE   MET   1          HE1       MET   1   9.873  -9.228  11.959
   10   2HE   MET   1          HE2       MET   1   8.891  -9.506  10.522
   11   3HE   MET   1          HE3       MET   1  10.652  -9.541  10.409
   12    H    VAL   2           HN       VAL   2  14.656 -12.389   9.722
   13    HA   VAL   2           HA       VAL   2  17.057 -10.898   9.419
   14    HB   VAL   2           HB       VAL   2  16.845 -13.052   8.329
   15   1HG1  VAL   2          HG11      VAL   2  14.643 -11.821   6.679
   16   2HG1  VAL   2          HG12      VAL   2  14.441 -13.052   7.925
   17   3HG1  VAL   2          HG13      VAL   2  15.331 -13.428   6.451
   18   1HG2  VAL   2          HG21      VAL   2  17.562 -12.465   6.057
   19   2HG2  VAL   2          HG22      VAL   2  18.320 -11.438   7.275
   20   3HG2  VAL   2          HG23      VAL   2  16.981 -10.817   6.308
   21    HA   PRO   3           HA       PRO   3  15.262  -7.022   8.208
   22   1HB   PRO   3          HB2       PRO   3  17.518  -6.058   6.926
   23   2HB   PRO   3          HB1       PRO   3  17.211  -5.940   8.661
   24   1HG   PRO   3          HG2       PRO   3  18.874  -7.917   7.159
   25   2HG   PRO   3          HG1       PRO   3  19.195  -7.135   8.718
   26   1HD   PRO   3          HD2       PRO   3  18.334  -9.665   8.580
   27   2HD   PRO   3          HD1       PRO   3  17.786  -8.574   9.870
   28    H    LYS   4           HN       LYS   4  13.804  -7.144   6.640
   29    HA   LYS   4           HA       LYS   4  14.649  -7.914   3.944
   30   1HB   LYS   4          HB2       LYS   4  11.870  -7.683   5.099
   31   2HB   LYS   4          HB1       LYS   4  12.252  -8.205   3.464
   32   1HG   LYS   4          HG2       LYS   4  13.540 -10.103   4.454
   33   2HG   LYS   4          HG1       LYS   4  12.928  -9.616   6.034
   34   1HD   LYS   4          HD2       LYS   4  10.619  -9.893   5.167
   35   2HD   LYS   4          HD1       LYS   4  11.296 -10.503   3.655
   36   1HE   LYS   4          HE2       LYS   4  12.454 -12.275   4.982
   37   2HE   LYS   4          HE1       LYS   4  11.571 -11.714   6.402
   38   1HZ   LYS   4          HZ1       LYS   4  10.284 -13.446   5.613
   39   2HZ   LYS   4          HZ2       LYS   4  10.533 -13.047   3.988
   40   3HZ   LYS   4          HZ3       LYS   4   9.507 -12.095   4.939
   41    H    GLY   5           HN       GLY   5  11.859  -5.967   4.591
   42   1HA   GLY   5          HA2       GLY   5  11.612  -3.639   4.549
   43   2HA   GLY   5          HA1       GLY   5  13.302  -3.510   4.109
   44    H    LYS   6           HN       LYS   6  10.975  -5.503   2.493
   45    HA   LYS   6           HA       LYS   6  10.682  -3.612   0.327
   46   1HB   LYS   6          HB2       LYS   6  11.507  -5.004  -1.400
   47   2HB   LYS   6          HB1       LYS   6  12.744  -4.929  -0.152
   48   1HG   LYS   6          HG2       LYS   6  10.791  -7.188  -0.442
   49   2HG   LYS   6          HG1       LYS   6  12.420  -7.184  -1.124
   50   1HD   LYS   6          HD2       LYS   6  13.332  -6.906   1.151
   51   2HD   LYS   6          HD1       LYS   6  11.685  -6.998   1.810
   52   1HE   LYS   6          HE2       LYS   6  12.683  -9.157   1.989
   53   2HE   LYS   6          HE1       LYS   6  11.464  -9.213   0.716
   54   1HZ   LYS   6          HZ1       LYS   6  14.406  -8.992   0.319
   55   2HZ   LYS   6          HZ2       LYS   6  13.257  -8.951  -0.924
   56   3HZ   LYS   6          HZ3       LYS   6  13.449 -10.359   0.000
   57    H    TYR   7           HN       TYR   7   8.842  -4.222   2.002
   58    HA   TYR   7           HA       TYR   7   7.293  -6.459   1.865
   59   1HB   TYR   7          HB2       TYR   7   6.242  -3.689   2.317
   60   2HB   TYR   7          HB1       TYR   7   5.812  -5.194   3.150
   61    HD1  TYR   7           HD1      TYR   7   7.890  -6.404   4.298
   62    HD2  TYR   7           HD2      TYR   7   7.600  -2.281   3.347
   63    HE1  TYR   7           HE1      TYR   7   9.516  -5.907   6.036
   64    HE2  TYR   7           HE2      TYR   7   9.196  -1.747   5.069
   65    HH   TYR   7           HH       TYR   7  11.048  -4.210   6.721
   66    HA   PRO   8           HA       PRO   8   5.143  -6.050  -2.180
   67   1HB   PRO   8          HB2       PRO   8   4.024  -8.482  -0.833
   68   2HB   PRO   8          HB1       PRO   8   4.483  -8.255  -2.528
   69   1HG   PRO   8          HG2       PRO   8   6.057  -9.637  -0.930
   70   2HG   PRO   8          HG1       PRO   8   6.767  -8.456  -2.052
   71   1HD   PRO   8          HD2       PRO   8   6.272  -8.214   0.893
   72   2HD   PRO   8          HD1       PRO   8   7.674  -7.680  -0.059
   73    H    ILE   9           HN       ILE   9   3.970  -4.196  -1.455
   74    HA   ILE   9           HA       ILE   9   1.951  -4.467   0.553
   75    HB   ILE   9           HB       ILE   9   2.472  -2.325   0.770
   76   1HG1  ILE   9          HG12      ILE   9   0.802  -2.104  -1.742
   77   2HG1  ILE   9          HG11      ILE   9   0.278  -1.925  -0.070
   78   1HG2  ILE   9          HG21      ILE   9   3.491  -2.300  -2.067
   79   2HG2  ILE   9          HG22      ILE   9   4.440  -2.577  -0.606
   80   3HG2  ILE   9          HG23      ILE   9   3.697  -1.002  -0.890
   81   1HD1  ILE   9          HD11      ILE   9   0.381   0.225  -1.143
   82   2HD1  ILE   9          HD12      ILE   9   2.063  -0.049  -1.604
   83   3HD1  ILE   9          HD13      ILE   9   1.632   0.125   0.100
   84    H    SER  10           HN       SER  10   0.014  -5.134   0.306
   85    HA   SER  10           HA       SER  10  -0.993  -5.648  -2.396
   86   1HB   SER  10          HB2       SER  10  -2.045  -6.809   0.174
   87   2HB   SER  10          HB1       SER  10  -2.182  -7.459  -1.466
   88    HG   SER  10           HG       SER  10   0.393  -7.155  -0.932
   89    H    VAL  11           HN       VAL  11  -2.436  -4.270  -3.144
   90    HA   VAL  11           HA       VAL  11  -4.289  -2.964  -1.246
   91    HB   VAL  11           HB       VAL  11  -3.689  -1.748  -3.908
   92   1HG1  VAL  11          HG11      VAL  11  -4.118   0.329  -2.692
   93   2HG1  VAL  11          HG12      VAL  11  -4.314  -0.591  -1.200
   94   3HG1  VAL  11          HG13      VAL  11  -5.454  -0.810  -2.526
   95   1HG2  VAL  11          HG21      VAL  11  -1.479  -2.132  -3.173
   96   2HG2  VAL  11          HG22      VAL  11  -1.870  -1.653  -1.514
   97   3HG2  VAL  11          HG23      VAL  11  -1.842  -0.441  -2.803
   98    H    CYS  12           HN       CYS  12  -6.418  -3.554  -1.555
   99    HA   CYS  12           HA       CYS  12  -7.211  -5.103  -3.795
  100   1HB   CYS  12          HB2       CYS  12  -8.477  -5.368  -1.772
  101   2HB   CYS  12          HB1       CYS  12  -8.877  -3.652  -1.734
  102    H    MET  13           HN       MET  13  -7.484  -4.413  -5.785
  103    HA   MET  13           HA       MET  13  -9.055  -1.957  -6.157
  104   1HB   MET  13          HB2       MET  13  -6.925  -3.076  -7.993
  105   2HB   MET  13          HB1       MET  13  -7.997  -1.746  -8.408
  106   1HG   MET  13          HG2       MET  13  -7.080  -0.455  -6.524
  107   2HG   MET  13          HG1       MET  13  -5.969  -1.780  -6.185
  108   1HE   MET  13          HE1       MET  13  -6.964   1.093  -8.627
  109   2HE   MET  13          HE2       MET  13  -7.148  -0.316  -9.672
  110   3HE   MET  13          HE3       MET  13  -5.857   0.846  -9.980
  111    H    GLY  14           HN       GLY  14  -9.832  -4.788  -5.717
  112   1HA   GLY  14          HA2       GLY  14 -10.476  -6.032  -8.189
  113   2HA   GLY  14          HA1       GLY  14 -11.125  -6.468  -6.617
  114    H    THR  15           HN       THR  15 -12.955  -6.817  -8.342
  115    HA   THR  15           HA       THR  15 -14.169  -4.587  -9.555
  116    HB   THR  15           HB       THR  15 -15.579  -7.161  -8.866
  117    HG1  THR  15           HG1      THR  15 -13.526  -6.617 -10.744
  118   1HG2  THR  15          HG21      THR  15 -16.745  -6.750 -10.990
  119   2HG2  THR  15          HG22      THR  15 -15.830  -5.256 -11.200
  120   3HG2  THR  15          HG23      THR  15 -16.971  -5.411  -9.863
  121    H    ALA  16           HN       ALA  16 -14.949  -6.324  -6.562
  122    HA   ALA  16           HA       ALA  16 -17.353  -4.894  -6.061
  123   1HB   ALA  16          HB1       ALA  16 -17.347  -6.019  -3.910
  124   2HB   ALA  16          HB2       ALA  16 -15.672  -6.514  -4.153
  125   3HB   ALA  16          HB3       ALA  16 -16.940  -7.149  -5.201
  126    H    CYS  17           HN       CYS  17 -14.169  -4.769  -4.499
  127    HA   CYS  17           HA       CYS  17 -14.907  -2.781  -2.646
  128   1HB   CYS  17          HB2       CYS  17 -12.203  -3.695  -3.583
  129   2HB   CYS  17          HB1       CYS  17 -12.474  -2.670  -2.204
  130    H    PHE  18           HN       PHE  18 -13.529  -2.610  -5.857
  131    HA   PHE  18           HA       PHE  18 -12.359  -0.067  -5.766
  132   1HB   PHE  18          HB2       PHE  18 -11.961  -1.756  -7.528
  133   2HB   PHE  18          HB1       PHE  18 -13.578  -1.463  -8.151
  134    HD1  PHE  18           HD1      PHE  18 -10.287   0.120  -7.571
  135    HD2  PHE  18           HD2      PHE  18 -13.987   0.277  -9.664
  136    HE1  PHE  18           HE1      PHE  18  -9.386   1.894  -9.019
  137    HE2  PHE  18           HE2      PHE  18 -13.096   2.053 -11.117
  138    HZ   PHE  18           HZ       PHE  18 -10.792   2.864 -10.794
  139    H    VAL  19           HN       VAL  19 -15.708  -0.962  -6.110
  140    HA   VAL  19           HA       VAL  19 -16.529   1.325  -7.592
  141    HB   VAL  19           HB       VAL  19 -18.806   0.645  -7.205
  142   1HG1  VAL  19          HG11      VAL  19 -17.027  -1.744  -7.649
  143   2HG1  VAL  19          HG12      VAL  19 -17.552  -0.593  -8.876
  144   3HG1  VAL  19          HG13      VAL  19 -18.731  -1.636  -8.083
  145   1HG2  VAL  19          HG21      VAL  19 -18.669   0.108  -4.832
  146   2HG2  VAL  19          HG22      VAL  19 -17.720  -1.331  -5.206
  147   3HG2  VAL  19          HG23      VAL  19 -19.396  -1.218  -5.742
  148    H    LYS  20           HN       LYS  20 -15.815   0.863  -4.298
  149    HA   LYS  20           HA       LYS  20 -17.666   2.820  -3.260
  150   1HB   LYS  20          HB2       LYS  20 -15.255   1.554  -1.940
  151   2HB   LYS  20          HB1       LYS  20 -16.541   2.433  -1.128
  152   1HG   LYS  20          HG2       LYS  20 -18.125   0.722  -1.614
  153   2HG   LYS  20          HG1       LYS  20 -16.986  -0.104  -2.679
  154   1HD   LYS  20          HD2       LYS  20 -17.062  -1.273  -0.581
  155   2HD   LYS  20          HD1       LYS  20 -15.500  -0.465  -0.720
  156   1HE   LYS  20          HE2       LYS  20 -16.322  -0.169   1.517
  157   2HE   LYS  20          HE1       LYS  20 -16.389   1.381   0.681
  158   1HZ   LYS  20          HZ1       LYS  20 -18.722   1.182   0.408
  159   2HZ   LYS  20          HZ2       LYS  20 -18.394   0.812   2.034
  160   3HZ   LYS  20          HZ3       LYS  20 -18.722  -0.432   0.933
  161    H    GLY  21           HN       GLY  21 -15.285   3.354  -5.258
  162   1HA   GLY  21          HA2       GLY  21 -14.329   5.418  -5.790
  163   2HA   GLY  21          HA1       GLY  21 -14.731   5.994  -4.172
  164    H    ALA  22           HN       ALA  22 -13.035   3.015  -4.815
  165    HA   ALA  22           HA       ALA  22 -11.102   3.687  -2.837
  166   1HB   ALA  22          HB1       ALA  22 -11.268   1.329  -4.709
  167   2HB   ALA  22          HB2       ALA  22 -11.876   1.408  -3.053
  168   3HB   ALA  22          HB3       ALA  22 -10.140   1.476  -3.360
  169    H    ASP  23           HN       ASP  23 -11.277   4.070  -6.236
  170    HA   ASP  23           HA       ASP  23  -8.632   3.834  -7.023
  171   1HB   ASP  23          HB2       ASP  23 -10.386   4.160  -8.646
  172   2HB   ASP  23          HB1       ASP  23 -10.772   5.745  -7.976
  173    H    LYS  24           HN       LYS  24 -10.275   6.705  -5.653
  174    HA   LYS  24           HA       LYS  24  -8.013   8.377  -6.108
  175   1HB   LYS  24          HB2       LYS  24 -10.239   8.855  -4.121
  176   2HB   LYS  24          HB1       LYS  24  -9.196  10.063  -4.862
  177   1HG   LYS  24          HG2       LYS  24 -11.325   8.416  -6.205
  178   2HG   LYS  24          HG1       LYS  24 -11.326  10.159  -5.928
  179   1HD   LYS  24          HD2       LYS  24  -9.506  10.458  -7.466
  180   2HD   LYS  24          HD1       LYS  24  -9.303   8.716  -7.637
  181   1HE   LYS  24          HE2       LYS  24 -10.464   9.537  -9.564
  182   2HE   LYS  24          HE1       LYS  24 -11.594   8.600  -8.590
  183   1HZ   LYS  24          HZ1       LYS  24 -11.390  11.559  -8.680
  184   2HZ   LYS  24          HZ2       LYS  24 -12.448  10.691  -7.676
  185   3HZ   LYS  24          HZ3       LYS  24 -12.627  10.621  -9.359
  186    H    VAL  25           HN       VAL  25  -9.115   6.527  -3.322
  187    HA   VAL  25           HA       VAL  25  -7.165   7.611  -1.549
  188    HB   VAL  25           HB       VAL  25  -7.790   5.497  -0.253
  189   1HG1  VAL  25          HG11      VAL  25  -8.575   7.711   0.346
  190   2HG1  VAL  25          HG12      VAL  25  -9.900   6.554   0.511
  191   3HG1  VAL  25          HG13      VAL  25  -9.827   7.618  -0.895
  192   1HG2  VAL  25          HG21      VAL  25  -9.894   4.465  -0.770
  193   2HG2  VAL  25          HG22      VAL  25  -8.785   4.266  -2.128
  194   3HG2  VAL  25          HG23      VAL  25 -10.063   5.479  -2.201
  195    H    VAL  26           HN       VAL  26  -7.364   4.685  -3.551
  196    HA   VAL  26           HA       VAL  26  -4.830   3.766  -2.659
  197    HB   VAL  26           HB       VAL  26  -4.783   2.227  -4.510
  198   1HG1  VAL  26          HG11      VAL  26  -6.206   1.644  -2.638
  199   2HG1  VAL  26          HG12      VAL  26  -6.885   1.034  -4.147
  200   3HG1  VAL  26          HG13      VAL  26  -7.567   2.476  -3.393
  201   1HG2  VAL  26          HG21      VAL  26  -6.569   2.221  -6.227
  202   2HG2  VAL  26          HG22      VAL  26  -5.490   3.613  -6.327
  203   3HG2  VAL  26          HG23      VAL  26  -7.097   3.795  -5.620
  204    H    HIS  27           HN       HIS  27  -5.872   6.087  -5.092
  205    HA   HIS  27           HA       HIS  27  -3.457   6.363  -6.478
  206   1HB   HIS  27          HB2       HIS  27  -5.642   7.492  -7.084
  207   2HB   HIS  27          HB1       HIS  27  -5.294   8.659  -5.806
  208    HD1  HIS  27           HD1      HIS  27  -3.250  10.277  -6.204
  209    HD2  HIS  27           HD2      HIS  27  -4.232   7.856  -9.440
  210    HE1  HIS  27           HE1      HIS  27  -1.979  11.206  -8.155
  211    HE2  HIS  27           HE2      HIS  27  -2.450   9.625 -10.057
  212    H    ALA  28           HN       ALA  28  -4.595   7.778  -3.519
  213    HA   ALA  28           HA       ALA  28  -2.433   9.410  -2.876
  214   1HB   ALA  28          HB1       ALA  28  -3.089   9.138  -0.543
  215   2HB   ALA  28          HB2       ALA  28  -4.085   7.746  -0.973
  216   3HB   ALA  28          HB3       ALA  28  -4.507   9.353  -1.570
  217    H    PHE  29           HN       PHE  29  -2.935   5.961  -2.208
  218    HA   PHE  29           HA       PHE  29  -0.537   5.296  -0.998
  219   1HB   PHE  29          HB2       PHE  29  -2.691   3.960  -2.363
  220   2HB   PHE  29          HB1       PHE  29  -1.156   3.240  -2.829
  221    HD1  PHE  29           HD1      PHE  29   0.405   3.412  -0.405
  222    HD2  PHE  29           HD2      PHE  29  -3.709   2.487  -0.930
  223    HE1  PHE  29           HE1      PHE  29   0.439   2.112   1.673
  224    HE2  PHE  29           HE2      PHE  29  -3.684   1.181   1.154
  225    HZ   PHE  29           HZ       PHE  29  -1.605   0.993   2.457
  226    H    LYS  30           HN       LYS  30  -1.336   5.393  -4.446
  227    HA   LYS  30           HA       LYS  30   1.063   4.578  -5.526
  228   1HB   LYS  30          HB2       LYS  30  -0.846   6.636  -6.618
  229   2HB   LYS  30          HB1       LYS  30   0.438   5.878  -7.545
  230   1HG   LYS  30          HG2       LYS  30  -1.870   4.414  -6.280
  231   2HG   LYS  30          HG1       LYS  30  -1.773   4.894  -7.975
  232   1HD   LYS  30          HD2       LYS  30   0.360   3.552  -8.110
  233   2HD   LYS  30          HD1       LYS  30  -0.036   2.919  -6.509
  234   1HE   LYS  30          HE2       LYS  30  -2.120   2.013  -7.354
  235   2HE   LYS  30          HE1       LYS  30  -1.810   2.717  -8.941
  236   1HZ   LYS  30          HZ1       LYS  30  -1.169   0.491  -9.121
  237   2HZ   LYS  30          HZ2       LYS  30  -0.388   0.482  -7.620
  238   3HZ   LYS  30          HZ3       LYS  30   0.296   1.327  -8.926
  239    H    GLU  31           HN       GLU  31   0.095   7.832  -4.683
  240    HA   GLU  31           HA       GLU  31   2.625   8.894  -5.579
  241   1HB   GLU  31          HB2       GLU  31   1.721  11.088  -4.775
  242   2HB   GLU  31          HB1       GLU  31   0.753  10.295  -6.008
  243   1HG   GLU  31          HG2       GLU  31  -0.812   9.532  -4.320
  244   2HG   GLU  31          HG1       GLU  31   0.173  10.264  -3.054
  245    H    GLN  32           HN       GLN  32   1.248   7.846  -2.639
  246    HA   GLN  32           HA       GLN  32   2.995   9.107  -0.852
  247   1HB   GLN  32          HB2       GLN  32   1.654   8.106   0.590
  248   2HB   GLN  32          HB1       GLN  32   0.939   7.153  -0.711
  249   1HG   GLN  32          HG2       GLN  32   2.692   5.562  -0.527
  250   2HG   GLN  32          HG1       GLN  32   3.460   6.478   0.757
  251   1HE2  GLN  32          HE21      GLN  32   0.865   7.193   1.886
  252   2HE2  GLN  32          HE22      GLN  32   0.342   5.795   2.768
  253    H    LEU  33           HN       LEU  33   3.185   6.209  -2.823
  254    HA   LEU  33           HA       LEU  33   5.513   5.014  -1.984
  255   1HB   LEU  33          HB2       LEU  33   4.023   4.581  -4.082
  256   2HB   LEU  33          HB1       LEU  33   5.102   5.705  -4.882
  257    HG   LEU  33           HG       LEU  33   5.749   3.024  -3.737
  258   1HD1  LEU  33          HD11      LEU  33   5.938   4.196  -6.482
  259   2HD1  LEU  33          HD12      LEU  33   4.796   2.968  -5.926
  260   3HD1  LEU  33          HD13      LEU  33   6.518   2.593  -6.027
  261   1HD2  LEU  33          HD21      LEU  33   7.586   4.553  -3.174
  262   2HD2  LEU  33          HD22      LEU  33   7.733   4.967  -4.883
  263   3HD2  LEU  33          HD23      LEU  33   8.063   3.319  -4.342
  264    H    LYS  34           HN       LYS  34   5.207   7.513  -4.355
  265    HA   LYS  34           HA       LYS  34   6.256   9.430  -4.833
  266   1HB   LYS  34          HB2       LYS  34   6.882  10.804  -3.086
  267   2HB   LYS  34          HB1       LYS  34   5.866   9.618  -2.287
  268   1HG   LYS  34          HG2       LYS  34   7.563   9.689  -0.800
  269   2HG   LYS  34          HG1       LYS  34   8.185   8.428  -1.866
  270   1HD   LYS  34          HD2       LYS  34   9.516  10.126  -3.056
  271   2HD   LYS  34          HD1       LYS  34   8.918  11.358  -1.939
  272   1HE   LYS  34          HE2       LYS  34  10.558   8.929  -1.223
  273   2HE   LYS  34          HE1       LYS  34  11.126  10.598  -1.268
  274   1HZ   LYS  34          HZ1       LYS  34   8.892   9.771   0.483
  275   2HZ   LYS  34          HZ2       LYS  34   9.863  11.155   0.604
  276   3HZ   LYS  34          HZ3       LYS  34  10.498   9.630   0.982
  277    H    ILE  35           HN       ILE  35   8.118   6.923  -3.635
  278    HA   ILE  35           HA       ILE  35   9.940   5.873  -4.301
  279    HB   ILE  35           HB       ILE  35  10.164   6.969  -6.974
  280   1HG1  ILE  35          HG12      ILE  35   7.589   5.587  -6.331
  281   2HG1  ILE  35          HG11      ILE  35   7.667   7.347  -6.367
  282   1HG2  ILE  35          HG21      ILE  35  11.061   4.836  -6.305
  283   2HG2  ILE  35          HG22      ILE  35   9.754   4.547  -7.454
  284   3HG2  ILE  35          HG23      ILE  35   9.478   4.320  -5.717
  285   1HD1  ILE  35          HD11      ILE  35   8.254   5.464  -8.640
  286   2HD1  ILE  35          HD12      ILE  35   8.416   7.217  -8.707
  287   3HD1  ILE  35          HD13      ILE  35   6.830   6.489  -8.461
  288    H    ASP  36           HN       ASP  36  11.960   6.302  -5.917
  289    HA   ASP  36           HA       ASP  36  13.358   8.717  -5.245
  290   1HB   ASP  36          HB2       ASP  36  13.417   7.139  -3.190
  291   2HB   ASP  36          HB1       ASP  36  14.455   6.117  -4.177
  292    H    ILE  37           HN       ILE  37  13.608   5.337  -6.057
  293    HA   ILE  37           HA       ILE  37  14.426   5.725  -8.727
  294    HB   ILE  37           HB       ILE  37  16.539   4.302  -8.298
  295   1HG1  ILE  37          HG12      ILE  37  16.623   5.891  -5.787
  296   2HG1  ILE  37          HG11      ILE  37  15.800   4.334  -5.846
  297   1HG2  ILE  37          HG21      ILE  37  16.588   7.264  -7.787
  298   2HG2  ILE  37          HG22      ILE  37  16.621   6.487  -9.369
  299   3HG2  ILE  37          HG23      ILE  37  17.971   6.275  -8.255
  300   1HD1  ILE  37          HD11      ILE  37  18.091   4.124  -5.020
  301   2HD1  ILE  37          HD12      ILE  37  18.700   4.832  -6.515
  302   3HD1  ILE  37          HD13      ILE  37  17.887   3.268  -6.547
  303    H    GLY  38           HN       GLY  38  12.615   4.179  -6.878
  304   1HA   GLY  38          HA2       GLY  38  12.685   1.633  -8.053
  305   2HA   GLY  38          HA1       GLY  38  13.551   1.586  -6.506
  306    H    ASP  39           HN       ASP  39  12.470   2.740  -4.780
  307    HA   ASP  39           HA       ASP  39   9.648   2.882  -4.621
  308   1HB   ASP  39          HB2       ASP  39  11.032   0.522  -3.406
  309   2HB   ASP  39          HB1       ASP  39   9.514   1.165  -2.815
  310    H    VAL  40           HN       VAL  40   9.419   4.448  -3.596
  311    HA   VAL  40           HA       VAL  40   9.255   5.984  -2.014
  312    HB   VAL  40           HB       VAL  40   8.341   4.271  -0.688
  313   1HG1  VAL  40          HG11      VAL  40  10.131   2.596  -0.796
  314   2HG1  VAL  40          HG12      VAL  40   9.449   2.838   0.817
  315   3HG1  VAL  40          HG13      VAL  40  11.015   3.542   0.406
  316   1HG2  VAL  40          HG21      VAL  40  10.297   5.830   0.914
  317   2HG2  VAL  40          HG22      VAL  40   8.836   5.060   1.533
  318   3HG2  VAL  40          HG23      VAL  40   8.712   6.389   0.378
  319    H    THR  41           HN       THR  41  11.900   4.110  -1.039
  320    HA   THR  41           HA       THR  41  13.774   6.309  -1.241
  321    HB   THR  41           HB       THR  41  13.144   5.305   1.537
  322    HG1  THR  41           HG1      THR  41  12.246   7.436   0.065
  323   1HG2  THR  41          HG21      THR  41  14.801   6.937   2.292
  324   2HG2  THR  41          HG22      THR  41  15.149   7.370   0.617
  325   3HG2  THR  41          HG23      THR  41  15.535   5.755   1.209
  326    HA   PRO  42           HA       PRO  42  16.198   2.617   0.080
  327   1HB   PRO  42          HB2       PRO  42  14.379   0.386   0.637
  328   2HB   PRO  42          HB1       PRO  42  15.714   1.009   1.612
  329   1HG   PRO  42          HG2       PRO  42  13.136   1.371   2.306
  330   2HG   PRO  42          HG1       PRO  42  14.394   2.571   2.661
  331   1HD   PRO  42          HD2       PRO  42  12.365   2.554   0.461
  332   2HD   PRO  42          HD1       PRO  42  12.915   3.903   1.474
  333    H    ASP  43           HN       ASP  43  13.568   2.510  -2.141
  334    HA   ASP  43           HA       ASP  43  13.969   2.214  -4.411
  335   1HB   ASP  43          HB2       ASP  43  16.321   2.421  -4.388
  336   2HB   ASP  43          HB1       ASP  43  16.530   1.001  -3.376
  337    H    GLY  44           HN       GLY  44  13.289   0.390  -1.985
  338   1HA   GLY  44          HA2       GLY  44  11.422  -1.125  -3.221
  339   2HA   GLY  44          HA1       GLY  44  12.849  -2.174  -3.137
  340    H    ARG  45           HN       ARG  45  11.218   0.167  -1.097
  341    HA   ARG  45           HA       ARG  45  11.193  -1.635   1.202
  342   1HB   ARG  45          HB2       ARG  45  11.621   0.732   1.540
  343   2HB   ARG  45          HB1       ARG  45  10.175   1.171   0.690
  344   1HG   ARG  45          HG2       ARG  45   9.669   1.456   2.950
  345   2HG   ARG  45          HG1       ARG  45   8.921  -0.078   2.510
  346   1HD   ARG  45          HD2       ARG  45   9.975  -0.348   4.634
  347   2HD   ARG  45          HD1       ARG  45  10.912  -1.242   3.441
  348    HE   ARG  45           HE       ARG  45  12.700   0.092   3.909
  349   1HH1  ARG  45          HH11      ARG  45   9.800   1.724   5.052
  350   2HH1  ARG  45          HH12      ARG  45  10.696   2.974   5.873
  351   1HH2  ARG  45          HH21      ARG  45  13.848   1.705   4.993
  352   2HH2  ARG  45          HH22      ARG  45  13.001   2.969   5.838
  353    H    PHE  46           HN       PHE  46   9.389  -0.070  -1.165
  354    HA   PHE  46           HA       PHE  46   6.833  -1.263  -0.599
  355   1HB   PHE  46          HB2       PHE  46   8.055   0.639  -2.571
  356   2HB   PHE  46          HB1       PHE  46   6.518  -0.121  -2.973
  357    HD1  PHE  46           HD1      PHE  46   8.142   2.568  -1.639
  358    HD2  PHE  46           HD2      PHE  46   4.625   0.258  -1.092
  359    HE1  PHE  46           HE1      PHE  46   7.021   4.533  -0.634
  360    HE2  PHE  46           HE2      PHE  46   3.513   2.166  -0.013
  361    HZ   PHE  46           HZ       PHE  46   4.704   4.309   0.215
  362    H    SER  47           HN       SER  47   5.880  -2.858  -1.879
  363    HA   SER  47           HA       SER  47   6.897  -3.341  -4.540
  364   1HB   SER  47          HB2       SER  47   6.573  -5.616  -2.553
  365   2HB   SER  47          HB1       SER  47   6.891  -5.805  -4.279
  366    HG   SER  47           HG       SER  47   8.650  -4.126  -3.003
  367    H    ILE  48           HN       ILE  48   4.904  -2.071  -4.715
  368    HA   ILE  48           HA       ILE  48   2.494  -2.993  -3.534
  369    HB   ILE  48           HB       ILE  48   1.382  -1.143  -4.502
  370   1HG1  ILE  48          HG12      ILE  48   2.105  -1.371  -6.830
  371   2HG1  ILE  48          HG11      ILE  48   2.330   0.280  -6.264
  372   1HG2  ILE  48          HG21      ILE  48   4.226  -0.316  -3.955
  373   2HG2  ILE  48          HG22      ILE  48   2.954  -0.552  -2.756
  374   3HG2  ILE  48          HG23      ILE  48   2.818   0.747  -3.938
  375   1HD1  ILE  48          HD11      ILE  48   4.703  -0.159  -5.946
  376   2HD1  ILE  48          HD12      ILE  48   4.199  -0.460  -7.615
  377   3HD1  ILE  48          HD13      ILE  48   4.460  -1.817  -6.509
  378    H    ASP  49           HN       ASP  49   1.299  -4.588  -4.175
  379    HA   ASP  49           HA       ASP  49   0.221  -4.392  -6.841
  380   1HB   ASP  49          HB2       ASP  49   0.491  -6.741  -7.451
  381   2HB   ASP  49          HB1       ASP  49   2.058  -5.975  -7.230
  382    H    THR  50           HN       THR  50  -1.805  -4.793  -6.901
  383    HA   THR  50           HA       THR  50  -3.632  -5.264  -5.005
  384    HB   THR  50           HB       THR  50  -5.024  -6.335  -6.847
  385    HG1  THR  50           HG1      THR  50  -3.895  -7.058  -8.482
  386   1HG2  THR  50          HG21      THR  50  -5.188  -4.242  -8.101
  387   2HG2  THR  50          HG22      THR  50  -3.648  -3.710  -7.427
  388   3HG2  THR  50          HG23      THR  50  -5.044  -3.929  -6.371
  389    H    LEU  51           HN       LEU  51  -1.712  -7.888  -6.479
  390    HA   LEU  51           HA       LEU  51  -3.808  -9.682  -6.680
  391   1HB   LEU  51          HB2       LEU  51  -1.677  -9.812  -7.884
  392   2HB   LEU  51          HB1       LEU  51  -0.886 -10.339  -6.413
  393    HG   LEU  51           HG       LEU  51  -2.310 -12.369  -6.404
  394   1HD1  LEU  51          HD11      LEU  51  -4.210 -11.460  -7.640
  395   2HD1  LEU  51          HD12      LEU  51  -3.599 -12.934  -8.392
  396   3HD1  LEU  51          HD13      LEU  51  -3.219 -11.361  -9.097
  397   1HD2  LEU  51          HD21      LEU  51  -1.181 -13.484  -8.261
  398   2HD2  LEU  51          HD22      LEU  51  -0.078 -12.422  -7.387
  399   3HD2  LEU  51          HD23      LEU  51  -0.742 -11.917  -8.941
  400    H    ARG  52           HN       ARG  52  -1.554  -9.448  -3.907
  401    HA   ARG  52           HA       ARG  52  -2.367 -11.887  -2.712
  402   1HB   ARG  52          HB2       ARG  52  -1.562  -9.595  -0.975
  403   2HB   ARG  52          HB1       ARG  52  -1.110 -11.290  -0.869
  404   1HG   ARG  52          HG2       ARG  52  -0.049  -9.238  -2.794
  405   2HG   ARG  52          HG1       ARG  52   0.816 -10.015  -1.468
  406   1HD   ARG  52          HD2       ARG  52   1.239 -11.865  -2.671
  407   2HD   ARG  52          HD1       ARG  52  -0.357 -11.862  -3.426
  408    HE   ARG  52           HE       ARG  52   1.077  -9.708  -4.477
  409   1HH1  ARG  52          HH11      ARG  52   1.174 -13.216  -4.542
  410   2HH1  ARG  52          HH12      ARG  52   1.942 -13.286  -6.094
  411   1HH2  ARG  52          HH21      ARG  52   2.055  -9.793  -6.487
  412   2HH2  ARG  52          HH22      ARG  52   2.455 -11.326  -7.213
  413    H    CYS  53           HN       CYS  53  -3.199  -8.594  -1.893
  414    HA   CYS  53           HA       CYS  53  -5.492  -9.129  -0.352
  415   1HB   CYS  53          HB2       CYS  53  -4.146  -7.035  -0.230
  416   2HB   CYS  53          HB1       CYS  53  -4.798  -6.572  -1.799
  417    H    VAL  54           HN       VAL  54  -7.696  -7.957  -1.182
  418    HA   VAL  54           HA       VAL  54  -9.607  -8.559  -2.193
  419    HB   VAL  54           HB       VAL  54  -9.874  -8.806  -4.472
  420   1HG1  VAL  54          HG11      VAL  54  -8.953  -6.652  -4.051
  421   2HG1  VAL  54          HG12      VAL  54  -8.348  -7.243  -5.600
  422   3HG1  VAL  54          HG13      VAL  54  -7.309  -7.278  -4.176
  423   1HG2  VAL  54          HG21      VAL  54  -8.212  -9.585  -6.089
  424   2HG2  VAL  54          HG22      VAL  54  -8.549 -10.805  -4.860
  425   3HG2  VAL  54          HG23      VAL  54  -7.063  -9.858  -4.778
  426    H    GLY  55           HN       GLY  55  -7.968 -10.266  -0.645
  427   1HA   GLY  55          HA2       GLY  55  -8.830 -12.909  -1.590
  428   2HA   GLY  55          HA1       GLY  55  -7.445 -12.629  -0.545
  429    H    GLY  56           HN       GLY  56 -10.988 -11.864  -0.520
  430   1HA   GLY  56          HA2       GLY  56 -12.565 -12.425   1.068
  431   2HA   GLY  56          HA1       GLY  56 -11.450 -13.663   1.608
  432    H    CYS  57           HN       CYS  57 -11.800 -10.045   1.882
  433    HA   CYS  57           HA       CYS  57 -10.531 -10.324   4.574
  434   1HB   CYS  57          HB2       CYS  57 -10.036  -7.903   2.983
  435   2HB   CYS  57          HB1       CYS  57  -9.005  -8.698   4.125
  436    H    ALA  58           HN       ALA  58 -12.629  -8.653   2.346
  437    HA   ALA  58           HA       ALA  58 -12.463  -6.059   3.122
  438   1HB   ALA  58          HB1       ALA  58 -14.527  -5.682   1.950
  439   2HB   ALA  58          HB2       ALA  58 -14.928  -7.398   2.049
  440   3HB   ALA  58          HB3       ALA  58 -13.543  -6.868   1.093
  441    H    LEU  59           HN       LEU  59 -14.481  -8.463   4.876
  442    HA   LEU  59           HA       LEU  59 -15.888  -6.347   6.224
  443   1HB   LEU  59          HB2       LEU  59 -16.433  -8.226   7.888
  444   2HB   LEU  59          HB1       LEU  59 -17.063  -8.336   6.259
  445    HG   LEU  59           HG       LEU  59 -15.161  -9.891   5.714
  446   1HD1  LEU  59          HD11      LEU  59 -14.791  -9.909   8.706
  447   2HD1  LEU  59          HD12      LEU  59 -13.647  -9.272   7.525
  448   3HD1  LEU  59          HD13      LEU  59 -14.013 -10.997   7.556
  449   1HD2  LEU  59          HD21      LEU  59 -17.430 -10.676   6.187
  450   2HD2  LEU  59          HD22      LEU  59 -17.035 -10.769   7.904
  451   3HD2  LEU  59          HD23      LEU  59 -16.209 -11.817   6.751
  452    H    ALA  60           HN       ALA  60 -12.702  -7.198   6.408
  453    HA   ALA  60           HA       ALA  60 -12.510  -5.569   8.862
  454   1HB   ALA  60          HB1       ALA  60 -10.467  -7.444   7.655
  455   2HB   ALA  60          HB2       ALA  60 -11.366  -7.706   9.149
  456   3HB   ALA  60          HB3       ALA  60 -10.186  -6.400   9.047
  457    HA   PRO  61           HA       PRO  61 -10.330  -2.840   5.900
  458   1HB   PRO  61          HB2       PRO  61  -8.769  -1.387   7.577
  459   2HB   PRO  61          HB1       PRO  61 -10.488  -1.045   7.353
  460   1HG   PRO  61          HG2       PRO  61  -9.110  -2.457   9.590
  461   2HG   PRO  61          HG1       PRO  61 -10.506  -1.368   9.641
  462   1HD   PRO  61          HD2       PRO  61 -10.654  -4.124   9.771
  463   2HD   PRO  61          HD1       PRO  61 -11.983  -3.068   9.254
  464    H    ILE  62           HN       ILE  62  -8.781  -3.879   4.742
  465    HA   ILE  62           HA       ILE  62  -6.455  -4.948   6.193
  466    HB   ILE  62           HB       ILE  62  -7.602  -5.772   3.529
  467   1HG1  ILE  62          HG12      ILE  62  -8.792  -6.611   5.508
  468   2HG1  ILE  62          HG11      ILE  62  -7.981  -7.913   4.647
  469   1HG2  ILE  62          HG21      ILE  62  -5.835  -7.460   3.435
  470   2HG2  ILE  62          HG22      ILE  62  -5.120  -6.791   4.902
  471   3HG2  ILE  62          HG23      ILE  62  -5.163  -5.826   3.426
  472   1HD1  ILE  62          HD11      ILE  62  -6.197  -7.916   6.300
  473   2HD1  ILE  62          HD12      ILE  62  -7.771  -8.146   7.065
  474   3HD1  ILE  62          HD13      ILE  62  -6.972  -6.577   7.151
  475    H    VAL  63           HN       VAL  63  -4.485  -3.990   5.869
  476    HA   VAL  63           HA       VAL  63  -4.000  -3.040   3.131
  477    HB   VAL  63           HB       VAL  63  -2.767  -1.670   5.529
  478   1HG1  VAL  63          HG11      VAL  63  -2.209   0.059   3.895
  479   2HG1  VAL  63          HG12      VAL  63  -2.988  -0.889   2.626
  480   3HG1  VAL  63          HG13      VAL  63  -1.545  -1.509   3.432
  481   1HG2  VAL  63          HG21      VAL  63  -5.172  -0.751   3.950
  482   2HG2  VAL  63          HG22      VAL  63  -4.308   0.207   5.152
  483   3HG2  VAL  63          HG23      VAL  63  -5.166  -1.255   5.640
  484    H    MET  64           HN       MET  64  -2.218  -4.210   2.297
  485    HA   MET  64           HA       MET  64  -0.623  -5.492   4.424
  486   1HB   MET  64          HB2       MET  64  -2.023  -7.048   3.085
  487   2HB   MET  64          HB1       MET  64  -1.122  -6.565   1.650
  488   1HG   MET  64          HG2       MET  64   0.945  -7.290   2.799
  489   2HG   MET  64          HG1       MET  64  -0.054  -7.929   4.100
  490   1HE   MET  64          HE1       MET  64  -2.567  -8.955   2.412
  491   2HE   MET  64          HE2       MET  64  -1.855  -9.846   3.755
  492   3HE   MET  64          HE3       MET  64  -2.146 -10.657   2.217
  493    H    VAL  65           HN       VAL  65   1.472  -5.115   4.476
  494    HA   VAL  65           HA       VAL  65   2.807  -4.751   1.874
  495    HB   VAL  65           HB       VAL  65   4.766  -3.939   3.454
  496   1HG1  VAL  65          HG11      VAL  65   3.799  -2.593   1.660
  497   2HG1  VAL  65          HG12      VAL  65   4.147  -1.621   3.092
  498   3HG1  VAL  65          HG13      VAL  65   2.488  -2.105   2.738
  499   1HG2  VAL  65          HG21      VAL  65   3.660  -4.266   5.533
  500   2HG2  VAL  65          HG22      VAL  65   2.299  -3.269   5.018
  501   3HG2  VAL  65          HG23      VAL  65   3.883  -2.532   5.286
  502    H    GLY  66           HN       GLY  66   3.722  -6.652   1.387
  503   1HA   GLY  66          HA2       GLY  66   4.604  -8.740   1.613
  504   2HA   GLY  66          HA1       GLY  66   5.641  -7.949   2.809
  505    H    GLU  67           HN       GLU  67   5.771  -9.583   4.076
  506    HA   GLU  67           HA       GLU  67   3.466 -10.837   5.300
  507   1HB   GLU  67          HB2       GLU  67   5.134 -12.066   6.656
  508   2HB   GLU  67          HB1       GLU  67   5.442 -12.208   4.934
  509   1HG   GLU  67          HG2       GLU  67   6.870 -10.214   6.669
  510   2HG   GLU  67          HG1       GLU  67   7.447 -11.863   6.442
  511    H    LYS  68           HN       LYS  68   3.829  -7.937   5.517
  512    HA   LYS  68           HA       LYS  68   4.362  -7.659   8.386
  513   1HB   LYS  68          HB2       LYS  68   4.251  -5.447   6.337
  514   2HB   LYS  68          HB1       LYS  68   4.788  -5.313   8.002
  515   1HG   LYS  68          HG2       LYS  68   6.188  -6.746   5.744
  516   2HG   LYS  68          HG1       LYS  68   6.699  -5.272   6.563
  517   1HD   LYS  68          HD2       LYS  68   6.448  -7.986   7.868
  518   2HD   LYS  68          HD1       LYS  68   7.955  -7.240   7.335
  519   1HE   LYS  68          HE2       LYS  68   6.088  -6.106   9.418
  520   2HE   LYS  68          HE1       LYS  68   7.576  -6.987   9.758
  521   1HZ   LYS  68          HZ1       LYS  68   8.752  -5.243   8.453
  522   2HZ   LYS  68          HZ2       LYS  68   8.062  -4.691   9.899
  523   3HZ   LYS  68          HZ3       LYS  68   7.307  -4.356   8.422
  524    H    VAL  69           HN       VAL  69   1.981  -7.439   5.950
  525    HA   VAL  69           HA       VAL  69  -0.119  -6.448   5.853
  526    HB   VAL  69           HB       VAL  69  -1.674  -7.490   7.549
  527   1HG1  VAL  69          HG11      VAL  69  -1.231  -8.491   5.384
  528   2HG1  VAL  69          HG12      VAL  69  -1.401  -9.736   6.621
  529   3HG1  VAL  69          HG13      VAL  69   0.200  -9.297   6.029
  530   1HG2  VAL  69          HG21      VAL  69  -0.762  -9.321   8.922
  531   2HG2  VAL  69          HG22      VAL  69  -0.154  -7.744   9.426
  532   3HG2  VAL  69          HG23      VAL  69   0.871  -8.821   8.478
  533    H    TYR  70           HN       TYR  70   0.021  -4.263   6.108
  534    HA   TYR  70           HA       TYR  70   0.140  -3.140   8.796
  535   1HB   TYR  70          HB2       TYR  70   0.859  -2.120   6.084
  536   2HB   TYR  70          HB1       TYR  70   0.520  -0.983   7.390
  537    HD1  TYR  70           HD1      TYR  70   1.814  -3.991   8.685
  538    HD2  TYR  70           HD2      TYR  70   2.982  -0.372   6.796
  539    HE1  TYR  70           HE1      TYR  70   4.045  -4.273   9.552
  540    HE2  TYR  70           HE2      TYR  70   5.246  -0.639   7.669
  541    HH   TYR  70           HH       TYR  70   6.406  -3.522   8.957
  542    H    GLY  71           HN       GLY  71  -0.734  -0.731   8.565
  543   1HA   GLY  71          HA2       GLY  71  -3.429  -0.762   7.406
  544   2HA   GLY  71          HA1       GLY  71  -3.169  -0.191   9.052
  545    H    ASN  72           HN       ASN  72  -1.510   0.274   5.915
  546    HA   ASN  72           HA       ASN  72  -1.302   3.104   6.526
  547   1HB   ASN  72          HB2       ASN  72   0.706   2.030   5.631
  548   2HB   ASN  72          HB1       ASN  72  -0.127   1.575   4.162
  549   1HD2  ASN  72          HD21      ASN  72   2.203   3.157   4.683
  550   2HD2  ASN  72          HD22      ASN  72   1.946   4.691   3.934
  551    H    VAL  73           HN       VAL  73  -3.807   1.905   6.186
  552    HA   VAL  73           HA       VAL  73  -5.821   2.810   5.752
  553    HB   VAL  73           HB       VAL  73  -5.865   4.963   6.451
  554   1HG1  VAL  73          HG11      VAL  73  -4.182   3.824   7.847
  555   2HG1  VAL  73          HG12      VAL  73  -3.853   5.552   7.715
  556   3HG1  VAL  73          HG13      VAL  73  -2.898   4.397   6.764
  557   1HG2  VAL  73          HG21      VAL  73  -5.222   5.979   4.352
  558   2HG2  VAL  73          HG22      VAL  73  -3.530   5.605   4.675
  559   3HG2  VAL  73          HG23      VAL  73  -4.390   6.756   5.698
  560    H    THR  74           HN       THR  74  -6.688   4.995   4.181
  561    HA   THR  74           HA       THR  74  -5.674   4.409   1.512
  562    HB   THR  74           HB       THR  74  -7.809   4.243   0.500
  563    HG1  THR  74           HG1      THR  74  -9.328   4.330   2.822
  564   1HG2  THR  74          HG21      THR  74  -8.796   2.305   1.655
  565   2HG2  THR  74          HG22      THR  74  -7.813   2.670   3.079
  566   3HG2  THR  74          HG23      THR  74  -7.038   2.190   1.565
  567    HA   PRO  75           HA       PRO  75  -7.729   8.728   1.290
  568   1HB   PRO  75          HB2       PRO  75  -8.072   9.831   3.948
  569   2HB   PRO  75          HB1       PRO  75  -9.285   9.533   2.703
  570   1HG   PRO  75          HG2       PRO  75  -9.155   8.118   5.025
  571   2HG   PRO  75          HG1       PRO  75  -9.789   7.448   3.511
  572   1HD   PRO  75          HD2       PRO  75  -7.085   7.087   4.755
  573   2HD   PRO  75          HD1       PRO  75  -8.133   5.886   3.969
  574    H    GLY  76           HN       GLY  76  -6.449   9.769   4.422
  575   1HA   GLY  76          HA2       GLY  76  -4.142  10.926   2.994
  576   2HA   GLY  76          HA1       GLY  76  -5.122  11.889   4.090
  577    H    GLN  77           HN       GLN  77  -4.996   8.817   5.282
  578    HA   GLN  77           HA       GLN  77  -3.205   9.687   7.415
  579   1HB   GLN  77          HB2       GLN  77  -4.713   7.075   7.057
  580   2HB   GLN  77          HB1       GLN  77  -3.876   7.584   8.515
  581   1HG   GLN  77          HG2       GLN  77  -5.459   9.217   8.999
  582   2HG   GLN  77          HG1       GLN  77  -6.095   9.213   7.357
  583   1HE2  GLN  77          HE21      GLN  77  -6.330   6.336   7.100
  584   2HE2  GLN  77          HE22      GLN  77  -7.632   5.859   8.137
  585    H    VAL  78           HN       VAL  78  -3.239   8.203   4.534
  586    HA   VAL  78           HA       VAL  78  -1.491   6.127   4.463
  587    HB   VAL  78           HB       VAL  78  -1.019   7.110   2.143
  588   1HG1  VAL  78          HG11      VAL  78  -3.837   6.509   2.919
  589   2HG1  VAL  78          HG12      VAL  78  -2.632   5.355   2.347
  590   3HG1  VAL  78          HG13      VAL  78  -3.268   6.592   1.252
  591   1HG2  VAL  78          HG21      VAL  78  -2.491   8.832   1.344
  592   2HG2  VAL  78          HG22      VAL  78  -1.473   9.396   2.680
  593   3HG2  VAL  78          HG23      VAL  78  -3.159   8.985   2.971
  594    H    LYS  79           HN       LYS  79  -0.958   9.568   4.412
  595    HA   LYS  79           HA       LYS  79   1.614   9.635   3.327
  596   1HB   LYS  79          HB2       LYS  79   0.667  11.687   5.314
  597   2HB   LYS  79          HB1       LYS  79   1.643  11.924   3.877
  598   1HG   LYS  79          HG2       LYS  79  -0.273  11.671   2.456
  599   2HG   LYS  79          HG1       LYS  79  -1.289  11.200   3.826
  600   1HD   LYS  79          HD2       LYS  79  -0.865  13.409   4.849
  601   2HD   LYS  79          HD1       LYS  79   0.047  13.875   3.413
  602   1HE   LYS  79          HE2       LYS  79  -2.832  12.997   3.353
  603   2HE   LYS  79          HE1       LYS  79  -2.333  14.682   3.495
  604   1HZ   LYS  79          HZ1       LYS  79  -2.793  14.204   1.219
  605   2HZ   LYS  79          HZ2       LYS  79  -1.788  12.841   1.226
  606   3HZ   LYS  79          HZ3       LYS  79  -1.110  14.392   1.372
  607    H    LYS  80           HN       LYS  80   0.398   9.567   6.563
  608    HA   LYS  80           HA       LYS  80   2.965   9.871   7.831
  609   1HB   LYS  80          HB2       LYS  80   1.144   9.010   9.741
  610   2HB   LYS  80          HB1       LYS  80   1.531  10.684   9.379
  611   1HG   LYS  80          HG2       LYS  80  -0.614   9.209   7.865
  612   2HG   LYS  80          HG1       LYS  80  -0.939   9.992   9.420
  613   1HD   LYS  80          HD2       LYS  80   0.393  11.502   7.206
  614   2HD   LYS  80          HD1       LYS  80  -1.356  11.264   7.195
  615   1HE   LYS  80          HE2       LYS  80  -1.542  12.358   9.349
  616   2HE   LYS  80          HE1       LYS  80   0.212  12.453   9.490
  617   1HZ   LYS  80          HZ1       LYS  80  -0.666  14.568   8.822
  618   2HZ   LYS  80          HZ2       LYS  80  -1.478  13.881   7.505
  619   3HZ   LYS  80          HZ3       LYS  80   0.216  13.916   7.533
  620    H    ILE  81           HN       ILE  81   0.612   7.331   7.295
  621    HA   ILE  81           HA       ILE  81   2.171   5.361   8.635
  622    HB   ILE  81           HB       ILE  81   0.092   4.851   6.495
  623   1HG1  ILE  81          HG12      ILE  81  -0.844   6.271   8.271
  624   2HG1  ILE  81          HG11      ILE  81  -1.505   4.642   8.372
  625   1HG2  ILE  81          HG21      ILE  81   1.191   3.171   8.780
  626   2HG2  ILE  81          HG22      ILE  81   1.480   2.908   7.059
  627   3HG2  ILE  81          HG23      ILE  81  -0.139   2.691   7.727
  628   1HD1  ILE  81          HD11      ILE  81   0.016   4.133  10.205
  629   2HD1  ILE  81          HD12      ILE  81  -0.986   5.537  10.574
  630   3HD1  ILE  81          HD13      ILE  81   0.696   5.757  10.095
  631    H    LEU  82           HN       LEU  82   2.382   6.842   5.532
  632    HA   LEU  82           HA       LEU  82   3.941   4.964   4.178
  633   1HB   LEU  82          HB2       LEU  82   3.363   6.799   2.888
  634   2HB   LEU  82          HB1       LEU  82   3.770   7.951   4.142
  635    HG   LEU  82           HG       LEU  82   6.202   7.352   3.725
  636   1HD1  LEU  82          HD11      LEU  82   6.733   6.395   1.541
  637   2HD1  LEU  82          HD12      LEU  82   5.018   6.101   1.254
  638   3HD1  LEU  82          HD13      LEU  82   5.853   5.254   2.559
  639   1HD2  LEU  82          HD21      LEU  82   6.368   8.817   1.774
  640   2HD2  LEU  82          HD22      LEU  82   5.212   9.438   2.952
  641   3HD2  LEU  82          HD23      LEU  82   4.638   8.636   1.491
  642    H    ALA  83           HN       ALA  83   4.866   7.331   6.674
  643    HA   ALA  83           HA       ALA  83   7.610   6.739   6.738
  644   1HB   ALA  83          HB1       ALA  83   5.775   7.428   9.035
  645   2HB   ALA  83          HB2       ALA  83   6.664   8.570   8.026
  646   3HB   ALA  83          HB3       ALA  83   7.537   7.466   9.088
  647    H    GLU  84           HN       GLU  84   4.820   5.080   8.000
  648    HA   GLU  84           HA       GLU  84   6.137   3.032   9.428
  649   1HB   GLU  84          HB2       GLU  84   3.418   3.612   8.457
  650   2HB   GLU  84          HB1       GLU  84   3.792   1.918   8.719
  651   1HG   GLU  84          HG2       GLU  84   4.415   3.919  10.839
  652   2HG   GLU  84          HG1       GLU  84   2.756   3.350  10.623
  653    H    TYR  85           HN       TYR  85   5.331   3.447   6.017
  654    HA   TYR  85           HA       TYR  85   5.739   0.716   5.374
  655   1HB   TYR  85          HB2       TYR  85   4.982   3.208   3.987
  656   2HB   TYR  85          HB1       TYR  85   5.709   1.943   3.013
  657    HD1  TYR  85           HD1      TYR  85   3.972   0.851   5.848
  658    HD2  TYR  85           HD2      TYR  85   3.598   1.897   1.874
  659    HE1  TYR  85           HE1      TYR  85   2.036  -0.542   5.759
  660    HE2  TYR  85           HE2      TYR  85   1.574   0.554   1.730
  661    HH   TYR  85           HH       TYR  85   0.469  -1.274   2.784
  Start of MODEL    6
    1   1H    MET   1          HT1       MET   1  11.906  -9.600  14.507
    2   2H    MET   1          HT2       MET   1  12.305  -8.543  15.768
    3   3H    MET   1          HT3       MET   1  13.122 -10.023  15.614
    4    HA   MET   1           HA       MET   1  13.222  -7.744  13.732
    5   1HB   MET   1          HB2       MET   1  15.630  -7.665  14.380
    6   2HB   MET   1          HB1       MET   1  14.533  -7.260  15.689
    7   1HG   MET   1          HG2       MET   1  14.825  -9.476  16.646
    8   2HG   MET   1          HG1       MET   1  15.876  -9.930  15.305
    9   1HE   MET   1          HE1       MET   1  15.434  -7.599  18.425
   10   2HE   MET   1          HE2       MET   1  15.776  -6.444  17.138
   11   3HE   MET   1          HE3       MET   1  16.954  -6.704  18.425
   12    H    VAL   2           HN       VAL   2  12.456  -9.323  12.158
   13    HA   VAL   2           HA       VAL   2  14.601 -11.151  11.302
   14    HB   VAL   2           HB       VAL   2  12.586 -12.384  11.815
   15   1HG1  VAL   2          HG11      VAL   2  10.473 -12.007  10.656
   16   2HG1  VAL   2          HG12      VAL   2  11.166 -10.609   9.839
   17   3HG1  VAL   2          HG13      VAL   2  10.952 -10.590  11.589
   18   1HG2  VAL   2          HG21      VAL   2  12.166 -13.477   9.660
   19   2HG2  VAL   2          HG22      VAL   2  13.885 -13.184   9.931
   20   3HG2  VAL   2          HG23      VAL   2  12.976 -12.141   8.837
   21    HA   PRO   3           HA       PRO   3  15.216  -8.283   7.970
   22   1HB   PRO   3          HB2       PRO   3  16.651 -10.525   6.703
   23   2HB   PRO   3          HB1       PRO   3  17.241  -8.924   7.156
   24   1HG   PRO   3          HG2       PRO   3  17.957 -11.116   8.523
   25   2HG   PRO   3          HG1       PRO   3  17.697  -9.560   9.331
   26   1HD   PRO   3          HD2       PRO   3  15.897 -11.944   9.187
   27   2HD   PRO   3          HD1       PRO   3  16.233 -10.868  10.560
   28    H    LYS   4           HN       LYS   4  13.144  -8.162   7.122
   29    HA   LYS   4           HA       LYS   4  12.452 -10.097   5.031
   30   1HB   LYS   4          HB2       LYS   4  10.826  -7.923   6.353
   31   2HB   LYS   4          HB1       LYS   4  10.243  -8.919   5.030
   32   1HG   LYS   4          HG2       LYS   4  11.169 -10.052   7.657
   33   2HG   LYS   4          HG1       LYS   4   9.496  -9.605   7.325
   34   1HD   LYS   4          HD2       LYS   4   9.446 -11.182   5.452
   35   2HD   LYS   4          HD1       LYS   4  11.122 -11.631   5.781
   36   1HE   LYS   4          HE2       LYS   4  10.523 -12.552   7.912
   37   2HE   LYS   4          HE1       LYS   4   8.883 -11.920   7.781
   38   1HZ   LYS   4          HZ1       LYS   4  10.069 -14.015   6.032
   39   2HZ   LYS   4          HZ2       LYS   4   8.490 -13.401   5.914
   40   3HZ   LYS   4          HZ3       LYS   4   8.956 -14.279   7.286
   41    H    GLY   5           HN       GLY   5  11.275  -6.890   4.931
   42   1HA   GLY   5          HA2       GLY   5  12.098  -4.996   3.787
   43   2HA   GLY   5          HA1       GLY   5  13.294  -6.029   3.003
   44    H    LYS   6           HN       LYS   6  11.919  -4.251   1.515
   45    HA   LYS   6           HA       LYS   6  10.362  -3.898  -0.114
   46   1HB   LYS   6          HB2       LYS   6  10.678  -5.442  -2.033
   47   2HB   LYS   6          HB1       LYS   6  12.176  -4.822  -1.351
   48   1HG   LYS   6          HG2       LYS   6  11.123  -7.501  -0.537
   49   2HG   LYS   6          HG1       LYS   6  12.026  -7.299  -2.041
   50   1HD   LYS   6          HD2       LYS   6  12.986  -6.613   0.739
   51   2HD   LYS   6          HD1       LYS   6  13.511  -7.989  -0.236
   52   1HE   LYS   6          HE2       LYS   6  13.882  -5.089  -0.984
   53   2HE   LYS   6          HE1       LYS   6  15.120  -6.112  -0.259
   54   1HZ   LYS   6          HZ1       LYS   6  14.948  -7.578  -2.197
   55   2HZ   LYS   6          HZ2       LYS   6  15.427  -6.008  -2.620
   56   3HZ   LYS   6          HZ3       LYS   6  13.833  -6.513  -2.907
   57    H    TYR   7           HN       TYR   7   8.972  -4.784   1.966
   58    HA   TYR   7           HA       TYR   7   7.255  -6.806   1.946
   59   1HB   TYR   7          HB2       TYR   7   6.342  -3.966   2.291
   60   2HB   TYR   7          HB1       TYR   7   5.838  -5.403   3.190
   61    HD1  TYR   7           HD1      TYR   7   7.809  -6.661   4.408
   62    HD2  TYR   7           HD2      TYR   7   7.848  -2.591   3.220
   63    HE1  TYR   7           HE1      TYR   7   9.470  -6.196   6.116
   64    HE2  TYR   7           HE2      TYR   7   9.494  -2.095   4.906
   65    HH   TYR   7           HH       TYR   7  10.318  -3.011   7.056
   66    HA   PRO   8           HA       PRO   8   5.204  -6.451  -2.142
   67   1HB   PRO   8          HB2       PRO   8   3.982  -8.853  -0.816
   68   2HB   PRO   8          HB1       PRO   8   4.532  -8.660  -2.491
   69   1HG   PRO   8          HG2       PRO   8   5.991 -10.041  -0.791
   70   2HG   PRO   8          HG1       PRO   8   6.783  -8.895  -1.893
   71   1HD   PRO   8          HD2       PRO   8   6.132  -8.589   1.017
   72   2HD   PRO   8          HD1       PRO   8   7.596  -8.105   0.134
   73    H    ILE   9           HN       ILE   9   3.985  -4.605  -1.576
   74    HA   ILE   9           HA       ILE   9   1.893  -4.906   0.369
   75    HB   ILE   9           HB       ILE   9   2.726  -2.806   0.638
   76   1HG1  ILE   9          HG12      ILE   9   0.177  -2.842   0.000
   77   2HG1  ILE   9          HG11      ILE   9   1.018  -1.324   0.279
   78   1HG2  ILE   9          HG21      ILE   9   3.387  -1.270  -1.144
   79   2HG2  ILE   9          HG22      ILE   9   2.903  -2.459  -2.352
   80   3HG2  ILE   9          HG23      ILE   9   4.234  -2.812  -1.249
   81   1HD1  ILE   9          HD11      ILE   9  -0.457  -1.223  -1.654
   82   2HD1  ILE   9          HD12      ILE   9   0.449  -2.528  -2.418
   83   3HD1  ILE   9          HD13      ILE   9   1.228  -0.976  -2.106
   84    H    SER  10           HN       SER  10  -0.060  -5.443   0.050
   85    HA   SER  10           HA       SER  10  -0.899  -5.964  -2.724
   86   1HB   SER  10          HB2       SER  10  -1.901  -7.256  -0.183
   87   2HB   SER  10          HB1       SER  10  -2.205  -7.784  -1.844
   88    HG   SER  10           HG       SER  10   0.414  -7.602  -1.540
   89    H    VAL  11           HN       VAL  11  -2.615  -4.962  -3.532
   90    HA   VAL  11           HA       VAL  11  -4.342  -3.434  -1.687
   91    HB   VAL  11           HB       VAL  11  -3.852  -2.666  -4.554
   92   1HG1  VAL  11          HG11      VAL  11  -5.806  -1.685  -3.516
   93   2HG1  VAL  11          HG12      VAL  11  -4.569  -0.453  -3.759
   94   3HG1  VAL  11          HG13      VAL  11  -4.833  -1.130  -2.153
   95   1HG2  VAL  11          HG21      VAL  11  -2.248  -1.959  -2.117
   96   2HG2  VAL  11          HG22      VAL  11  -2.253  -0.968  -3.581
   97   3HG2  VAL  11          HG23      VAL  11  -1.686  -2.640  -3.650
   98    H    CYS  12           HN       CYS  12  -6.439  -4.080  -1.672
   99    HA   CYS  12           HA       CYS  12  -7.515  -5.880  -3.573
  100   1HB   CYS  12          HB2       CYS  12  -8.510  -5.837  -1.385
  101   2HB   CYS  12          HB1       CYS  12  -8.898  -4.125  -1.540
  102    H    MET  13           HN       MET  13  -8.185  -5.509  -5.534
  103    HA   MET  13           HA       MET  13  -9.403  -2.905  -6.159
  104   1HB   MET  13          HB2       MET  13  -7.790  -4.752  -7.930
  105   2HB   MET  13          HB1       MET  13  -8.771  -3.437  -8.558
  106   1HG   MET  13          HG2       MET  13  -6.494  -3.115  -6.618
  107   2HG   MET  13          HG1       MET  13  -6.386  -2.867  -8.359
  108   1HE   MET  13          HE1       MET  13  -7.733  -0.945  -9.657
  109   2HE   MET  13          HE2       MET  13  -8.835   0.173  -8.852
  110   3HE   MET  13          HE3       MET  13  -9.230  -1.544  -8.943
  111    H    GLY  14           HN       GLY  14 -10.482  -5.455  -5.044
  112   1HA   GLY  14          HA2       GLY  14 -11.960  -6.795  -7.077
  113   2HA   GLY  14          HA1       GLY  14 -12.251  -6.894  -5.347
  114    H    THR  15           HN       THR  15 -14.464  -6.972  -6.650
  115    HA   THR  15           HA       THR  15 -15.512  -4.530  -7.609
  116    HB   THR  15           HB       THR  15 -17.097  -6.887  -6.584
  117    HG1  THR  15           HG1      THR  15 -15.414  -6.611  -8.763
  118   1HG2  THR  15          HG21      THR  15 -18.750  -6.160  -8.236
  119   2HG2  THR  15          HG22      THR  15 -17.714  -4.806  -8.686
  120   3HG2  THR  15          HG23      THR  15 -18.419  -4.878  -7.071
  121    H    ALA  16           HN       ALA  16 -15.761  -6.155  -4.474
  122    HA   ALA  16           HA       ALA  16 -17.784  -4.427  -3.465
  123   1HB   ALA  16          HB1       ALA  16 -17.442  -5.576  -1.357
  124   2HB   ALA  16          HB2       ALA  16 -15.948  -6.287  -1.966
  125   3HB   ALA  16          HB3       ALA  16 -17.493  -6.732  -2.688
  126    H    CYS  17           HN       CYS  17 -14.341  -4.768  -2.667
  127    HA   CYS  17           HA       CYS  17 -14.327  -2.728  -0.729
  128   1HB   CYS  17          HB2       CYS  17 -12.084  -3.940  -2.321
  129   2HB   CYS  17          HB1       CYS  17 -11.861  -2.915  -0.932
  130    H    PHE  18           HN       PHE  18 -13.786  -2.703  -4.177
  131    HA   PHE  18           HA       PHE  18 -12.513  -0.230  -4.477
  132   1HB   PHE  18          HB2       PHE  18 -12.725  -1.967  -6.244
  133   2HB   PHE  18          HB1       PHE  18 -14.425  -1.553  -6.412
  134    HD1  PHE  18           HD1      PHE  18 -11.020  -0.090  -6.638
  135    HD2  PHE  18           HD2      PHE  18 -15.078   0.089  -7.907
  136    HE1  PHE  18           HE1      PHE  18 -10.421   1.627  -8.294
  137    HE2  PHE  18           HE2      PHE  18 -14.487   1.808  -9.565
  138    HZ   PHE  18           HZ       PHE  18 -12.155   2.577  -9.762
  139    H    VAL  19           HN       VAL  19 -15.836  -0.983  -3.831
  140    HA   VAL  19           HA       VAL  19 -17.031   1.326  -4.982
  141    HB   VAL  19           HB       VAL  19 -18.102  -0.477  -2.798
  142   1HG1  VAL  19          HG11      VAL  19 -20.314   0.295  -3.541
  143   2HG1  VAL  19          HG12      VAL  19 -19.535   1.427  -4.648
  144   3HG1  VAL  19          HG13      VAL  19 -19.328   1.613  -2.907
  145   1HG2  VAL  19          HG21      VAL  19 -19.254  -1.666  -4.581
  146   2HG2  VAL  19          HG22      VAL  19 -17.508  -1.710  -4.827
  147   3HG2  VAL  19          HG23      VAL  19 -18.506  -0.612  -5.782
  148    H    LYS  20           HN       LYS  20 -15.351   0.770  -2.049
  149    HA   LYS  20           HA       LYS  20 -16.656   2.858  -0.538
  150   1HB   LYS  20          HB2       LYS  20 -14.190   1.207   0.037
  151   2HB   LYS  20          HB1       LYS  20 -14.918   2.339   1.169
  152   1HG   LYS  20          HG2       LYS  20 -16.938   1.012   1.244
  153   2HG   LYS  20          HG1       LYS  20 -16.285  -0.085   0.027
  154   1HD   LYS  20          HD2       LYS  20 -14.519  -0.760   1.531
  155   2HD   LYS  20          HD1       LYS  20 -15.065   0.403   2.741
  156   1HE   LYS  20          HE2       LYS  20 -15.829  -1.845   3.286
  157   2HE   LYS  20          HE1       LYS  20 -17.191  -0.785   2.925
  158   1HZ   LYS  20          HZ1       LYS  20 -17.208  -1.731   0.656
  159   2HZ   LYS  20          HZ2       LYS  20 -17.534  -2.877   1.857
  160   3HZ   LYS  20          HZ3       LYS  20 -16.003  -2.833   1.126
  161    H    GLY  21           HN       GLY  21 -14.899   3.238  -3.113
  162   1HA   GLY  21          HA2       GLY  21 -13.901   5.221  -3.848
  163   2HA   GLY  21          HA1       GLY  21 -13.752   5.735  -2.167
  164    H    ALA  22           HN       ALA  22 -12.674   2.640  -3.414
  165    HA   ALA  22           HA       ALA  22 -10.235   2.938  -1.981
  166   1HB   ALA  22          HB1       ALA  22  -9.699   0.713  -2.812
  167   2HB   ALA  22          HB2       ALA  22 -11.036   0.802  -3.958
  168   3HB   ALA  22          HB3       ALA  22 -11.359   0.771  -2.225
  169    H    ASP  23           HN       ASP  23 -11.235   3.610  -5.205
  170    HA   ASP  23           HA       ASP  23  -8.787   3.420  -6.545
  171   1HB   ASP  23          HB2       ASP  23  -9.772   5.187  -8.086
  172   2HB   ASP  23          HB1       ASP  23 -10.733   3.724  -7.875
  173    H    LYS  24           HN       LYS  24 -10.246   6.277  -4.924
  174    HA   LYS  24           HA       LYS  24  -7.908   7.839  -5.408
  175   1HB   LYS  24          HB2       LYS  24  -8.890   9.421  -3.671
  176   2HB   LYS  24          HB1       LYS  24  -9.831   9.157  -5.127
  177   1HG   LYS  24          HG2       LYS  24 -10.442   7.489  -2.745
  178   2HG   LYS  24          HG1       LYS  24 -10.930   9.184  -2.732
  179   1HD   LYS  24          HD2       LYS  24 -11.705   7.095  -4.771
  180   2HD   LYS  24          HD1       LYS  24 -12.751   7.833  -3.562
  181   1HE   LYS  24          HE2       LYS  24 -12.691   9.925  -4.642
  182   2HE   LYS  24          HE1       LYS  24 -11.326   9.449  -5.653
  183   1HZ   LYS  24          HZ1       LYS  24 -12.751   7.868  -6.779
  184   2HZ   LYS  24          HZ2       LYS  24 -13.394   9.434  -6.897
  185   3HZ   LYS  24          HZ3       LYS  24 -14.070   8.317  -5.810
  186    H    VAL  25           HN       VAL  25  -8.942   5.650  -2.961
  187    HA   VAL  25           HA       VAL  25  -7.154   6.297  -0.870
  188    HB   VAL  25           HB       VAL  25  -8.336   3.655  -1.766
  189   1HG1  VAL  25          HG11      VAL  25  -6.301   3.226  -0.509
  190   2HG1  VAL  25          HG12      VAL  25  -7.727   2.758   0.415
  191   3HG1  VAL  25          HG13      VAL  25  -6.882   4.258   0.798
  192   1HG2  VAL  25          HG21      VAL  25  -9.984   5.274  -1.022
  193   2HG2  VAL  25          HG22      VAL  25  -9.081   5.534   0.471
  194   3HG2  VAL  25          HG23      VAL  25  -9.833   3.969   0.155
  195    H    VAL  26           HN       VAL  26  -6.862   3.904  -3.507
  196    HA   VAL  26           HA       VAL  26  -4.193   3.291  -2.774
  197    HB   VAL  26           HB       VAL  26  -5.609   1.712  -4.065
  198   1HG1  VAL  26          HG11      VAL  26  -5.925   2.026  -6.467
  199   2HG1  VAL  26          HG12      VAL  26  -5.176   3.621  -6.358
  200   3HG1  VAL  26          HG13      VAL  26  -6.706   3.308  -5.535
  201   1HG2  VAL  26          HG21      VAL  26  -3.190   1.429  -4.056
  202   2HG2  VAL  26          HG22      VAL  26  -3.047   2.492  -5.456
  203   3HG2  VAL  26          HG23      VAL  26  -3.869   0.938  -5.608
  204    H    HIS  27           HN       HIS  27  -5.702   5.699  -4.795
  205    HA   HIS  27           HA       HIS  27  -3.509   6.411  -6.384
  206   1HB   HIS  27          HB2       HIS  27  -5.929   7.194  -6.644
  207   2HB   HIS  27          HB1       HIS  27  -5.541   8.398  -5.415
  208    HD1  HIS  27           HD1      HIS  27  -3.663  10.175  -6.075
  209    HD2  HIS  27           HD2      HIS  27  -5.013   7.747  -9.167
  210    HE1  HIS  27           HE1      HIS  27  -2.854  11.253  -8.182
  211    HE2  HIS  27           HE2      HIS  27  -3.497   9.660 -10.018
  212    H    ALA  28           HN       ALA  28  -4.552   7.495  -3.251
  213    HA   ALA  28           HA       ALA  28  -2.665   9.490  -2.774
  214   1HB   ALA  28          HB1       ALA  28  -3.047   9.082  -0.395
  215   2HB   ALA  28          HB2       ALA  28  -3.820   7.543  -0.772
  216   3HB   ALA  28          HB3       ALA  28  -4.572   9.054  -1.282
  217    H    PHE  29           HN       PHE  29  -2.542   6.012  -2.182
  218    HA   PHE  29           HA       PHE  29   0.046   5.734  -1.169
  219   1HB   PHE  29          HB2       PHE  29  -1.871   3.997  -1.618
  220   2HB   PHE  29          HB1       PHE  29  -1.061   3.793  -3.163
  221    HD1  PHE  29           HD1      PHE  29   1.741   4.274  -2.164
  222    HD2  PHE  29           HD2      PHE  29  -1.424   1.851  -0.706
  223    HE1  PHE  29           HE1      PHE  29   3.370   2.796  -1.133
  224    HE2  PHE  29           HE2      PHE  29   0.215   0.340   0.333
  225    HZ   PHE  29           HZ       PHE  29   2.625   0.809   0.120
  226    H    LYS  30           HN       LYS  30  -1.092   5.577  -4.508
  227    HA   LYS  30           HA       LYS  30   1.282   5.039  -5.769
  228   1HB   LYS  30          HB2       LYS  30  -1.070   5.252  -6.761
  229   2HB   LYS  30          HB1       LYS  30  -0.706   6.963  -6.929
  230   1HG   LYS  30          HG2       LYS  30   1.098   6.504  -8.424
  231   2HG   LYS  30          HG1       LYS  30   0.959   4.767  -8.137
  232   1HD   LYS  30          HD2       LYS  30  -1.392   4.934  -9.045
  233   2HD   LYS  30          HD1       LYS  30  -0.993   6.576  -9.551
  234   1HE   LYS  30          HE2       LYS  30  -0.706   4.997 -11.384
  235   2HE   LYS  30          HE1       LYS  30   0.833   5.717 -10.918
  236   1HZ   LYS  30          HZ1       LYS  30  -0.080   3.076  -9.928
  237   2HZ   LYS  30          HZ2       LYS  30   1.477   3.746  -9.816
  238   3HZ   LYS  30          HZ3       LYS  30   0.869   3.261 -11.320
  239    H    GLU  31           HN       GLU  31   0.037   8.164  -4.839
  240    HA   GLU  31           HA       GLU  31   2.323   9.484  -6.021
  241   1HB   GLU  31          HB2       GLU  31   1.221  11.588  -5.254
  242   2HB   GLU  31          HB1       GLU  31   0.260  10.612  -6.352
  243   1HG   GLU  31          HG2       GLU  31  -0.991   9.726  -4.433
  244   2HG   GLU  31          HG1       GLU  31  -0.057  10.775  -3.367
  245    H    GLN  32           HN       GLN  32   1.227   8.654  -2.830
  246    HA   GLN  32           HA       GLN  32   3.039  10.234  -1.382
  247   1HB   GLN  32          HB2       GLN  32   2.451   8.945   0.478
  248   2HB   GLN  32          HB1       GLN  32   0.991   9.038  -0.489
  249   1HG   GLN  32          HG2       GLN  32   1.245   6.866  -1.274
  250   2HG   GLN  32          HG1       GLN  32   2.915   6.799  -0.736
  251   1HE2  GLN  32          HE21      GLN  32   2.426   7.879   1.862
  252   2HE2  GLN  32          HE22      GLN  32   1.595   6.651   2.766
  253    H    LEU  33           HN       LEU  33   3.260   7.241  -3.137
  254    HA   LEU  33           HA       LEU  33   5.686   6.257  -2.153
  255   1HB   LEU  33          HB2       LEU  33   4.055   5.264  -3.863
  256   2HB   LEU  33          HB1       LEU  33   4.843   6.300  -5.037
  257    HG   LEU  33           HG       LEU  33   5.542   3.754  -4.448
  258   1HD1  LEU  33          HD11      LEU  33   6.220   4.775  -6.457
  259   2HD1  LEU  33          HD12      LEU  33   7.689   4.269  -5.606
  260   3HD1  LEU  33          HD13      LEU  33   7.191   5.961  -5.585
  261   1HD2  LEU  33          HD21      LEU  33   6.493   4.193  -2.323
  262   2HD2  LEU  33          HD22      LEU  33   7.380   5.580  -2.961
  263   3HD2  LEU  33          HD23      LEU  33   7.838   3.948  -3.452
  264    H    LYS  34           HN       LYS  34   5.055   8.182  -5.001
  265    HA   LYS  34           HA       LYS  34   5.998  10.019  -5.919
  266   1HB   LYS  34          HB2       LYS  34   6.697  11.689  -4.543
  267   2HB   LYS  34          HB1       LYS  34   6.086  10.610  -3.299
  268   1HG   LYS  34          HG2       LYS  34   8.751   9.827  -3.816
  269   2HG   LYS  34          HG1       LYS  34   8.748  11.587  -3.688
  270   1HD   LYS  34          HD2       LYS  34   7.939  11.534  -1.487
  271   2HD   LYS  34          HD1       LYS  34   7.378   9.866  -1.643
  272   1HE   LYS  34          HE2       LYS  34   9.684   9.081  -1.773
  273   2HE   LYS  34          HE1       LYS  34  10.265  10.746  -1.668
  274   1HZ   LYS  34          HZ1       LYS  34  10.446   9.720   0.451
  275   2HZ   LYS  34          HZ2       LYS  34   8.830   9.217   0.432
  276   3HZ   LYS  34          HZ3       LYS  34   9.203  10.865   0.552
  277    H    ILE  35           HN       ILE  35   7.760   7.611  -4.596
  278    HA   ILE  35           HA       ILE  35   9.584   6.498  -4.995
  279    HB   ILE  35           HB       ILE  35  10.201   7.437  -7.618
  280   1HG1  ILE  35          HG12      ILE  35   7.607   6.008  -7.440
  281   2HG1  ILE  35          HG11      ILE  35   7.565   7.763  -7.267
  282   1HG2  ILE  35          HG21      ILE  35   9.885   4.988  -8.012
  283   2HG2  ILE  35          HG22      ILE  35   9.314   4.871  -6.338
  284   3HG2  ILE  35          HG23      ILE  35  10.973   5.369  -6.676
  285   1HD1  ILE  35          HD11      ILE  35   7.125   7.083  -9.557
  286   2HD1  ILE  35          HD12      ILE  35   8.656   6.210  -9.613
  287   3HD1  ILE  35          HD13      ILE  35   8.646   7.965  -9.459
  288    H    ASP  36           HN       ASP  36  11.411   6.654  -4.387
  289    HA   ASP  36           HA       ASP  36  12.811   9.190  -4.170
  290   1HB   ASP  36          HB2       ASP  36  12.579   7.411  -2.324
  291   2HB   ASP  36          HB1       ASP  36  13.753   6.468  -3.227
  292    H    ILE  37           HN       ILE  37  13.182   5.978  -5.371
  293    HA   ILE  37           HA       ILE  37  14.776   6.686  -7.661
  294    HB   ILE  37           HB       ILE  37  16.587   5.065  -6.935
  295   1HG1  ILE  37          HG12      ILE  37  15.182   5.632  -4.381
  296   2HG1  ILE  37          HG11      ILE  37  15.583   4.069  -5.088
  297   1HG2  ILE  37          HG21      ILE  37  17.935   6.765  -5.821
  298   2HG2  ILE  37          HG22      ILE  37  16.485   7.731  -5.550
  299   3HG2  ILE  37          HG23      ILE  37  17.056   7.439  -7.193
  300   1HD1  ILE  37          HD11      ILE  37  16.978   4.538  -3.144
  301   2HD1  ILE  37          HD12      ILE  37  17.563   6.017  -3.907
  302   3HD1  ILE  37          HD13      ILE  37  17.949   4.448  -4.614
  303    H    GLY  38           HN       GLY  38  12.534   4.812  -6.259
  304   1HA   GLY  38          HA2       GLY  38  12.566   2.540  -7.807
  305   2HA   GLY  38          HA1       GLY  38  13.636   2.212  -6.438
  306    H    ASP  39           HN       ASP  39  12.174   3.973  -4.714
  307    HA   ASP  39           HA       ASP  39   9.816   2.356  -4.149
  308   1HB   ASP  39          HB2       ASP  39  12.182   1.571  -3.195
  309   2HB   ASP  39          HB1       ASP  39  11.769   2.741  -1.959
  310    H    VAL  40           HN       VAL  40   9.514   3.086  -1.565
  311    HA   VAL  40           HA       VAL  40   8.417   5.690  -1.679
  312    HB   VAL  40           HB       VAL  40   7.671   5.273   0.423
  313   1HG1  VAL  40          HG11      VAL  40   7.107   3.350  -0.987
  314   2HG1  VAL  40          HG12      VAL  40   7.122   2.980   0.738
  315   3HG1  VAL  40          HG13      VAL  40   8.483   2.497  -0.279
  316   1HG2  VAL  40          HG21      VAL  40   8.808   4.071   2.213
  317   2HG2  VAL  40          HG22      VAL  40   9.811   5.375   1.579
  318   3HG2  VAL  40          HG23      VAL  40  10.135   3.706   1.107
  319    H    THR  41           HN       THR  41  11.215   4.244  -0.881
  320    HA   THR  41           HA       THR  41  12.862   6.519  -0.841
  321    HB   THR  41           HB       THR  41  12.397   5.257   1.859
  322    HG1  THR  41           HG1      THR  41  11.215   7.301   0.762
  323   1HG2  THR  41          HG21      THR  41  14.461   7.297   1.031
  324   2HG2  THR  41          HG22      THR  41  14.778   5.629   1.515
  325   3HG2  THR  41          HG23      THR  41  14.135   6.777   2.689
  326    HA   PRO  42           HA       PRO  42  15.664   3.157   0.453
  327   1HB   PRO  42          HB2       PRO  42  14.296   0.635   0.965
  328   2HB   PRO  42          HB1       PRO  42  15.317   1.589   2.044
  329   1HG   PRO  42          HG2       PRO  42  12.640   1.377   2.375
  330   2HG   PRO  42          HG1       PRO  42  13.553   2.829   2.835
  331   1HD   PRO  42          HD2       PRO  42  11.927   2.318   0.366
  332   2HD   PRO  42          HD1       PRO  42  11.988   3.768   1.390
  333    H    ASP  43           HN       ASP  43  13.303   2.326  -1.952
  334    HA   ASP  43           HA       ASP  43  13.714   1.637  -4.086
  335   1HB   ASP  43          HB2       ASP  43  15.943   2.667  -4.016
  336   2HB   ASP  43          HB1       ASP  43  16.583   1.269  -3.169
  337    H    GLY  44           HN       GLY  44  13.301   0.181  -1.489
  338   1HA   GLY  44          HA2       GLY  44  12.514  -2.192  -2.583
  339   2HA   GLY  44          HA1       GLY  44  14.086  -2.520  -1.848
  340    H    ARG  45           HN       ARG  45  10.995  -1.019  -1.254
  341    HA   ARG  45           HA       ARG  45  10.976  -1.995   1.529
  342   1HB   ARG  45          HB2       ARG  45  11.579   0.461   1.259
  343   2HB   ARG  45          HB1       ARG  45   9.977   0.706   0.581
  344   1HG   ARG  45          HG2       ARG  45   9.814   1.345   2.825
  345   2HG   ARG  45          HG1       ARG  45   9.106  -0.270   2.770
  346   1HD   ARG  45          HD2       ARG  45  11.034  -1.251   3.726
  347   2HD   ARG  45          HD1       ARG  45  11.989   0.213   3.484
  348    HE   ARG  45           HE       ARG  45   9.690   0.604   5.165
  349   1HH1  ARG  45          HH11      ARG  45  13.051  -0.419   5.137
  350   2HH1  ARG  45          HH12      ARG  45  13.321   0.015   6.791
  351   1HH2  ARG  45          HH21      ARG  45  10.033   1.164   7.306
  352   2HH2  ARG  45          HH22      ARG  45  11.583   0.904   8.054
  353    H    PHE  46           HN       PHE  46   9.133  -0.266  -0.905
  354    HA   PHE  46           HA       PHE  46   6.781  -1.877  -0.336
  355   1HB   PHE  46          HB2       PHE  46   5.620  -0.023  -0.915
  356   2HB   PHE  46          HB1       PHE  46   7.148   0.801  -0.658
  357    HD1  PHE  46           HD1      PHE  46   8.663   1.103  -2.633
  358    HD2  PHE  46           HD2      PHE  46   4.540   0.153  -2.993
  359    HE1  PHE  46           HE1      PHE  46   8.666   1.954  -4.956
  360    HE2  PHE  46           HE2      PHE  46   4.534   0.966  -5.311
  361    HZ   PHE  46           HZ       PHE  46   6.603   1.868  -6.300
  362    H    SER  47           HN       SER  47   5.813  -3.132  -1.904
  363    HA   SER  47           HA       SER  47   6.620  -2.942  -4.682
  364   1HB   SER  47          HB2       SER  47   6.950  -5.535  -3.139
  365   2HB   SER  47          HB1       SER  47   7.123  -5.359  -4.885
  366    HG   SER  47           HG       SER  47   8.644  -3.566  -3.499
  367    H    ILE  48           HN       ILE  48   4.562  -2.529  -5.405
  368    HA   ILE  48           HA       ILE  48   2.366  -3.707  -3.914
  369    HB   ILE  48           HB       ILE  48   0.919  -2.100  -4.786
  370   1HG1  ILE  48          HG12      ILE  48   1.418  -2.351  -7.172
  371   2HG1  ILE  48          HG11      ILE  48   1.386  -0.653  -6.711
  372   1HG2  ILE  48          HG21      ILE  48   2.510  -1.132  -3.253
  373   2HG2  ILE  48          HG22      ILE  48   2.042   0.047  -4.478
  374   3HG2  ILE  48          HG23      ILE  48   3.606  -0.761  -4.584
  375   1HD1  ILE  48          HD11      ILE  48   3.817  -0.615  -6.681
  376   2HD1  ILE  48          HD12      ILE  48   3.200  -1.136  -8.250
  377   3HD1  ILE  48          HD13      ILE  48   3.845  -2.326  -7.114
  378    H    ASP  49           HN       ASP  49   1.093  -5.283  -4.565
  379    HA   ASP  49           HA       ASP  49   0.114  -5.103  -7.259
  380   1HB   ASP  49          HB2       ASP  49   0.396  -7.403  -7.920
  381   2HB   ASP  49          HB1       ASP  49   1.974  -6.745  -7.520
  382    H    THR  50           HN       THR  50  -1.956  -5.401  -7.314
  383    HA   THR  50           HA       THR  50  -3.779  -6.029  -5.437
  384    HB   THR  50           HB       THR  50  -3.890  -6.835  -8.341
  385    HG1  THR  50           HG1      THR  50  -4.533  -4.423  -6.960
  386   1HG2  THR  50          HG21      THR  50  -5.672  -7.880  -7.029
  387   2HG2  THR  50          HG22      THR  50  -6.324  -6.619  -8.073
  388   3HG2  THR  50          HG23      THR  50  -6.106  -6.310  -6.351
  389    H    LEU  51           HN       LEU  51  -1.827  -8.480  -7.163
  390    HA   LEU  51           HA       LEU  51  -3.859 -10.347  -7.410
  391   1HB   LEU  51          HB2       LEU  51  -0.892 -10.811  -7.301
  392   2HB   LEU  51          HB1       LEU  51  -2.069 -11.986  -7.857
  393    HG   LEU  51           HG       LEU  51  -1.494  -9.311  -9.136
  394   1HD1  LEU  51          HD11      LEU  51  -0.632 -10.655 -10.989
  395   2HD1  LEU  51          HD12      LEU  51  -0.907 -12.122 -10.051
  396   3HD1  LEU  51          HD13      LEU  51   0.275 -10.935  -9.503
  397   1HD2  LEU  51          HD21      LEU  51  -3.396 -11.500  -9.968
  398   2HD2  LEU  51          HD22      LEU  51  -3.015 -10.054 -10.903
  399   3HD2  LEU  51          HD23      LEU  51  -3.846  -9.908  -9.354
  400    H    ARG  52           HN       ARG  52  -1.485 -10.163  -4.738
  401    HA   ARG  52           HA       ARG  52  -2.295 -12.562  -3.465
  402   1HB   ARG  52          HB2       ARG  52  -1.597 -10.357  -1.643
  403   2HB   ARG  52          HB1       ARG  52  -0.901 -11.963  -1.779
  404   1HG   ARG  52          HG2       ARG  52  -0.295  -9.707  -3.671
  405   2HG   ARG  52          HG1       ARG  52   0.666 -10.086  -2.244
  406   1HD   ARG  52          HD2       ARG  52   1.155 -12.296  -3.150
  407   2HD   ARG  52          HD1       ARG  52   0.152 -11.947  -4.563
  408    HE   ARG  52           HE       ARG  52   1.754 -10.091  -5.023
  409   1HH1  ARG  52          HH11      ARG  52   2.741 -12.905  -3.169
  410   2HH1  ARG  52          HH12      ARG  52   4.433 -12.686  -3.520
  411   1HH2  ARG  52          HH21      ARG  52   3.948  -9.807  -5.473
  412   2HH2  ARG  52          HH22      ARG  52   5.121 -10.925  -4.841
  413    H    CYS  53           HN       CYS  53  -3.130  -9.262  -2.880
  414    HA   CYS  53           HA       CYS  53  -5.116  -9.657  -0.936
  415   1HB   CYS  53          HB2       CYS  53  -3.683  -7.640  -1.198
  416   2HB   CYS  53          HB1       CYS  53  -4.627  -7.214  -2.624
  417    H    VAL  54           HN       VAL  54  -7.366  -8.437  -1.371
  418    HA   VAL  54           HA       VAL  54  -9.467  -8.996  -1.908
  419    HB   VAL  54           HB       VAL  54 -10.238  -9.235  -4.070
  420   1HG1  VAL  54          HG11      VAL  54  -8.944  -7.749  -5.522
  421   2HG1  VAL  54          HG12      VAL  54  -7.588  -7.865  -4.400
  422   3HG1  VAL  54          HG13      VAL  54  -9.104  -7.135  -3.876
  423   1HG2  VAL  54          HG21      VAL  54  -9.129 -11.302  -4.702
  424   2HG2  VAL  54          HG22      VAL  54  -7.617 -10.431  -4.959
  425   3HG2  VAL  54          HG23      VAL  54  -9.007 -10.109  -5.996
  426    H    GLY  55           HN       GLY  55  -7.552 -10.724  -0.752
  427   1HA   GLY  55          HA2       GLY  55  -8.625 -13.372  -1.434
  428   2HA   GLY  55          HA1       GLY  55  -7.032 -13.086  -0.748
  429    H    GLY  56           HN       GLY  56 -10.467 -12.336   0.065
  430   1HA   GLY  56          HA2       GLY  56 -11.634 -12.821   1.986
  431   2HA   GLY  56          HA1       GLY  56 -10.398 -14.006   2.341
  432    H    CYS  57           HN       CYS  57 -10.643 -10.399   2.372
  433    HA   CYS  57           HA       CYS  57  -9.278 -10.438   5.015
  434   1HB   CYS  57          HB2       CYS  57  -8.785  -8.200   3.159
  435   2HB   CYS  57          HB1       CYS  57  -7.748  -8.868   4.375
  436    H    ALA  58           HN       ALA  58 -11.418  -9.029   2.687
  437    HA   ALA  58           HA       ALA  58 -11.430  -6.379   3.221
  438   1HB   ALA  58          HB1       ALA  58 -12.495  -7.438   1.307
  439   2HB   ALA  58          HB2       ALA  58 -13.558  -6.272   2.095
  440   3HB   ALA  58          HB3       ALA  58 -13.800  -8.001   2.351
  441    H    LEU  59           HN       LEU  59 -13.128  -8.762   5.259
  442    HA   LEU  59           HA       LEU  59 -14.818  -6.746   6.414
  443   1HB   LEU  59          HB2       LEU  59 -14.099  -9.547   7.208
  444   2HB   LEU  59          HB1       LEU  59 -15.005  -8.521   8.300
  445    HG   LEU  59           HG       LEU  59 -16.755  -8.269   6.540
  446   1HD1  LEU  59          HD11      LEU  59 -15.170 -10.396   5.110
  447   2HD1  LEU  59          HD12      LEU  59 -15.398  -8.733   4.571
  448   3HD1  LEU  59          HD13      LEU  59 -16.777  -9.828   4.662
  449   1HD2  LEU  59          HD21      LEU  59 -16.964  -9.904   8.345
  450   2HD2  LEU  59          HD22      LEU  59 -16.138 -11.105   7.351
  451   3HD2  LEU  59          HD23      LEU  59 -17.713 -10.479   6.855
  452    H    ALA  60           HN       ALA  60 -11.556  -7.026   6.575
  453    HA   ALA  60           HA       ALA  60 -11.580  -5.237   8.925
  454   1HB   ALA  60          HB1       ALA  60  -9.245  -6.727   7.708
  455   2HB   ALA  60          HB2       ALA  60 -10.050  -7.134   9.224
  456   3HB   ALA  60          HB3       ALA  60  -9.157  -5.619   9.077
  457    HA   PRO  61           HA       PRO  61 -10.258  -2.218   5.756
  458   1HB   PRO  61          HB2       PRO  61  -8.554  -0.833   7.687
  459   2HB   PRO  61          HB1       PRO  61 -10.014  -0.248   6.888
  460   1HG   PRO  61          HG2       PRO  61  -9.910  -0.801   9.547
  461   2HG   PRO  61          HG1       PRO  61 -11.389  -0.967   8.583
  462   1HD   PRO  61          HD2       PRO  61  -9.485  -3.081   9.514
  463   2HD   PRO  61          HD1       PRO  61 -11.261  -3.121   9.421
  464    H    ILE  62           HN       ILE  62  -8.725  -2.880   4.330
  465    HA   ILE  62           HA       ILE  62  -6.272  -4.028   5.465
  466    HB   ILE  62           HB       ILE  62  -7.676  -4.730   2.899
  467   1HG1  ILE  62          HG12      ILE  62  -8.816  -5.554   4.899
  468   2HG1  ILE  62          HG11      ILE  62  -8.078  -6.887   4.017
  469   1HG2  ILE  62          HG21      ILE  62  -5.186  -5.944   4.094
  470   2HG2  ILE  62          HG22      ILE  62  -5.246  -4.921   2.659
  471   3HG2  ILE  62          HG23      ILE  62  -6.025  -6.503   2.647
  472   1HD1  ILE  62          HD11      ILE  62  -6.927  -5.567   6.460
  473   2HD1  ILE  62          HD12      ILE  62  -6.243  -6.943   5.597
  474   3HD1  ILE  62          HD13      ILE  62  -7.789  -7.104   6.429
  475    H    VAL  63           HN       VAL  63  -4.398  -2.881   5.097
  476    HA   VAL  63           HA       VAL  63  -3.881  -2.957   2.246
  477    HB   VAL  63           HB       VAL  63  -4.056  -0.532   2.719
  478   1HG1  VAL  63          HG11      VAL  63  -1.683  -0.969   4.505
  479   2HG1  VAL  63          HG12      VAL  63  -3.316  -0.583   5.043
  480   3HG1  VAL  63          HG13      VAL  63  -2.407   0.582   4.080
  481   1HG2  VAL  63          HG21      VAL  63  -1.284  -1.512   2.056
  482   2HG2  VAL  63          HG22      VAL  63  -1.915   0.098   1.701
  483   3HG2  VAL  63          HG23      VAL  63  -2.626  -1.320   0.928
  484    H    MET  64           HN       MET  64  -2.156  -4.324   1.906
  485    HA   MET  64           HA       MET  64  -0.754  -5.040   4.418
  486   1HB   MET  64          HB2       MET  64  -2.214  -6.819   3.571
  487   2HB   MET  64          HB1       MET  64  -1.405  -6.757   2.010
  488   1HG   MET  64          HG2       MET  64   0.649  -7.494   3.002
  489   2HG   MET  64          HG1       MET  64  -0.080  -7.471   4.609
  490   1HE   MET  64          HE1       MET  64   0.157  -9.297   1.166
  491   2HE   MET  64          HE2       MET  64  -1.528  -8.778   1.150
  492   3HE   MET  64          HE3       MET  64  -1.136 -10.492   1.280
  493    H    VAL  65           HN       VAL  65   1.461  -4.881   4.449
  494    HA   VAL  65           HA       VAL  65   2.795  -4.845   1.798
  495    HB   VAL  65           HB       VAL  65   4.759  -3.986   3.406
  496   1HG1  VAL  65          HG11      VAL  65   3.869  -2.747   1.450
  497   2HG1  VAL  65          HG12      VAL  65   4.320  -1.711   2.808
  498   3HG1  VAL  65          HG13      VAL  65   2.619  -2.072   2.502
  499   1HG2  VAL  65          HG21      VAL  65   2.227  -3.145   4.752
  500   2HG2  VAL  65          HG22      VAL  65   3.804  -2.411   5.063
  501   3HG2  VAL  65          HG23      VAL  65   3.535  -4.119   5.425
  502    H    GLY  66           HN       GLY  66   3.659  -6.825   1.461
  503   1HA   GLY  66          HA2       GLY  66   4.435  -8.923   1.886
  504   2HA   GLY  66          HA1       GLY  66   5.454  -8.104   3.084
  505    H    GLU  67           HN       GLU  67   5.295  -9.935   4.280
  506    HA   GLU  67           HA       GLU  67   2.865 -10.656   5.643
  507   1HB   GLU  67          HB2       GLU  67   5.730 -11.217   6.438
  508   2HB   GLU  67          HB1       GLU  67   4.301 -12.055   7.022
  509   1HG   GLU  67          HG2       GLU  67   3.934 -13.083   4.921
  510   2HG   GLU  67          HG1       GLU  67   5.130 -12.053   4.135
  511    H    LYS  68           HN       LYS  68   3.382  -7.856   5.675
  512    HA   LYS  68           HA       LYS  68   4.073  -7.404   8.493
  513   1HB   LYS  68          HB2       LYS  68   4.195  -5.374   6.269
  514   2HB   LYS  68          HB1       LYS  68   4.735  -5.144   7.921
  515   1HG   LYS  68          HG2       LYS  68   6.006  -6.911   5.817
  516   2HG   LYS  68          HG1       LYS  68   6.636  -5.412   6.489
  517   1HD   LYS  68          HD2       LYS  68   6.183  -7.964   8.040
  518   2HD   LYS  68          HD1       LYS  68   7.743  -7.352   7.486
  519   1HE   LYS  68          HE2       LYS  68   7.401  -5.328   8.852
  520   2HE   LYS  68          HE1       LYS  68   5.884  -6.003   9.440
  521   1HZ   LYS  68          HZ1       LYS  68   7.267  -7.940  10.241
  522   2HZ   LYS  68          HZ2       LYS  68   7.466  -6.477  11.072
  523   3HZ   LYS  68          HZ3       LYS  68   8.634  -6.973   9.943
  524    H    VAL  69           HN       VAL  69   1.669  -6.998   6.062
  525    HA   VAL  69           HA       VAL  69  -0.347  -5.851   5.957
  526    HB   VAL  69           HB       VAL  69  -1.965  -6.569   7.694
  527   1HG1  VAL  69          HG11      VAL  69  -1.527  -7.963   5.768
  528   2HG1  VAL  69          HG12      VAL  69  -1.812  -8.962   7.194
  529   3HG1  VAL  69          HG13      VAL  69  -0.169  -8.722   6.598
  530   1HG2  VAL  69          HG21      VAL  69  -0.488  -6.581   9.645
  531   2HG2  VAL  69          HG22      VAL  69   0.404  -7.941   8.965
  532   3HG2  VAL  69          HG23      VAL  69  -1.285  -8.138   9.427
  533    H    TYR  70           HN       TYR  70  -0.697  -3.676   6.007
  534    HA   TYR  70           HA       TYR  70  -0.307  -2.283   8.585
  535   1HB   TYR  70          HB2       TYR  70   0.593  -1.401   5.825
  536   2HB   TYR  70          HB1       TYR  70   0.345  -0.255   7.145
  537    HD1  TYR  70           HD1      TYR  70   1.586  -3.655   7.614
  538    HD2  TYR  70           HD2      TYR  70   2.661   0.441   7.349
  539    HE1  TYR  70           HE1      TYR  70   3.795  -4.201   8.396
  540    HE2  TYR  70           HE2      TYR  70   4.880  -0.098   8.169
  541    HH   TYR  70           HH       TYR  70   6.202  -3.038   8.168
  542    H    GLY  71           HN       GLY  71  -1.029   0.174   8.051
  543   1HA   GLY  71          HA2       GLY  71  -3.767   0.091   6.957
  544   2HA   GLY  71          HA1       GLY  71  -3.387   0.929   8.457
  545    H    ASN  72           HN       ASN  72  -1.030   0.998   5.952
  546    HA   ASN  72           HA       ASN  72  -1.247   3.845   5.649
  547   1HB   ASN  72          HB2       ASN  72   0.994   2.954   5.525
  548   2HB   ASN  72          HB1       ASN  72   0.554   1.772   4.299
  549   1HD2  ASN  72          HD21      ASN  72   0.000   2.574   2.190
  550   2HD2  ASN  72          HD22      ASN  72   0.626   4.095   1.650
  551    H    VAL  73           HN       VAL  73  -3.261   4.286   4.812
  552    HA   VAL  73           HA       VAL  73  -3.460   4.352   1.986
  553    HB   VAL  73           HB       VAL  73  -5.837   3.146   2.163
  554   1HG1  VAL  73          HG11      VAL  73  -4.216   2.751   0.455
  555   2HG1  VAL  73          HG12      VAL  73  -4.806   1.211   1.083
  556   3HG1  VAL  73          HG13      VAL  73  -3.223   1.817   1.570
  557   1HG2  VAL  73          HG21      VAL  73  -5.579   2.393   4.435
  558   2HG2  VAL  73          HG22      VAL  73  -4.031   1.640   4.035
  559   3HG2  VAL  73          HG23      VAL  73  -5.529   0.993   3.359
  560    H    THR  74           HN       THR  74  -6.044   4.694   1.555
  561    HA   THR  74           HA       THR  74  -7.748   6.145   1.574
  562    HB   THR  74           HB       THR  74  -8.942   6.419   3.754
  563    HG1  THR  74           HG1      THR  74  -7.243   6.287   5.215
  564   1HG2  THR  74          HG21      THR  74  -9.440   4.552   2.269
  565   2HG2  THR  74          HG22      THR  74  -9.567   4.061   3.957
  566   3HG2  THR  74          HG23      THR  74  -8.150   3.607   3.013
  567    HA   PRO  75           HA       PRO  75  -5.496   9.955   1.235
  568   1HB   PRO  75          HB2       PRO  75  -8.330  10.853   1.611
  569   2HB   PRO  75          HB1       PRO  75  -7.122  11.413   0.450
  570   1HG   PRO  75          HG2       PRO  75  -9.079   9.556  -0.111
  571   2HG   PRO  75          HG1       PRO  75  -7.562   9.723  -1.006
  572   1HD   PRO  75          HD2       PRO  75  -8.411   7.523   0.612
  573   2HD   PRO  75          HD1       PRO  75  -6.859   7.720  -0.228
  574    H    GLY  76           HN       GLY  76  -4.398   9.926   3.194
  575   1HA   GLY  76          HA2       GLY  76  -4.624  11.637   5.174
  576   2HA   GLY  76          HA1       GLY  76  -5.894  10.507   5.617
  577    H    GLN  77           HN       GLN  77  -4.831   7.993   5.195
  578    HA   GLN  77           HA       GLN  77  -3.275   8.048   7.671
  579   1HB   GLN  77          HB2       GLN  77  -3.733   5.489   6.180
  580   2HB   GLN  77          HB1       GLN  77  -3.698   5.774   7.914
  581   1HG   GLN  77          HG2       GLN  77  -5.928   7.052   7.444
  582   2HG   GLN  77          HG1       GLN  77  -5.916   6.075   5.964
  583   1HE2  GLN  77          HE21      GLN  77  -6.155   3.880   6.089
  584   2HE2  GLN  77          HE22      GLN  77  -6.678   3.064   7.522
  585    H    VAL  78           HN       VAL  78  -2.990   7.614   4.375
  586    HA   VAL  78           HA       VAL  78  -0.845   6.020   3.943
  587    HB   VAL  78           HB       VAL  78  -0.535   7.673   1.967
  588   1HG1  VAL  78          HG11      VAL  78  -1.553   5.477   1.722
  589   2HG1  VAL  78          HG12      VAL  78  -2.409   6.683   0.757
  590   3HG1  VAL  78          HG13      VAL  78  -3.085   6.142   2.292
  591   1HG2  VAL  78          HG21      VAL  78  -2.282   9.127   1.482
  592   2HG2  VAL  78          HG22      VAL  78  -1.806   9.432   3.165
  593   3HG2  VAL  78          HG23      VAL  78  -3.252   8.479   2.810
  594    H    LYS  79           HN       LYS  79  -0.871   9.520   4.647
  595    HA   LYS  79           HA       LYS  79   1.759   9.961   3.718
  596   1HB   LYS  79          HB2       LYS  79   0.369  11.576   5.865
  597   2HB   LYS  79          HB1       LYS  79   1.615  12.123   4.753
  598   1HG   LYS  79          HG2       LYS  79   0.067  11.942   2.894
  599   2HG   LYS  79          HG1       LYS  79  -1.186  11.331   3.978
  600   1HD   LYS  79          HD2       LYS  79   0.107  14.054   4.059
  601   2HD   LYS  79          HD1       LYS  79  -1.550  13.687   3.580
  602   1HE   LYS  79          HE2       LYS  79  -2.042  12.900   5.831
  603   2HE   LYS  79          HE1       LYS  79  -0.375  13.203   6.313
  604   1HZ   LYS  79          HZ1       LYS  79  -0.790  15.585   5.718
  605   2HZ   LYS  79          HZ2       LYS  79  -1.655  15.018   7.063
  606   3HZ   LYS  79          HZ3       LYS  79  -2.438  15.198   5.568
  607    H    LYS  80           HN       LYS  80   0.328   9.364   6.812
  608    HA   LYS  80           HA       LYS  80   2.808   9.637   8.244
  609   1HB   LYS  80          HB2       LYS  80   1.086   8.662  10.048
  610   2HB   LYS  80          HB1       LYS  80   1.151  10.362   9.625
  611   1HG   LYS  80          HG2       LYS  80  -0.638   8.600   8.025
  612   2HG   LYS  80          HG1       LYS  80  -1.125   8.990   9.683
  613   1HD   LYS  80          HD2       LYS  80  -0.563  10.907   7.414
  614   2HD   LYS  80          HD1       LYS  80  -2.118  10.559   8.165
  615   1HE   LYS  80          HE2       LYS  80   0.228  11.925   9.469
  616   2HE   LYS  80          HE1       LYS  80  -1.290  12.675   8.981
  617   1HZ   LYS  80          HZ1       LYS  80  -1.648  12.323  11.201
  618   2HZ   LYS  80          HZ2       LYS  80  -0.732  10.906  11.254
  619   3HZ   LYS  80          HZ3       LYS  80  -2.286  10.879  10.575
  620    H    ILE  81           HN       ILE  81   0.629   7.050   7.253
  621    HA   ILE  81           HA       ILE  81   2.136   5.074   8.676
  622    HB   ILE  81           HB       ILE  81   0.141   4.584   6.456
  623   1HG1  ILE  81          HG12      ILE  81  -0.908   5.915   8.214
  624   2HG1  ILE  81          HG11      ILE  81  -1.508   4.262   8.272
  625   1HG2  ILE  81          HG21      ILE  81   1.196   2.849   8.729
  626   2HG2  ILE  81          HG22      ILE  81   1.530   2.635   7.006
  627   3HG2  ILE  81          HG23      ILE  81  -0.102   2.386   7.628
  628   1HD1  ILE  81          HD11      ILE  81  -1.128   5.118  10.498
  629   2HD1  ILE  81          HD12      ILE  81   0.553   5.473  10.096
  630   3HD1  ILE  81          HD13      ILE  81  -0.004   3.801  10.151
  631    H    LEU  82           HN       LEU  82   2.447   6.696   5.661
  632    HA   LEU  82           HA       LEU  82   4.113   4.876   4.327
  633   1HB   LEU  82          HB2       LEU  82   3.325   6.940   3.272
  634   2HB   LEU  82          HB1       LEU  82   4.242   7.900   4.421
  635    HG   LEU  82           HG       LEU  82   6.328   6.831   3.532
  636   1HD1  LEU  82          HD11      LEU  82   6.207   5.820   1.298
  637   2HD1  LEU  82          HD12      LEU  82   4.446   5.892   1.364
  638   3HD1  LEU  82          HD13      LEU  82   5.333   4.874   2.500
  639   1HD2  LEU  82          HD21      LEU  82   4.634   8.490   1.662
  640   2HD2  LEU  82          HD22      LEU  82   6.371   8.244   1.493
  641   3HD2  LEU  82          HD23      LEU  82   5.734   9.084   2.907
  642    H    ALA  83           HN       ALA  83   4.822   7.250   6.889
  643    HA   ALA  83           HA       ALA  83   7.577   6.751   7.089
  644   1HB   ALA  83          HB1       ALA  83   5.643   7.299   9.344
  645   2HB   ALA  83          HB2       ALA  83   6.424   8.526   8.347
  646   3HB   ALA  83          HB3       ALA  83   7.395   7.498   9.400
  647    H    GLU  84           HN       GLU  84   4.780   4.973   8.095
  648    HA   GLU  84           HA       GLU  84   6.169   2.941   9.530
  649   1HB   GLU  84          HB2       GLU  84   3.424   3.544   8.812
  650   2HB   GLU  84          HB1       GLU  84   3.789   1.822   8.715
  651   1HG   GLU  84          HG2       GLU  84   4.696   1.974  11.038
  652   2HG   GLU  84          HG1       GLU  84   4.132   3.648  11.089
  653    H    TYR  85           HN       TYR  85   5.234   3.440   6.174
  654    HA   TYR  85           HA       TYR  85   5.752   0.786   5.410
  655   1HB   TYR  85          HB2       TYR  85   4.919   3.299   4.143
  656   2HB   TYR  85          HB1       TYR  85   5.702   2.108   3.122
  657    HD1  TYR  85           HD1      TYR  85   4.207   0.603   5.759
  658    HD2  TYR  85           HD2      TYR  85   3.427   2.262   2.075
  659    HE1  TYR  85           HE1      TYR  85   2.317  -0.821   5.604
  660    HE2  TYR  85           HE2      TYR  85   1.450   0.844   1.905
  661    HH   TYR  85           HH       TYR  85   0.531  -1.194   2.711
  Start of MODEL    7
    1   1H    MET   1          HT1       MET   1   7.431 -19.154  -1.118
    2   2H    MET   1          HT2       MET   1   8.984 -18.476  -1.141
    3   3H    MET   1          HT3       MET   1   8.080 -18.567  -2.572
    4    HA   MET   1           HA       MET   1   6.416 -17.067  -1.582
    5   1HB   MET   1          HB2       MET   1   8.523 -16.926   0.578
    6   2HB   MET   1          HB1       MET   1   7.277 -15.706   0.376
    7   1HG   MET   1          HG2       MET   1   5.556 -17.342   0.806
    8   2HG   MET   1          HG1       MET   1   6.763 -18.622   0.903
    9   1HE   MET   1          HE1       MET   1   4.546 -18.045   3.140
   10   2HE   MET   1          HE2       MET   1   5.502 -18.224   4.614
   11   3HE   MET   1          HE3       MET   1   5.727 -19.348   3.272
   12    H    VAL   2           HN       VAL   2   6.510 -15.472  -2.971
   13    HA   VAL   2           HA       VAL   2   8.952 -14.802  -4.264
   14    HB   VAL   2           HB       VAL   2   7.540 -13.056  -5.447
   15   1HG1  VAL   2          HG11      VAL   2   6.654 -15.936  -5.470
   16   2HG1  VAL   2          HG12      VAL   2   7.959 -15.226  -6.421
   17   3HG1  VAL   2          HG13      VAL   2   6.287 -14.754  -6.726
   18   1HG2  VAL   2          HG21      VAL   2   5.343 -14.393  -3.867
   19   2HG2  VAL   2          HG22      VAL   2   5.103 -13.281  -5.214
   20   3HG2  VAL   2          HG23      VAL   2   5.854 -12.712  -3.724
   21    HA   PRO   3           HA       PRO   3   9.960 -11.367  -1.564
   22   1HB   PRO   3          HB2       PRO   3  12.589 -11.356  -2.656
   23   2HB   PRO   3          HB1       PRO   3  12.076 -12.042  -1.115
   24   1HG   PRO   3          HG2       PRO   3  13.007 -13.494  -3.298
   25   2HG   PRO   3          HG1       PRO   3  12.088 -14.157  -1.936
   26   1HD   PRO   3          HD2       PRO   3  11.147 -13.378  -4.662
   27   2HD   PRO   3          HD1       PRO   3  10.623 -14.724  -3.626
   28    H    LYS   4           HN       LYS   4   8.430 -10.425  -3.324
   29    HA   LYS   4           HA       LYS   4   9.236  -9.154  -5.624
   30   1HB   LYS   4          HB2       LYS   4   6.915  -9.315  -4.465
   31   2HB   LYS   4          HB1       LYS   4   7.387  -7.826  -3.674
   32   1HG   LYS   4          HG2       LYS   4   6.003  -7.339  -5.577
   33   2HG   LYS   4          HG1       LYS   4   7.640  -6.751  -5.865
   34   1HD   LYS   4          HD2       LYS   4   8.110  -8.503  -7.372
   35   2HD   LYS   4          HD1       LYS   4   6.696  -9.428  -6.861
   36   1HE   LYS   4          HE2       LYS   4   5.216  -7.825  -7.872
   37   2HE   LYS   4          HE1       LYS   4   6.563  -6.750  -8.241
   38   1HZ   LYS   4          HZ1       LYS   4   6.476  -9.496  -9.340
   39   2HZ   LYS   4          HZ2       LYS   4   7.318  -8.142  -9.918
   40   3HZ   LYS   4          HZ3       LYS   4   5.636  -8.232 -10.095
   41    H    GLY   5           HN       GLY   5   8.945  -7.641  -2.496
   42   1HA   GLY   5          HA2       GLY   5  11.586  -6.438  -2.806
   43   2HA   GLY   5          HA1       GLY   5  10.221  -5.363  -2.466
   44    H    LYS   6           HN       LYS   6  11.350  -4.872  -0.409
   45    HA   LYS   6           HA       LYS   6  11.618  -6.853   1.563
   46   1HB   LYS   6          HB2       LYS   6  12.709  -4.598   1.598
   47   2HB   LYS   6          HB1       LYS   6  11.126  -3.901   1.954
   48   1HG   LYS   6          HG2       LYS   6  12.469  -4.189   3.967
   49   2HG   LYS   6          HG1       LYS   6  11.000  -5.166   3.990
   50   1HD   LYS   6          HD2       LYS   6  12.766  -6.551   4.795
   51   2HD   LYS   6          HD1       LYS   6  12.367  -7.086   3.159
   52   1HE   LYS   6          HE2       LYS   6  14.258  -5.720   2.308
   53   2HE   LYS   6          HE1       LYS   6  14.698  -5.357   3.976
   54   1HZ   LYS   6          HZ1       LYS   6  16.012  -7.176   3.118
   55   2HZ   LYS   6          HZ2       LYS   6  14.620  -8.064   2.748
   56   3HZ   LYS   6          HZ3       LYS   6  15.012  -7.734   4.365
   57    H    TYR   7           HN       TYR   7   9.019  -4.596   0.727
   58    HA   TYR   7           HA       TYR   7   7.233  -6.281   2.308
   59   1HB   TYR   7          HB2       TYR   7   7.048  -3.268   2.147
   60   2HB   TYR   7          HB1       TYR   7   6.007  -4.338   3.080
   61    HD1  TYR   7           HD1      TYR   7   8.063  -6.145   4.233
   62    HD2  TYR   7           HD2      TYR   7   8.016  -1.936   3.744
   63    HE1  TYR   7           HE1      TYR   7   9.552  -5.924   6.142
   64    HE2  TYR   7           HE2      TYR   7   9.532  -1.681   5.637
   65    HH   TYR   7           HH       TYR   7  11.163  -4.361   7.072
   66    HA   PRO   8           HA       PRO   8   5.733  -6.171  -2.132
   67   1HB   PRO   8          HB2       PRO   8   4.594  -8.617  -0.813
   68   2HB   PRO   8          HB1       PRO   8   5.187  -8.413  -2.471
   69   1HG   PRO   8          HG2       PRO   8   6.693  -9.654  -0.701
   70   2HG   PRO   8          HG1       PRO   8   7.428  -8.465  -1.797
   71   1HD   PRO   8          HD2       PRO   8   6.712  -8.190   1.093
   72   2HD   PRO   8          HD1       PRO   8   8.119  -7.552   0.213
   73    H    ILE   9           HN       ILE   9   4.151  -4.630  -2.160
   74    HA   ILE   9           HA       ILE   9   2.231  -4.495  -0.052
   75    HB   ILE   9           HB       ILE   9   1.422  -2.527  -1.361
   76   1HG1  ILE   9          HG12      ILE   9   3.918  -3.009  -2.946
   77   2HG1  ILE   9          HG11      ILE   9   2.264  -3.102  -3.552
   78   1HG2  ILE   9          HG21      ILE   9   3.335  -1.106  -0.719
   79   2HG2  ILE   9          HG22      ILE   9   4.274  -2.574  -0.447
   80   3HG2  ILE   9          HG23      ILE   9   2.855  -2.239   0.545
   81   1HD1  ILE   9          HD11      ILE   9   3.639  -0.641  -2.506
   82   2HD1  ILE   9          HD12      ILE   9   1.966  -0.725  -3.060
   83   3HD1  ILE   9          HD13      ILE   9   3.286  -1.012  -4.192
   84    H    SER  10           HN       SER  10   0.197  -5.166  -0.096
   85    HA   SER  10           HA       SER  10  -0.809  -6.256  -2.623
   86   1HB   SER  10          HB2       SER  10  -2.335  -7.538  -1.429
   87   2HB   SER  10          HB1       SER  10  -0.964  -7.484  -0.319
   88    HG   SER  10           HG       SER  10  -3.493  -6.564   0.005
   89    H    VAL  11           HN       VAL  11  -2.352  -5.300  -3.773
   90    HA   VAL  11           HA       VAL  11  -3.570  -2.901  -2.578
   91    HB   VAL  11           HB       VAL  11  -3.085  -3.411  -5.514
   92   1HG1  VAL  11          HG11      VAL  11  -4.921  -1.885  -5.114
   93   2HG1  VAL  11          HG12      VAL  11  -3.525  -0.993  -5.718
   94   3HG1  VAL  11          HG13      VAL  11  -3.929  -0.941  -4.002
   95   1HG2  VAL  11          HG21      VAL  11  -1.384  -1.459  -4.983
   96   2HG2  VAL  11          HG22      VAL  11  -0.942  -3.160  -4.806
   97   3HG2  VAL  11          HG23      VAL  11  -1.401  -2.213  -3.378
   98    H    CYS  12           HN       CYS  12  -5.634  -3.107  -2.151
   99    HA   CYS  12           HA       CYS  12  -7.162  -5.307  -3.059
  100   1HB   CYS  12          HB2       CYS  12  -7.676  -4.394  -0.907
  101   2HB   CYS  12          HB1       CYS  12  -7.957  -2.795  -1.592
  102    H    MET  13           HN       MET  13  -7.984  -5.522  -4.997
  103    HA   MET  13           HA       MET  13  -9.593  -3.263  -5.981
  104   1HB   MET  13          HB2       MET  13  -8.268  -5.487  -7.553
  105   2HB   MET  13          HB1       MET  13  -9.502  -4.433  -8.227
  106   1HG   MET  13          HG2       MET  13  -6.831  -3.554  -7.156
  107   2HG   MET  13          HG1       MET  13  -7.260  -3.724  -8.857
  108   1HE   MET  13          HE1       MET  13  -9.132  -2.169 -10.066
  109   2HE   MET  13          HE2       MET  13 -10.057  -0.945  -9.196
  110   3HE   MET  13          HE3       MET  13 -10.271  -2.655  -8.811
  111    H    GLY  14           HN       GLY  14  -9.940  -5.455  -3.985
  112   1HA   GLY  14          HA2       GLY  14 -11.778  -7.362  -5.036
  113   2HA   GLY  14          HA1       GLY  14 -11.470  -7.031  -3.341
  114    H    THR  15           HN       THR  15 -13.931  -7.595  -3.772
  115    HA   THR  15           HA       THR  15 -15.629  -5.478  -4.555
  116    HB   THR  15           HB       THR  15 -16.339  -7.704  -2.647
  117    HG1  THR  15           HG1      THR  15 -15.578  -7.801  -5.299
  118   1HG2  THR  15          HG21      THR  15 -17.966  -6.187  -4.693
  119   2HG2  THR  15          HG22      THR  15 -18.033  -5.950  -2.948
  120   3HG2  THR  15          HG23      THR  15 -18.561  -7.478  -3.648
  121    H    ALA  16           HN       ALA  16 -14.308  -6.452  -1.408
  122    HA   ALA  16           HA       ALA  16 -16.232  -5.019   0.107
  123   1HB   ALA  16          HB1       ALA  16 -14.882  -5.621   2.038
  124   2HB   ALA  16          HB2       ALA  16 -13.571  -6.129   0.973
  125   3HB   ALA  16          HB3       ALA  16 -15.103  -7.001   0.964
  126    H    CYS  17           HN       CYS  17 -12.721  -4.413  -0.287
  127    HA   CYS  17           HA       CYS  17 -12.800  -1.989   1.151
  128   1HB   CYS  17          HB2       CYS  17 -10.812  -2.962  -0.876
  129   2HB   CYS  17          HB1       CYS  17 -10.585  -1.561   0.125
  130    H    PHE  18           HN       PHE  18 -13.264  -2.740  -2.233
  131    HA   PHE  18           HA       PHE  18 -12.823  -0.199  -3.327
  132   1HB   PHE  18          HB2       PHE  18 -13.047  -2.363  -4.600
  133   2HB   PHE  18          HB1       PHE  18 -14.789  -2.237  -4.380
  134    HD1  PHE  18           HD1      PHE  18 -11.862  -0.447  -5.804
  135    HD2  PHE  18           HD2      PHE  18 -16.079  -1.011  -5.866
  136    HE1  PHE  18           HE1      PHE  18 -12.016   0.957  -7.820
  137    HE2  PHE  18           HE2      PHE  18 -16.242   0.391  -7.880
  138    HZ   PHE  18           HZ       PHE  18 -14.176   1.370  -8.868
  139    H    VAL  19           HN       VAL  19 -15.630  -1.569  -1.751
  140    HA   VAL  19           HA       VAL  19 -17.443   0.511  -2.505
  141    HB   VAL  19           HB       VAL  19 -17.600  -1.409  -0.167
  142   1HG1  VAL  19          HG11      VAL  19 -19.753   0.254  -1.470
  143   2HG1  VAL  19          HG12      VAL  19 -19.076   0.507   0.138
  144   3HG1  VAL  19          HG13      VAL  19 -20.008  -0.949  -0.209
  145   1HG2  VAL  19          HG21      VAL  19 -18.751  -1.608  -2.946
  146   2HG2  VAL  19          HG22      VAL  19 -19.093  -2.716  -1.617
  147   3HG2  VAL  19          HG23      VAL  19 -17.459  -2.601  -2.270
  148    H    LYS  20           HN       LYS  20 -14.995   0.140  -0.127
  149    HA   LYS  20           HA       LYS  20 -16.004   2.180   1.665
  150   1HB   LYS  20          HB2       LYS  20 -14.765   0.099   2.381
  151   2HB   LYS  20          HB1       LYS  20 -13.321   0.782   1.658
  152   1HG   LYS  20          HG2       LYS  20 -13.157   1.192   3.961
  153   2HG   LYS  20          HG1       LYS  20 -13.607   2.734   3.229
  154   1HD   LYS  20          HD2       LYS  20 -15.893   2.447   3.903
  155   2HD   LYS  20          HD1       LYS  20 -15.561   0.812   4.481
  156   1HE   LYS  20          HE2       LYS  20 -15.658   2.310   6.363
  157   2HE   LYS  20          HE1       LYS  20 -13.997   1.762   6.146
  158   1HZ   LYS  20          HZ1       LYS  20 -13.524   3.864   4.999
  159   2HZ   LYS  20          HZ2       LYS  20 -14.041   4.112   6.593
  160   3HZ   LYS  20          HZ3       LYS  20 -15.107   4.385   5.302
  161    H    GLY  21           HN       GLY  21 -14.775   2.483  -1.300
  162   1HA   GLY  21          HA2       GLY  21 -14.073   4.487  -2.292
  163   2HA   GLY  21          HA1       GLY  21 -13.707   5.121  -0.691
  164    H    ALA  22           HN       ALA  22 -12.536   2.071  -2.028
  165    HA   ALA  22           HA       ALA  22  -9.940   2.641  -1.000
  166   1HB   ALA  22          HB1       ALA  22 -10.851   0.381  -0.978
  167   2HB   ALA  22          HB2       ALA  22  -9.319   0.445  -1.850
  168   3HB   ALA  22          HB3       ALA  22 -10.839   0.352  -2.741
  169    H    ASP  23           HN       ASP  23 -11.428   3.124  -4.100
  170    HA   ASP  23           HA       ASP  23  -9.083   3.000  -5.662
  171   1HB   ASP  23          HB2       ASP  23 -10.262   4.093  -7.403
  172   2HB   ASP  23          HB1       ASP  23 -11.460   3.119  -6.556
  173    H    LYS  24           HN       LYS  24 -10.526   5.664  -3.796
  174    HA   LYS  24           HA       LYS  24  -8.572   7.585  -4.579
  175   1HB   LYS  24          HB2       LYS  24 -10.292   7.460  -2.083
  176   2HB   LYS  24          HB1       LYS  24  -9.254   8.815  -2.489
  177   1HG   LYS  24          HG2       LYS  24 -11.366   9.500  -3.161
  178   2HG   LYS  24          HG1       LYS  24 -10.607   8.959  -4.659
  179   1HD   LYS  24          HD2       LYS  24 -11.747   6.787  -4.413
  180   2HD   LYS  24          HD1       LYS  24 -12.553   7.396  -2.967
  181   1HE   LYS  24          HE2       LYS  24 -13.692   9.082  -4.254
  182   2HE   LYS  24          HE1       LYS  24 -12.775   8.648  -5.699
  183   1HZ   LYS  24          HZ1       LYS  24 -14.905   7.640  -5.867
  184   2HZ   LYS  24          HZ2       LYS  24 -14.807   6.993  -4.299
  185   3HZ   LYS  24          HZ3       LYS  24 -13.793   6.398  -5.524
  186    H    VAL  25           HN       VAL  25  -8.814   5.185  -2.070
  187    HA   VAL  25           HA       VAL  25  -6.606   5.841  -0.503
  188    HB   VAL  25           HB       VAL  25  -7.730   3.116  -1.211
  189   1HG1  VAL  25          HG11      VAL  25  -6.563   2.262   0.755
  190   2HG1  VAL  25          HG12      VAL  25  -5.812   3.837   1.000
  191   3HG1  VAL  25          HG13      VAL  25  -5.426   2.893  -0.437
  192   1HG2  VAL  25          HG21      VAL  25  -8.820   3.242   0.971
  193   2HG2  VAL  25          HG22      VAL  25  -9.311   4.581  -0.067
  194   3HG2  VAL  25          HG23      VAL  25  -8.139   4.849   1.223
  195    H    VAL  26           HN       VAL  26  -6.828   3.721  -3.356
  196    HA   VAL  26           HA       VAL  26  -4.095   3.051  -3.204
  197    HB   VAL  26           HB       VAL  26  -4.298   2.005  -5.363
  198   1HG1  VAL  26          HG11      VAL  26  -6.780   1.625  -3.696
  199   2HG1  VAL  26          HG12      VAL  26  -5.235   0.800  -3.489
  200   3HG1  VAL  26          HG13      VAL  26  -6.206   0.505  -4.932
  201   1HG2  VAL  26          HG21      VAL  26  -6.412   2.170  -6.652
  202   2HG2  VAL  26          HG22      VAL  26  -5.491   3.674  -6.591
  203   3HG2  VAL  26          HG23      VAL  26  -6.915   3.471  -5.569
  204    H    HIS  27           HN       HIS  27  -5.825   5.692  -4.818
  205    HA   HIS  27           HA       HIS  27  -3.664   6.465  -6.467
  206   1HB   HIS  27          HB2       HIS  27  -6.061   7.371  -6.594
  207   2HB   HIS  27          HB1       HIS  27  -5.586   8.449  -5.277
  208    HD1  HIS  27           HD1      HIS  27  -3.201   9.803  -5.906
  209    HD2  HIS  27           HD2      HIS  27  -5.596   8.473  -9.026
  210    HE1  HIS  27           HE1      HIS  27  -2.399  11.037  -7.923
  211    HE2  HIS  27           HE2      HIS  27  -3.717  10.054  -9.840
  212    H    ALA  28           HN       ALA  28  -4.582   7.430  -3.243
  213    HA   ALA  28           HA       ALA  28  -2.456   9.171  -2.749
  214   1HB   ALA  28          HB1       ALA  28  -4.366   8.973  -1.243
  215   2HB   ALA  28          HB2       ALA  28  -2.852   8.713  -0.377
  216   3HB   ALA  28          HB3       ALA  28  -3.868   7.337  -0.811
  217    H    PHE  29           HN       PHE  29  -2.822   5.697  -2.355
  218    HA   PHE  29           HA       PHE  29  -0.391   5.023  -1.187
  219   1HB   PHE  29          HB2       PHE  29  -2.475   3.603  -1.772
  220   2HB   PHE  29          HB1       PHE  29  -1.711   3.379  -3.334
  221    HD1  PHE  29           HD1      PHE  29   0.246   3.615  -0.258
  222    HD2  PHE  29           HD2      PHE  29  -1.536   1.002  -3.100
  223    HE1  PHE  29           HE1      PHE  29   1.549   1.747   0.654
  224    HE2  PHE  29           HE2      PHE  29  -0.230  -0.879  -2.196
  225    HZ   PHE  29           HZ       PHE  29   1.315  -0.506  -0.313
  226    H    LYS  30           HN       LYS  30  -1.315   5.252  -4.569
  227    HA   LYS  30           HA       LYS  30   0.991   4.455  -5.819
  228   1HB   LYS  30          HB2       LYS  30  -0.988   4.909  -7.091
  229   2HB   LYS  30          HB1       LYS  30  -0.949   6.605  -6.630
  230   1HG   LYS  30          HG2       LYS  30   1.159   6.866  -7.884
  231   2HG   LYS  30          HG1       LYS  30   1.027   5.182  -8.401
  232   1HD   LYS  30          HD2       LYS  30  -0.986   5.635  -9.602
  233   2HD   LYS  30          HD1       LYS  30  -1.095   7.258  -8.917
  234   1HE   LYS  30          HE2       LYS  30   1.059   6.261 -10.780
  235   2HE   LYS  30          HE1       LYS  30  -0.281   7.321 -11.218
  236   1HZ   LYS  30          HZ1       LYS  30   1.962   7.936  -9.366
  237   2HZ   LYS  30          HZ2       LYS  30   0.594   8.921  -9.541
  238   3HZ   LYS  30          HZ3       LYS  30   1.628   8.670 -10.860
  239    H    GLU  31           HN       GLU  31   0.190   7.720  -4.867
  240    HA   GLU  31           HA       GLU  31   2.866   8.597  -5.619
  241   1HB   GLU  31          HB2       GLU  31   1.989  10.882  -5.191
  242   2HB   GLU  31          HB1       GLU  31   1.069   9.987  -6.378
  243   1HG   GLU  31          HG2       GLU  31  -0.593   9.455  -4.627
  244   2HG   GLU  31          HG1       GLU  31   0.311  10.484  -3.514
  245    H    GLN  32           HN       GLN  32   1.201   7.710  -2.810
  246    HA   GLN  32           HA       GLN  32   2.844   9.037  -0.952
  247   1HB   GLN  32          HB2       GLN  32   1.672   7.994   0.628
  248   2HB   GLN  32          HB1       GLN  32   0.549   7.733  -0.676
  249   1HG   GLN  32          HG2       GLN  32   0.659   5.570  -0.290
  250   2HG   GLN  32          HG1       GLN  32   2.350   5.630  -0.793
  251   1HE2  GLN  32          HE21      GLN  32   1.212   7.301   2.003
  252   2HE2  GLN  32          HE22      GLN  32   2.008   6.312   3.162
  253    H    LEU  33           HN       LEU  33   3.182   6.256  -2.956
  254    HA   LEU  33           HA       LEU  33   5.367   4.949  -1.895
  255   1HB   LEU  33          HB2       LEU  33   4.189   4.703  -4.212
  256   2HB   LEU  33          HB1       LEU  33   5.346   5.902  -4.750
  257    HG   LEU  33           HG       LEU  33   5.891   3.135  -3.759
  258   1HD1  LEU  33          HD11      LEU  33   5.203   3.277  -6.063
  259   2HD1  LEU  33          HD12      LEU  33   6.915   2.857  -5.962
  260   3HD1  LEU  33          HD13      LEU  33   6.433   4.505  -6.367
  261   1HD2  LEU  33          HD21      LEU  33   7.608   4.637  -2.851
  262   2HD2  LEU  33          HD22      LEU  33   7.963   5.189  -4.489
  263   3HD2  LEU  33          HD23      LEU  33   8.261   3.509  -4.039
  264    H    LYS  34           HN       LYS  34   5.357   7.613  -4.091
  265    HA   LYS  34           HA       LYS  34   6.416   9.558  -4.297
  266   1HB   LYS  34          HB2       LYS  34   6.798  10.840  -2.398
  267   2HB   LYS  34          HB1       LYS  34   5.593   9.663  -1.907
  268   1HG   LYS  34          HG2       LYS  34   6.998   9.751  -0.089
  269   2HG   LYS  34          HG1       LYS  34   7.576   8.334  -0.959
  270   1HD   LYS  34          HD2       LYS  34   9.385   9.661  -1.922
  271   2HD   LYS  34          HD1       LYS  34   8.796  11.090  -1.067
  272   1HE   LYS  34          HE2       LYS  34   9.674   8.535   0.273
  273   2HE   LYS  34          HE1       LYS  34  10.703   9.951   0.059
  274   1HZ   LYS  34          HZ1       LYS  34   9.422   9.633   2.262
  275   2HZ   LYS  34          HZ2       LYS  34   8.091  10.232   1.394
  276   3HZ   LYS  34          HZ3       LYS  34   9.494  11.170   1.557
  277    H    ILE  35           HN       ILE  35   8.153   7.047  -2.927
  278    HA   ILE  35           HA       ILE  35  10.027   6.005  -3.460
  279    HB   ILE  35           HB       ILE  35  10.626   7.338  -5.967
  280   1HG1  ILE  35          HG12      ILE  35   8.009   5.903  -5.854
  281   2HG1  ILE  35          HG11      ILE  35   8.057   7.655  -5.663
  282   1HG2  ILE  35          HG21      ILE  35   9.779   4.583  -5.112
  283   2HG2  ILE  35          HG22      ILE  35  11.432   5.146  -5.380
  284   3HG2  ILE  35          HG23      ILE  35  10.325   4.996  -6.742
  285   1HD1  ILE  35          HD11      ILE  35   9.126   7.823  -7.865
  286   2HD1  ILE  35          HD12      ILE  35   7.544   7.051  -7.942
  287   3HD1  ILE  35          HD13      ILE  35   9.007   6.073  -8.039
  288    H    ASP  36           HN       ASP  36  12.245   6.464  -4.649
  289    HA   ASP  36           HA       ASP  36  13.497   8.903  -3.737
  290   1HB   ASP  36          HB2       ASP  36  13.570   7.133  -1.870
  291   2HB   ASP  36          HB1       ASP  36  14.616   6.195  -2.932
  292    H    ILE  37           HN       ILE  37  14.077   5.632  -4.849
  293    HA   ILE  37           HA       ILE  37  14.552   6.348  -7.547
  294    HB   ILE  37           HB       ILE  37  16.837   5.137  -7.465
  295   1HG1  ILE  37          HG12      ILE  37  17.069   6.529  -4.859
  296   2HG1  ILE  37          HG11      ILE  37  16.350   4.917  -4.951
  297   1HG2  ILE  37          HG21      ILE  37  16.608   8.034  -6.705
  298   2HG2  ILE  37          HG22      ILE  37  16.608   7.381  -8.344
  299   3HG2  ILE  37          HG23      ILE  37  18.059   7.262  -7.347
  300   1HD1  ILE  37          HD11      ILE  37  19.113   5.686  -5.914
  301   2HD1  ILE  37          HD12      ILE  37  18.414   4.067  -5.949
  302   3HD1  ILE  37          HD13      ILE  37  18.750   4.850  -4.405
  303    H    GLY  38           HN       GLY  38  13.073   4.576  -5.738
  304   1HA   GLY  38          HA2       GLY  38  13.286   2.132  -7.192
  305   2HA   GLY  38          HA1       GLY  38  13.929   2.006  -5.541
  306    H    ASP  39           HN       ASP  39  12.578   3.095  -3.923
  307    HA   ASP  39           HA       ASP  39   9.761   3.155  -4.082
  308   1HB   ASP  39          HB2       ASP  39  10.983   0.645  -2.983
  309   2HB   ASP  39          HB1       ASP  39   9.384   1.220  -2.560
  310    H    VAL  40           HN       VAL  40   9.390   4.577  -2.884
  311    HA   VAL  40           HA       VAL  40   9.077   5.925  -1.162
  312    HB   VAL  40           HB       VAL  40   8.046   4.085  -0.095
  313   1HG1  VAL  40          HG11      VAL  40  10.628   3.241   1.124
  314   2HG1  VAL  40          HG12      VAL  40   9.833   2.422  -0.220
  315   3HG1  VAL  40          HG13      VAL  40   9.036   2.515   1.352
  316   1HG2  VAL  40          HG21      VAL  40   8.320   6.078   1.204
  317   2HG2  VAL  40          HG22      VAL  40   9.869   5.472   1.795
  318   3HG2  VAL  40          HG23      VAL  40   8.376   4.644   2.229
  319    H    THR  41           HN       THR  41  11.639   3.934  -0.188
  320    HA   THR  41           HA       THR  41  13.550   6.084  -0.068
  321    HB   THR  41           HB       THR  41  13.937   5.395   2.529
  322    HG1  THR  41           HG1      THR  41  11.515   5.968   3.186
  323   1HG2  THR  41          HG21      THR  41  12.274   7.690   1.495
  324   2HG2  THR  41          HG22      THR  41  14.032   7.655   1.630
  325   3HG2  THR  41          HG23      THR  41  13.034   7.609   3.084
  326    HA   PRO  42           HA       PRO  42  15.818   2.224   1.062
  327   1HB   PRO  42          HB2       PRO  42  13.931  -0.008   1.246
  328   2HB   PRO  42          HB1       PRO  42  15.202   0.473   2.376
  329   1HG   PRO  42          HG2       PRO  42  12.584   0.817   2.925
  330   2HG   PRO  42          HG1       PRO  42  13.831   1.944   3.497
  331   1HD   PRO  42          HD2       PRO  42  11.978   2.199   1.155
  332   2HD   PRO  42          HD1       PRO  42  12.446   3.419   2.357
  333    H    ASP  43           HN       ASP  43  13.259   2.386  -1.210
  334    HA   ASP  43           HA       ASP  43  13.497   2.283  -3.455
  335   1HB   ASP  43          HB2       ASP  43  16.259   1.188  -2.901
  336   2HB   ASP  43          HB1       ASP  43  15.622   1.562  -4.505
  337    H    GLY  44           HN       GLY  44  12.908   0.210  -1.394
  338   1HA   GLY  44          HA2       GLY  44  11.324  -1.166  -3.118
  339   2HA   GLY  44          HA1       GLY  44  12.723  -2.224  -2.852
  340    H    ARG  45           HN       ARG  45  11.307   0.050  -0.598
  341    HA   ARG  45           HA       ARG  45  10.699  -1.958   1.358
  342   1HB   ARG  45          HB2       ARG  45  11.252   0.507   1.700
  343   2HB   ARG  45          HB1       ARG  45   9.634   0.867   1.138
  344   1HG   ARG  45          HG2       ARG  45   8.642  -0.115   3.001
  345   2HG   ARG  45          HG1       ARG  45  10.092  -1.028   3.417
  346   1HD   ARG  45          HD2       ARG  45  11.217   0.976   4.119
  347   2HD   ARG  45          HD1       ARG  45   9.885   1.977   3.543
  348    HE   ARG  45           HE       ARG  45   8.543   0.596   5.258
  349   1HH1  ARG  45          HH11      ARG  45  11.855   1.668   5.663
  350   2HH1  ARG  45          HH12      ARG  45  11.751   1.763   7.390
  351   1HH2  ARG  45          HH21      ARG  45   8.392   0.704   7.493
  352   2HH2  ARG  45          HH22      ARG  45   9.745   1.245   8.442
  353    H    PHE  46           HN       PHE  46   9.193  -0.096  -1.067
  354    HA   PHE  46           HA       PHE  46   6.598  -1.351  -0.906
  355   1HB   PHE  46          HB2       PHE  46   8.007   0.713  -2.562
  356   2HB   PHE  46          HB1       PHE  46   6.523  -0.010  -3.179
  357    HD1  PHE  46           HD1      PHE  46   8.001   2.538  -1.435
  358    HD2  PHE  46           HD2      PHE  46   4.449   0.220  -1.502
  359    HE1  PHE  46           HE1      PHE  46   6.761   4.420  -0.389
  360    HE2  PHE  46           HE2      PHE  46   3.215   2.032  -0.392
  361    HZ   PHE  46           HZ       PHE  46   4.368   4.135   0.167
  362    H    SER  47           HN       SER  47   5.834  -2.875  -2.428
  363    HA   SER  47           HA       SER  47   7.020  -3.166  -4.997
  364   1HB   SER  47          HB2       SER  47   7.495  -5.325  -2.957
  365   2HB   SER  47          HB1       SER  47   7.412  -5.698  -4.676
  366    HG   SER  47           HG       SER  47   9.067  -3.594  -3.851
  367    H    ILE  48           HN       ILE  48   5.100  -3.024  -6.015
  368    HA   ILE  48           HA       ILE  48   2.675  -3.706  -4.738
  369    HB   ILE  48           HB       ILE  48   1.521  -2.833  -6.574
  370   1HG1  ILE  48          HG12      ILE  48   2.430  -4.198  -8.371
  371   2HG1  ILE  48          HG11      ILE  48   2.494  -2.498  -8.822
  372   1HG2  ILE  48          HG21      ILE  48   2.677  -0.762  -7.159
  373   2HG2  ILE  48          HG22      ILE  48   4.187  -1.434  -6.540
  374   3HG2  ILE  48          HG23      ILE  48   2.836  -1.143  -5.444
  375   1HD1  ILE  48          HD11      ILE  48   4.793  -4.143  -7.811
  376   2HD1  ILE  48          HD12      ILE  48   4.869  -2.444  -8.295
  377   3HD1  ILE  48          HD13      ILE  48   4.503  -3.689  -9.492
  378    H    ASP  49           HN       ASP  49   1.482  -5.545  -4.685
  379    HA   ASP  49           HA       ASP  49   0.936  -6.588  -7.314
  380   1HB   ASP  49          HB2       ASP  49   1.285  -8.931  -6.958
  381   2HB   ASP  49          HB1       ASP  49   2.786  -8.094  -6.601
  382    H    THR  50           HN       THR  50  -1.083  -6.871  -7.584
  383    HA   THR  50           HA       THR  50  -3.252  -7.065  -5.990
  384    HB   THR  50           HB       THR  50  -2.818  -8.768  -8.442
  385    HG1  THR  50           HG1      THR  50  -2.327  -6.645  -8.984
  386   1HG2  THR  50          HG21      THR  50  -4.870  -9.288  -7.207
  387   2HG2  THR  50          HG22      THR  50  -5.237  -8.494  -8.740
  388   3HG2  THR  50          HG23      THR  50  -5.319  -7.583  -7.232
  389    H    LEU  51           HN       LEU  51  -0.904  -9.607  -6.473
  390    HA   LEU  51           HA       LEU  51  -2.509 -11.836  -6.527
  391   1HB   LEU  51          HB2       LEU  51   0.329 -11.626  -5.551
  392   2HB   LEU  51          HB1       LEU  51  -0.473 -13.118  -6.000
  393    HG   LEU  51           HG       LEU  51   0.109 -10.809  -7.858
  394   1HD1  LEU  51          HD11      LEU  51   1.342 -13.554  -7.684
  395   2HD1  LEU  51          HD12      LEU  51   2.113 -12.046  -7.193
  396   3HD1  LEU  51          HD13      LEU  51   1.711 -12.322  -8.888
  397   1HD2  LEU  51          HD21      LEU  51  -0.663 -12.302  -9.625
  398   2HD2  LEU  51          HD22      LEU  51  -1.947 -11.988  -8.457
  399   3HD2  LEU  51          HD23      LEU  51  -1.080 -13.522  -8.423
  400    H    ARG  52           HN       ARG  52  -1.314 -10.227  -3.662
  401    HA   ARG  52           HA       ARG  52  -1.690 -12.213  -1.754
  402   1HB   ARG  52          HB2       ARG  52  -2.359  -9.306  -1.315
  403   2HB   ARG  52          HB1       ARG  52  -1.794 -10.473  -0.126
  404   1HG   ARG  52          HG2       ARG  52  -0.219  -9.382  -2.444
  405   2HG   ARG  52          HG1       ARG  52  -0.011  -8.968  -0.742
  406   1HD   ARG  52          HD2       ARG  52   0.903 -11.032  -0.220
  407   2HD   ARG  52          HD1       ARG  52   0.203 -11.810  -1.643
  408    HE   ARG  52           HE       ARG  52   1.844 -10.151  -2.840
  409   1HH1  ARG  52          HH11      ARG  52   2.434 -11.981   0.101
  410   2HH1  ARG  52          HH12      ARG  52   4.138 -12.142  -0.197
  411   1HH2  ARG  52          HH21      ARG  52   4.056 -10.393  -3.247
  412   2HH2  ARG  52          HH22      ARG  52   5.053 -11.273  -2.127
  413    H    CYS  53           HN       CYS  53  -4.021  -9.981  -3.135
  414    HA   CYS  53           HA       CYS  53  -6.091 -10.317  -1.306
  415   1HB   CYS  53          HB2       CYS  53  -5.983  -8.432  -2.858
  416   2HB   CYS  53          HB1       CYS  53  -6.332  -9.522  -4.203
  417    H    VAL  54           HN       VAL  54  -8.325 -11.094  -1.863
  418    HA   VAL  54           HA       VAL  54  -9.641 -12.935  -1.778
  419    HB   VAL  54           HB       VAL  54  -7.849 -14.226  -3.850
  420   1HG1  VAL  54          HG11      VAL  54 -10.776 -14.595  -3.211
  421   2HG1  VAL  54          HG12      VAL  54  -9.475 -15.719  -2.813
  422   3HG1  VAL  54          HG13      VAL  54  -9.893 -15.415  -4.500
  423   1HG2  VAL  54          HG21      VAL  54  -9.340 -13.284  -5.560
  424   2HG2  VAL  54          HG22      VAL  54  -8.479 -12.026  -4.671
  425   3HG2  VAL  54          HG23      VAL  54 -10.174 -12.359  -4.312
  426    H    GLY  55           HN       GLY  55  -7.184 -12.488  -0.316
  427   1HA   GLY  55          HA2       GLY  55  -6.611 -15.232   0.573
  428   2HA   GLY  55          HA1       GLY  55  -5.470 -13.901   0.680
  429    H    GLY  56           HN       GLY  56  -8.868 -14.578   1.761
  430   1HA   GLY  56          HA2       GLY  56  -9.735 -14.421   3.891
  431   2HA   GLY  56          HA1       GLY  56  -8.090 -14.587   4.464
  432    H    CYS  57           HN       CYS  57 -10.188 -11.979   3.004
  433    HA   CYS  57           HA       CYS  57  -8.555 -10.086   4.615
  434   1HB   CYS  57          HB2       CYS  57  -9.619  -9.401   1.926
  435   2HB   CYS  57          HB1       CYS  57  -8.370  -8.618   2.825
  436    H    ALA  58           HN       ALA  58 -11.638 -10.737   2.988
  437    HA   ALA  58           HA       ALA  58 -12.551  -8.178   2.622
  438   1HB   ALA  58          HB1       ALA  58 -14.758  -9.115   2.367
  439   2HB   ALA  58          HB2       ALA  58 -14.242 -10.592   3.179
  440   3HB   ALA  58          HB3       ALA  58 -13.546 -10.156   1.619
  441    H    LEU  59           HN       LEU  59 -12.803  -9.966   5.729
  442    HA   LEU  59           HA       LEU  59 -14.670  -8.006   6.739
  443   1HB   LEU  59          HB2       LEU  59 -13.041 -10.115   8.144
  444   2HB   LEU  59          HB1       LEU  59 -14.188  -9.067   8.958
  445    HG   LEU  59           HG       LEU  59 -14.868 -11.047   6.779
  446   1HD1  LEU  59          HD11      LEU  59 -14.248 -12.119   8.881
  447   2HD1  LEU  59          HD12      LEU  59 -15.973 -12.289   8.558
  448   3HD1  LEU  59          HD13      LEU  59 -15.412 -11.112   9.742
  449   1HD2  LEU  59          HD21      LEU  59 -16.326  -9.089   6.743
  450   2HD2  LEU  59          HD22      LEU  59 -16.645  -9.287   8.467
  451   3HD2  LEU  59          HD23      LEU  59 -17.190 -10.513   7.322
  452    H    ALA  60           HN       ALA  60 -11.515  -7.648   5.987
  453    HA   ALA  60           HA       ALA  60 -11.236  -5.480   7.966
  454   1HB   ALA  60          HB1       ALA  60  -9.058  -6.952   6.487
  455   2HB   ALA  60          HB2       ALA  60  -9.456  -7.131   8.194
  456   3HB   ALA  60          HB3       ALA  60  -8.815  -5.602   7.593
  457    HA   PRO  61           HA       PRO  61 -10.494  -2.989   4.165
  458   1HB   PRO  61          HB2       PRO  61  -9.188  -0.884   5.270
  459   2HB   PRO  61          HB1       PRO  61 -10.950  -1.019   5.323
  460   1HG   PRO  61          HG2       PRO  61  -8.938  -1.596   7.453
  461   2HG   PRO  61          HG1       PRO  61 -10.536  -0.844   7.593
  462   1HD   PRO  61          HD2       PRO  61 -10.000  -3.475   8.202
  463   2HD   PRO  61          HD1       PRO  61 -11.600  -2.863   7.742
  464    H    ILE  62           HN       ILE  62  -8.750  -3.682   2.900
  465    HA   ILE  62           HA       ILE  62  -6.307  -4.284   4.418
  466    HB   ILE  62           HB       ILE  62  -7.192  -5.408   1.767
  467   1HG1  ILE  62          HG12      ILE  62  -8.459  -6.241   3.710
  468   2HG1  ILE  62          HG11      ILE  62  -7.456  -7.502   2.999
  469   1HG2  ILE  62          HG21      ILE  62  -4.748  -6.031   3.421
  470   2HG2  ILE  62          HG22      ILE  62  -4.769  -5.217   1.857
  471   3HG2  ILE  62          HG23      ILE  62  -5.259  -6.907   1.978
  472   1HD1  ILE  62          HD11      ILE  62  -7.391  -7.601   5.415
  473   2HD1  ILE  62          HD12      ILE  62  -6.836  -5.929   5.492
  474   3HD1  ILE  62          HD13      ILE  62  -5.804  -7.168   4.777
  475    H    VAL  63           HN       VAL  63  -4.613  -2.997   4.204
  476    HA   VAL  63           HA       VAL  63  -3.753  -2.528   1.444
  477    HB   VAL  63           HB       VAL  63  -3.230  -0.519   3.656
  478   1HG1  VAL  63          HG11      VAL  63  -2.645  -0.448   0.698
  479   2HG1  VAL  63          HG12      VAL  63  -1.467  -0.679   1.991
  480   3HG1  VAL  63          HG13      VAL  63  -2.324   0.856   1.843
  481   1HG2  VAL  63          HG21      VAL  63  -5.130  -0.292   1.321
  482   2HG2  VAL  63          HG22      VAL  63  -4.703   1.016   2.425
  483   3HG2  VAL  63          HG23      VAL  63  -5.577  -0.393   3.025
  484    H    MET  64           HN       MET  64  -1.787  -3.617   1.200
  485    HA   MET  64           HA       MET  64  -0.533  -4.381   3.781
  486   1HB   MET  64          HB2       MET  64  -1.594  -6.262   2.706
  487   2HB   MET  64          HB1       MET  64  -0.760  -5.918   1.197
  488   1HG   MET  64          HG2       MET  64   1.383  -6.302   2.426
  489   2HG   MET  64          HG1       MET  64   0.415  -6.899   3.771
  490   1HE   MET  64          HE1       MET  64  -1.426  -9.949   2.098
  491   2HE   MET  64          HE2       MET  64  -1.992  -8.279   2.121
  492   3HE   MET  64          HE3       MET  64  -1.253  -8.979   3.561
  493    H    VAL  65           HN       VAL  65   1.571  -3.972   4.083
  494    HA   VAL  65           HA       VAL  65   3.266  -3.850   1.660
  495    HB   VAL  65           HB       VAL  65   4.942  -3.140   3.677
  496   1HG1  VAL  65          HG11      VAL  65   4.674  -1.832   1.649
  497   2HG1  VAL  65          HG12      VAL  65   4.609  -0.788   3.071
  498   3HG1  VAL  65          HG13      VAL  65   3.122  -1.224   2.231
  499   1HG2  VAL  65          HG21      VAL  65   3.683  -1.518   5.101
  500   2HG2  VAL  65          HG22      VAL  65   3.323  -3.221   5.390
  501   3HG2  VAL  65          HG23      VAL  65   2.201  -2.232   4.456
  502    H    GLY  66           HN       GLY  66   4.042  -5.865   1.364
  503   1HA   GLY  66          HA2       GLY  66   4.674  -8.024   1.791
  504   2HA   GLY  66          HA1       GLY  66   5.754  -7.218   2.923
  505    H    GLU  67           HN       GLU  67   5.779  -8.671   4.372
  506    HA   GLU  67           HA       GLU  67   3.434  -9.832   5.560
  507   1HB   GLU  67          HB2       GLU  67   6.247  -9.847   6.664
  508   2HB   GLU  67          HB1       GLU  67   4.961 -10.996   7.001
  509   1HG   GLU  67          HG2       GLU  67   6.424 -10.648   4.395
  510   2HG   GLU  67          HG1       GLU  67   6.609 -11.976   5.538
  511    H    LYS  68           HN       LYS  68   3.711  -6.876   5.557
  512    HA   LYS  68           HA       LYS  68   3.916  -6.333   8.433
  513   1HB   LYS  68          HB2       LYS  68   3.646  -4.331   6.193
  514   2HB   LYS  68          HB1       LYS  68   4.010  -3.976   7.871
  515   1HG   LYS  68          HG2       LYS  68   5.864  -5.654   6.206
  516   2HG   LYS  68          HG1       LYS  68   5.917  -3.895   6.142
  517   1HD   LYS  68          HD2       LYS  68   6.219  -5.558   8.645
  518   2HD   LYS  68          HD1       LYS  68   7.548  -4.832   7.737
  519   1HE   LYS  68          HE2       LYS  68   5.276  -3.279   8.975
  520   2HE   LYS  68          HE1       LYS  68   6.836  -3.536   9.751
  521   1HZ   LYS  68          HZ1       LYS  68   7.920  -2.278   8.068
  522   2HZ   LYS  68          HZ2       LYS  68   6.592  -1.368   8.590
  523   3HZ   LYS  68          HZ3       LYS  68   6.520  -2.195   7.115
  524    H    VAL  69           HN       VAL  69   1.838  -5.935   5.650
  525    HA   VAL  69           HA       VAL  69  -0.364  -5.323   5.371
  526    HB   VAL  69           HB       VAL  69  -0.633  -7.149   7.757
  527   1HG1  VAL  69          HG11      VAL  69  -2.670  -5.847   7.492
  528   2HG1  VAL  69          HG12      VAL  69  -2.944  -7.510   6.974
  529   3HG1  VAL  69          HG13      VAL  69  -2.722  -6.236   5.774
  530   1HG2  VAL  69          HG21      VAL  69   0.492  -8.181   5.879
  531   2HG2  VAL  69          HG22      VAL  69  -0.781  -7.638   4.782
  532   3HG2  VAL  69          HG23      VAL  69  -1.138  -8.836   6.030
  533    H    TYR  70           HN       TYR  70  -1.253  -3.370   5.656
  534    HA   TYR  70           HA       TYR  70  -1.834  -2.451   8.393
  535   1HB   TYR  70          HB2       TYR  70  -0.462  -0.928   6.197
  536   2HB   TYR  70          HB1       TYR  70  -1.178  -0.151   7.616
  537    HD1  TYR  70           HD1      TYR  70  -0.438  -1.223   9.922
  538    HD2  TYR  70           HD2      TYR  70   1.724  -1.467   6.285
  539    HE1  TYR  70           HE1      TYR  70   1.608  -1.690  11.177
  540    HE2  TYR  70           HE2      TYR  70   3.728  -1.939   7.480
  541    HH   TYR  70           HH       TYR  70   4.634  -1.421   9.919
  542    H    GLY  71           HN       GLY  71  -2.728   0.063   7.716
  543   1HA   GLY  71          HA2       GLY  71  -4.789  -0.273   5.658
  544   2HA   GLY  71          HA1       GLY  71  -5.200   0.392   7.238
  545    H    ASN  72           HN       ASN  72  -2.205   0.920   5.475
  546    HA   ASN  72           HA       ASN  72  -2.277   3.736   5.638
  547   1HB   ASN  72          HB2       ASN  72  -0.130   2.834   5.273
  548   2HB   ASN  72          HB1       ASN  72  -0.658   1.772   3.984
  549   1HD2  ASN  72          HD21      ASN  72   0.344   4.898   4.885
  550   2HD2  ASN  72          HD22      ASN  72   0.503   5.551   3.290
  551    H    VAL  73           HN       VAL  73  -3.551   5.099   4.689
  552    HA   VAL  73           HA       VAL  73  -5.567   3.871   2.968
  553    HB   VAL  73           HB       VAL  73  -6.712   6.138   4.017
  554   1HG1  VAL  73          HG11      VAL  73  -7.720   3.913   3.833
  555   2HG1  VAL  73          HG12      VAL  73  -7.919   4.574   5.457
  556   3HG1  VAL  73          HG13      VAL  73  -6.696   3.340   5.149
  557   1HG2  VAL  73          HG21      VAL  73  -6.165   6.154   6.380
  558   2HG2  VAL  73          HG22      VAL  73  -4.695   6.433   5.439
  559   3HG2  VAL  73          HG23      VAL  73  -5.000   4.843   6.150
  560    H    THR  74           HN       THR  74  -6.149   7.149   3.257
  561    HA   THR  74           HA       THR  74  -4.804   7.761   0.760
  562    HB   THR  74           HB       THR  74  -6.732   6.890  -0.183
  563    HG1  THR  74           HG1      THR  74  -6.666   8.640  -1.362
  564   1HG2  THR  74          HG21      THR  74  -8.155   6.733   1.775
  565   2HG2  THR  74          HG22      THR  74  -9.023   7.521   0.456
  566   3HG2  THR  74          HG23      THR  74  -8.373   8.483   1.786
  567    HA   PRO  75           HA       PRO  75  -6.515  11.926   2.208
  568   1HB   PRO  75          HB2       PRO  75  -7.547  11.889   4.880
  569   2HB   PRO  75          HB1       PRO  75  -8.434  12.117   3.374
  570   1HG   PRO  75          HG2       PRO  75  -8.691   9.926   5.017
  571   2HG   PRO  75          HG1       PRO  75  -9.084   9.940   3.290
  572   1HD   PRO  75          HD2       PRO  75  -6.624   8.940   4.671
  573   2HD   PRO  75          HD1       PRO  75  -7.519   8.234   3.306
  574    H    GLY  76           HN       GLY  76  -3.980  11.412   2.493
  575   1HA   GLY  76          HA2       GLY  76  -2.119  12.472   3.327
  576   2HA   GLY  76          HA1       GLY  76  -3.149  13.329   4.458
  577    H    GLN  77           HN       GLN  77  -3.998  10.307   5.009
  578    HA   GLN  77           HA       GLN  77  -2.533  10.262   7.498
  579   1HB   GLN  77          HB2       GLN  77  -4.288   8.042   6.440
  580   2HB   GLN  77          HB1       GLN  77  -3.906   8.410   8.114
  581   1HG   GLN  77          HG2       GLN  77  -5.202  10.521   7.867
  582   2HG   GLN  77          HG1       GLN  77  -5.694   9.963   6.266
  583   1HE2  GLN  77          HE21      GLN  77  -6.989   8.098   6.103
  584   2HE2  GLN  77          HE22      GLN  77  -7.982   7.594   7.424
  585    H    VAL  78           HN       VAL  78  -2.582   8.867   4.456
  586    HA   VAL  78           HA       VAL  78  -1.096   6.603   4.581
  587    HB   VAL  78           HB       VAL  78  -0.261   7.753   2.279
  588   1HG1  VAL  78          HG11      VAL  78  -1.401   5.618   2.439
  589   2HG1  VAL  78          HG12      VAL  78  -2.184   6.635   1.225
  590   3HG1  VAL  78          HG13      VAL  78  -2.911   6.451   2.825
  591   1HG2  VAL  78          HG21      VAL  78  -1.579   9.756   3.113
  592   2HG2  VAL  78          HG22      VAL  78  -2.995   8.800   2.625
  593   3HG2  VAL  78          HG23      VAL  78  -1.769   9.235   1.429
  594    H    LYS  79           HN       LYS  79   0.163   9.972   4.189
  595    HA   LYS  79           HA       LYS  79   2.762   9.071   3.554
  596   1HB   LYS  79          HB2       LYS  79   3.455  11.407   3.940
  597   2HB   LYS  79          HB1       LYS  79   2.030  11.286   2.921
  598   1HG   LYS  79          HG2       LYS  79   0.628  11.790   4.901
  599   2HG   LYS  79          HG1       LYS  79   2.110  12.045   5.830
  600   1HD   LYS  79          HD2       LYS  79   2.750  13.755   4.071
  601   2HD   LYS  79          HD1       LYS  79   1.092  13.623   3.477
  602   1HE   LYS  79          HE2       LYS  79   1.184  15.487   4.964
  603   2HE   LYS  79          HE1       LYS  79   0.315  14.193   5.789
  604   1HZ   LYS  79          HZ1       LYS  79   3.162  14.940   6.194
  605   2HZ   LYS  79          HZ2       LYS  79   2.398  13.632   6.944
  606   3HZ   LYS  79          HZ3       LYS  79   1.888  15.212   7.282
  607    H    LYS  80           HN       LYS  80   1.123   9.537   6.501
  608    HA   LYS  80           HA       LYS  80   3.437   9.544   8.206
  609   1HB   LYS  80          HB2       LYS  80   0.646   8.887   9.065
  610   2HB   LYS  80          HB1       LYS  80   1.856   9.866   9.872
  611   1HG   LYS  80          HG2       LYS  80   1.193  11.726   8.885
  612   2HG   LYS  80          HG1       LYS  80   1.022  10.971   7.312
  613   1HD   LYS  80          HD2       LYS  80  -1.159  11.271   7.611
  614   2HD   LYS  80          HD1       LYS  80  -1.052   9.889   8.696
  615   1HE   LYS  80          HE2       LYS  80  -0.664  12.730   9.621
  616   2HE   LYS  80          HE1       LYS  80  -2.227  11.917   9.634
  617   1HZ   LYS  80          HZ1       LYS  80   0.200  11.045  11.121
  618   2HZ   LYS  80          HZ2       LYS  80  -1.293  10.238  11.114
  619   3HZ   LYS  80          HZ3       LYS  80  -1.173  11.788  11.787
  620    H    ILE  81           HN       ILE  81   0.744   7.421   7.519
  621    HA   ILE  81           HA       ILE  81   1.816   5.092   8.701
  622    HB   ILE  81           HB       ILE  81   0.065   5.096   6.232
  623   1HG1  ILE  81          HG12      ILE  81  -0.960   6.529   7.933
  624   2HG1  ILE  81          HG11      ILE  81  -1.862   5.029   7.757
  625   1HG2  ILE  81          HG21      ILE  81   0.972   2.924   6.760
  626   2HG2  ILE  81          HG22      ILE  81  -0.739   2.950   7.194
  627   3HG2  ILE  81          HG23      ILE  81   0.491   3.095   8.448
  628   1HD1  ILE  81          HD11      ILE  81  -1.666   5.677  10.082
  629   2HD1  ILE  81          HD12      ILE  81   0.094   5.667   9.948
  630   3HD1  ILE  81          HD13      ILE  81  -0.814   4.163   9.779
  631    H    LEU  82           HN       LEU  82   2.759   6.816   5.899
  632    HA   LEU  82           HA       LEU  82   4.002   4.781   4.418
  633   1HB   LEU  82          HB2       LEU  82   3.673   6.987   3.476
  634   2HB   LEU  82          HB1       LEU  82   4.689   7.700   4.725
  635    HG   LEU  82           HG       LEU  82   6.627   6.446   3.856
  636   1HD1  LEU  82          HD11      LEU  82   4.734   5.670   1.641
  637   2HD1  LEU  82          HD12      LEU  82   5.427   4.584   2.846
  638   3HD1  LEU  82          HD13      LEU  82   6.472   5.374   1.664
  639   1HD2  LEU  82          HD21      LEU  82   6.193   8.756   3.135
  640   2HD2  LEU  82          HD22      LEU  82   5.230   8.147   1.786
  641   3HD2  LEU  82          HD23      LEU  82   6.958   7.805   1.860
  642    H    ALA  83           HN       ALA  83   5.154   6.801   7.117
  643    HA   ALA  83           HA       ALA  83   7.726   5.705   7.354
  644   1HB   ALA  83          HB1       ALA  83   5.871   6.595   9.567
  645   2HB   ALA  83          HB2       ALA  83   6.979   7.631   8.668
  646   3HB   ALA  83          HB3       ALA  83   7.613   6.361   9.715
  647    H    GLU  84           HN       GLU  84   4.588   4.549   8.246
  648    HA   GLU  84           HA       GLU  84   5.434   2.259   9.729
  649   1HB   GLU  84          HB2       GLU  84   2.893   3.396   8.753
  650   2HB   GLU  84          HB1       GLU  84   2.921   1.665   9.027
  651   1HG   GLU  84          HG2       GLU  84   3.628   2.026  11.332
  652   2HG   GLU  84          HG1       GLU  84   3.642   3.773  11.051
  653    H    TYR  85           HN       TYR  85   5.058   2.963   6.358
  654    HA   TYR  85           HA       TYR  85   4.466   0.272   5.643
  655   1HB   TYR  85          HB2       TYR  85   4.429   2.866   4.339
  656   2HB   TYR  85          HB1       TYR  85   4.941   1.531   3.290
  657    HD1  TYR  85           HD1      TYR  85   2.986   1.087   6.192
  658    HD2  TYR  85           HD2      TYR  85   2.900   1.428   2.056
  659    HE1  TYR  85           HE1      TYR  85   0.883   0.059   6.236
  660    HE2  TYR  85           HE2      TYR  85   0.693   0.386   2.072
  661    HH   TYR  85           HH       TYR  85  -0.714  -1.007   3.398
  Start of MODEL    8
    1   1H    MET   1          HT1       MET   1  14.590   2.534 -12.226
    2   2H    MET   1          HT2       MET   1  15.776   2.645 -11.017
    3   3H    MET   1          HT3       MET   1  14.749   3.962 -11.320
    4    HA   MET   1           HA       MET   1  14.085   2.808  -9.321
    5   1HB   MET   1          HB2       MET   1  12.185   2.397 -11.641
    6   2HB   MET   1          HB1       MET   1  11.729   2.336  -9.946
    7   1HG   MET   1          HG2       MET   1  12.825   4.737 -11.390
    8   2HG   MET   1          HG1       MET   1  11.136   4.462 -10.969
    9   1HE   MET   1          HE1       MET   1  12.161   7.355  -8.551
   10   2HE   MET   1          HE2       MET   1  11.010   6.814  -9.772
   11   3HE   MET   1          HE3       MET   1  12.690   7.116 -10.216
   12    H    VAL   2           HN       VAL   2  15.008   0.993  -8.516
   13    HA   VAL   2           HA       VAL   2  14.121  -1.553  -9.718
   14    HB   VAL   2           HB       VAL   2  16.709  -1.158  -8.202
   15   1HG1  VAL   2          HG11      VAL   2  17.266  -3.381  -9.071
   16   2HG1  VAL   2          HG12      VAL   2  15.682  -3.477  -9.840
   17   3HG1  VAL   2          HG13      VAL   2  15.806  -3.422  -8.081
   18   1HG2  VAL   2          HG21      VAL   2  16.837   0.058 -10.295
   19   2HG2  VAL   2          HG22      VAL   2  16.256  -1.353 -11.178
   20   3HG2  VAL   2          HG23      VAL   2  17.830  -1.398 -10.383
   21    HA   PRO   3           HA       PRO   3  12.329  -1.171  -5.441
   22   1HB   PRO   3          HB2       PRO   3  10.102  -2.648  -6.099
   23   2HB   PRO   3          HB1       PRO   3  10.203  -0.891  -6.239
   24   1HG   PRO   3          HG2       PRO   3  10.523  -2.983  -8.345
   25   2HG   PRO   3          HG1       PRO   3   9.700  -1.414  -8.435
   26   1HD   PRO   3          HD2       PRO   3  12.152  -1.802  -9.474
   27   2HD   PRO   3          HD1       PRO   3  11.676  -0.254  -8.744
   28    H    LYS   4           HN       LYS   4  13.282  -2.514  -4.086
   29    HA   LYS   4           HA       LYS   4  14.267  -5.026  -4.824
   30   1HB   LYS   4          HB2       LYS   4  14.001  -3.704  -2.149
   31   2HB   LYS   4          HB1       LYS   4  14.780  -5.264  -2.365
   32   1HG   LYS   4          HG2       LYS   4  15.611  -2.641  -3.587
   33   2HG   LYS   4          HG1       LYS   4  16.452  -3.538  -2.320
   34   1HD   LYS   4          HD2       LYS   4  17.000  -5.308  -3.817
   35   2HD   LYS   4          HD1       LYS   4  15.929  -4.668  -5.062
   36   1HE   LYS   4          HE2       LYS   4  18.434  -3.329  -4.043
   37   2HE   LYS   4          HE1       LYS   4  18.293  -4.227  -5.555
   38   1HZ   LYS   4          HZ1       LYS   4  16.477  -2.580  -6.136
   39   2HZ   LYS   4          HZ2       LYS   4  18.057  -1.979  -6.126
   40   3HZ   LYS   4          HZ3       LYS   4  17.022  -1.650  -4.828
   41    H    GLY   5           HN       GLY   5  11.642  -4.260  -2.616
   42   1HA   GLY   5          HA2       GLY   5   9.523  -5.349  -2.856
   43   2HA   GLY   5          HA1       GLY   5  10.374  -6.725  -3.538
   44    H    LYS   6           HN       LYS   6  11.438  -5.068  -0.730
   45    HA   LYS   6           HA       LYS   6  11.731  -7.222   0.923
   46   1HB   LYS   6          HB2       LYS   6  12.657  -4.933   1.248
   47   2HB   LYS   6          HB1       LYS   6  11.050  -4.375   1.707
   48   1HG   LYS   6          HG2       LYS   6  12.424  -4.783   3.659
   49   2HG   LYS   6          HG1       LYS   6  11.065  -5.905   3.588
   50   1HD   LYS   6          HD2       LYS   6  13.043  -7.125   4.224
   51   2HD   LYS   6          HD1       LYS   6  12.558  -7.596   2.591
   52   1HE   LYS   6          HE2       LYS   6  14.239  -6.055   1.669
   53   2HE   LYS   6          HE1       LYS   6  14.751  -5.655   3.310
   54   1HZ   LYS   6          HZ1       LYS   6  16.115  -7.375   2.136
   55   2HZ   LYS   6          HZ2       LYS   6  14.782  -8.418   2.241
   56   3HZ   LYS   6          HZ3       LYS   6  15.520  -7.844   3.656
   57    H    TYR   7           HN       TYR   7   9.039  -4.884   0.963
   58    HA   TYR   7           HA       TYR   7   7.314  -6.973   2.012
   59   1HB   TYR   7          HB2       TYR   7   6.691  -4.034   1.706
   60   2HB   TYR   7          HB1       TYR   7   5.863  -5.212   2.723
   61    HD1  TYR   7           HD1      TYR   7   8.482  -6.511   3.726
   62    HD2  TYR   7           HD2      TYR   7   7.124  -2.506   3.438
   63    HE1  TYR   7           HE1      TYR   7   9.904  -5.903   5.618
   64    HE2  TYR   7           HE2      TYR   7   8.539  -1.868   5.286
   65    HH   TYR   7           HH       TYR   7  11.000  -3.888   6.536
   66    HA   PRO   8           HA       PRO   8   5.708  -6.979  -2.365
   67   1HB   PRO   8          HB2       PRO   8   4.819  -9.625  -1.365
   68   2HB   PRO   8          HB1       PRO   8   5.608  -9.213  -2.892
   69   1HG   PRO   8          HG2       PRO   8   6.939 -10.492  -0.972
   70   2HG   PRO   8          HG1       PRO   8   7.730  -9.237  -1.945
   71   1HD   PRO   8          HD2       PRO   8   6.626  -9.063   0.838
   72   2HD   PRO   8          HD1       PRO   8   8.143  -8.404   0.185
   73    H    ILE   9           HN       ILE   9   4.068  -5.464  -1.901
   74    HA   ILE   9           HA       ILE   9   2.283  -5.886   0.284
   75    HB   ILE   9           HB       ILE   9   1.717  -3.709   0.058
   76   1HG1  ILE   9          HG12      ILE   9   2.319  -3.665  -2.877
   77   2HG1  ILE   9          HG11      ILE   9   0.722  -4.012  -2.219
   78   1HG2  ILE   9          HG21      ILE   9   4.108  -3.787   0.320
   79   2HG2  ILE   9          HG22      ILE   9   3.633  -2.377  -0.628
   80   3HG2  ILE   9          HG23      ILE   9   4.306  -3.797  -1.431
   81   1HD1  ILE   9          HD11      ILE   9   0.986  -1.682  -2.942
   82   2HD1  ILE   9          HD12      ILE   9   2.262  -1.475  -1.740
   83   3HD1  ILE   9          HD13      ILE   9   0.613  -1.828  -1.222
   84    H    SER  10           HN       SER  10  -0.083  -5.334  -0.054
   85    HA   SER  10           HA       SER  10  -1.108  -6.207  -2.638
   86   1HB   SER  10          HB2       SER  10  -2.598  -7.873  -1.670
   87   2HB   SER  10          HB1       SER  10  -0.908  -8.272  -1.347
   88    HG   SER  10           HG       SER  10  -2.425  -6.797   0.510
   89    H    VAL  11           HN       VAL  11  -2.513  -4.803  -3.264
   90    HA   VAL  11           HA       VAL  11  -4.213  -3.401  -1.296
   91    HB   VAL  11           HB       VAL  11  -3.760  -2.233  -3.992
   92   1HG1  VAL  11          HG11      VAL  11  -5.305  -1.199  -2.427
   93   2HG1  VAL  11          HG12      VAL  11  -3.936  -0.137  -2.760
   94   3HG1  VAL  11          HG13      VAL  11  -4.010  -1.033  -1.243
   95   1HG2  VAL  11          HG21      VAL  11  -1.723  -1.057  -3.142
   96   2HG2  VAL  11          HG22      VAL  11  -1.508  -2.779  -3.473
   97   3HG2  VAL  11          HG23      VAL  11  -1.690  -2.213  -1.805
   98    H    CYS  12           HN       CYS  12  -6.384  -3.826  -1.505
   99    HA   CYS  12           HA       CYS  12  -7.347  -5.465  -3.607
  100   1HB   CYS  12          HB2       CYS  12  -8.548  -5.471  -1.514
  101   2HB   CYS  12          HB1       CYS  12  -8.848  -3.741  -1.630
  102    H    MET  13           HN       MET  13  -7.631  -4.920  -5.609
  103    HA   MET  13           HA       MET  13  -8.882  -2.326  -6.215
  104   1HB   MET  13          HB2       MET  13  -7.066  -3.952  -8.018
  105   2HB   MET  13          HB1       MET  13  -7.822  -2.421  -8.429
  106   1HG   MET  13          HG2       MET  13  -5.772  -2.840  -6.266
  107   2HG   MET  13          HG1       MET  13  -5.466  -2.153  -7.858
  108   1HE   MET  13          HE1       MET  13  -4.812  -0.850  -4.915
  109   2HE   MET  13          HE2       MET  13  -5.161   0.842  -5.275
  110   3HE   MET  13          HE3       MET  13  -4.293  -0.145  -6.449
  111    H    GLY  14           HN       GLY  14  -9.956  -4.940  -5.422
  112   1HA   GLY  14          HA2       GLY  14 -10.804  -6.420  -7.692
  113   2HA   GLY  14          HA1       GLY  14 -11.417  -6.587  -6.056
  114    H    THR  15           HN       THR  15 -13.285  -6.992  -7.690
  115    HA   THR  15           HA       THR  15 -14.462  -4.788  -8.997
  116    HB   THR  15           HB       THR  15 -15.009  -6.926  -9.828
  117    HG1  THR  15           HG1      THR  15 -17.461  -6.944  -9.011
  118   1HG2  THR  15          HG21      THR  15 -16.038  -7.645  -7.083
  119   2HG2  THR  15          HG22      THR  15 -14.557  -8.246  -7.826
  120   3HG2  THR  15          HG23      THR  15 -16.126  -8.669  -8.513
  121    H    ALA  16           HN       ALA  16 -15.131  -6.281  -5.827
  122    HA   ALA  16           HA       ALA  16 -17.462  -4.686  -5.372
  123   1HB   ALA  16          HB1       ALA  16 -17.468  -5.657  -3.151
  124   2HB   ALA  16          HB2       ALA  16 -15.842  -6.290  -3.406
  125   3HB   ALA  16          HB3       ALA  16 -17.185  -6.895  -4.375
  126    H    CYS  17           HN       CYS  17 -14.227  -4.654  -3.919
  127    HA   CYS  17           HA       CYS  17 -14.810  -2.598  -2.088
  128   1HB   CYS  17          HB2       CYS  17 -12.179  -3.642  -3.104
  129   2HB   CYS  17          HB1       CYS  17 -12.360  -2.589  -1.732
  130    H    PHE  18           HN       PHE  18 -13.486  -2.567  -5.325
  131    HA   PHE  18           HA       PHE  18 -12.274  -0.041  -5.343
  132   1HB   PHE  18          HB2       PHE  18 -11.949  -1.828  -7.051
  133   2HB   PHE  18          HB1       PHE  18 -13.546  -1.461  -7.688
  134    HD1  PHE  18           HD1      PHE  18 -10.182  -0.031  -7.107
  135    HD2  PHE  18           HD2      PHE  18 -13.850   0.269  -9.245
  136    HE1  PHE  18           HE1      PHE  18  -9.187   1.678  -8.567
  137    HE2  PHE  18           HE2      PHE  18 -12.859   1.982 -10.707
  138    HZ   PHE  18           HZ       PHE  18 -10.528   2.689 -10.367
  139    H    VAL  19           HN       VAL  19 -15.611  -0.909  -5.492
  140    HA   VAL  19           HA       VAL  19 -16.539   1.164  -7.188
  141    HB   VAL  19           HB       VAL  19 -18.074  -0.508  -5.186
  142   1HG1  VAL  19          HG11      VAL  19 -19.326   1.491  -5.790
  143   2HG1  VAL  19          HG12      VAL  19 -20.060   0.058  -6.508
  144   3HG1  VAL  19          HG13      VAL  19 -19.085   1.142  -7.501
  145   1HG2  VAL  19          HG21      VAL  19 -17.680  -0.876  -8.151
  146   2HG2  VAL  19          HG22      VAL  19 -18.670  -1.890  -7.101
  147   3HG2  VAL  19          HG23      VAL  19 -16.921  -1.834  -6.881
  148    H    LYS  20           HN       LYS  20 -15.701   1.153  -3.846
  149    HA   LYS  20           HA       LYS  20 -17.571   3.217  -3.087
  150   1HB   LYS  20          HB2       LYS  20 -15.231   1.988  -1.631
  151   2HB   LYS  20          HB1       LYS  20 -16.310   3.180  -0.928
  152   1HG   LYS  20          HG2       LYS  20 -17.085   0.428  -1.874
  153   2HG   LYS  20          HG1       LYS  20 -16.876   0.941  -0.199
  154   1HD   LYS  20          HD2       LYS  20 -18.975   1.848  -2.159
  155   2HD   LYS  20          HD1       LYS  20 -19.215   0.943  -0.665
  156   1HE   LYS  20          HE2       LYS  20 -18.262   3.795  -0.910
  157   2HE   LYS  20          HE1       LYS  20 -19.850   3.265  -0.365
  158   1HZ   LYS  20          HZ1       LYS  20 -18.869   2.283   1.574
  159   2HZ   LYS  20          HZ2       LYS  20 -18.337   3.891   1.451
  160   3HZ   LYS  20          HZ3       LYS  20 -17.299   2.624   1.023
  161    H    GLY  21           HN       GLY  21 -15.123   3.512  -5.083
  162   1HA   GLY  21          HA2       GLY  21 -14.213   5.518  -5.872
  163   2HA   GLY  21          HA1       GLY  21 -14.714   6.304  -4.375
  164    H    ALA  22           HN       ALA  22 -12.880   3.342  -4.542
  165    HA   ALA  22           HA       ALA  22 -11.184   4.326  -2.481
  166   1HB   ALA  22          HB1       ALA  22 -11.950   1.999  -2.553
  167   2HB   ALA  22          HB2       ALA  22 -10.189   2.108  -2.516
  168   3HB   ALA  22          HB3       ALA  22 -11.019   1.744  -4.030
  169    H    ASP  23           HN       ASP  23 -10.960   4.237  -5.936
  170    HA   ASP  23           HA       ASP  23  -8.216   3.938  -6.258
  171   1HB   ASP  23          HB2       ASP  23  -9.532   3.930  -8.245
  172   2HB   ASP  23          HB1       ASP  23 -10.166   5.547  -7.909
  173    H    LYS  24           HN       LYS  24 -10.051   6.936  -5.588
  174    HA   LYS  24           HA       LYS  24  -7.748   8.554  -6.066
  175   1HB   LYS  24          HB2       LYS  24 -10.236   9.278  -4.515
  176   2HB   LYS  24          HB1       LYS  24  -9.057  10.401  -5.182
  177   1HG   LYS  24          HG2       LYS  24 -10.997   8.652  -6.663
  178   2HG   LYS  24          HG1       LYS  24 -10.871  10.412  -6.680
  179   1HD   LYS  24          HD2       LYS  24  -8.780  10.302  -7.854
  180   2HD   LYS  24          HD1       LYS  24  -8.738   8.547  -7.709
  181   1HE   LYS  24          HE2       LYS  24 -10.910   8.539  -9.018
  182   2HE   LYS  24          HE1       LYS  24 -10.583  10.234  -9.376
  183   1HZ   LYS  24          HZ1       LYS  24  -9.777   8.757 -11.125
  184   2HZ   LYS  24          HZ2       LYS  24  -8.775   7.963 -10.007
  185   3HZ   LYS  24          HZ3       LYS  24  -8.493   9.594 -10.390
  186    H    VAL  25           HN       VAL  25  -9.091   7.102  -3.166
  187    HA   VAL  25           HA       VAL  25  -7.233   8.419  -1.432
  188    HB   VAL  25           HB       VAL  25  -8.024   6.273  -0.011
  189   1HG1  VAL  25          HG11      VAL  25  -9.746   7.724   0.939
  190   2HG1  VAL  25          HG12      VAL  25  -9.645   8.768  -0.481
  191   3HG1  VAL  25          HG13      VAL  25  -8.269   8.629   0.613
  192   1HG2  VAL  25          HG21      VAL  25 -10.330   5.750  -0.461
  193   2HG2  VAL  25          HG22      VAL  25  -9.360   5.376  -1.885
  194   3HG2  VAL  25          HG23      VAL  25 -10.337   6.846  -1.842
  195    H    VAL  26           HN       VAL  26  -7.361   5.209  -2.991
  196    HA   VAL  26           HA       VAL  26  -4.817   4.475  -1.901
  197    HB   VAL  26           HB       VAL  26  -4.752   2.643  -3.464
  198   1HG1  VAL  26          HG11      VAL  26  -6.192   2.381  -1.520
  199   2HG1  VAL  26          HG12      VAL  26  -6.834   1.498  -2.906
  200   3HG1  VAL  26          HG13      VAL  26  -7.554   3.037  -2.429
  201   1HG2  VAL  26          HG21      VAL  26  -5.481   3.782  -5.465
  202   2HG2  VAL  26          HG22      VAL  26  -7.110   3.941  -4.805
  203   3HG2  VAL  26          HG23      VAL  26  -6.464   2.342  -5.191
  204    H    HIS  27           HN       HIS  27  -5.851   6.541  -4.442
  205    HA   HIS  27           HA       HIS  27  -3.613   6.494  -6.120
  206   1HB   HIS  27          HB2       HIS  27  -5.830   7.762  -6.470
  207   2HB   HIS  27          HB1       HIS  27  -5.092   9.033  -5.490
  208    HD1  HIS  27           HD1      HIS  27  -2.703   9.959  -6.492
  209    HD2  HIS  27           HD2      HIS  27  -5.202   7.863  -9.087
  210    HE1  HIS  27           HE1      HIS  27  -1.842  10.432  -8.801
  211    HE2  HIS  27           HE2      HIS  27  -3.279   9.037 -10.344
  212    H    ALA  28           HN       ALA  28  -4.350   8.294  -3.268
  213    HA   ALA  28           HA       ALA  28  -2.018   9.746  -2.929
  214   1HB   ALA  28          HB1       ALA  28  -3.937   9.946  -1.428
  215   2HB   ALA  28          HB2       ALA  28  -2.451   9.661  -0.523
  216   3HB   ALA  28          HB3       ALA  28  -3.599   8.345  -0.773
  217    H    PHE  29           HN       PHE  29  -2.687   6.401  -1.973
  218    HA   PHE  29           HA       PHE  29  -0.183   5.653  -0.981
  219   1HB   PHE  29          HB2       PHE  29  -2.400   4.354  -1.056
  220   2HB   PHE  29          HB1       PHE  29  -1.939   3.883  -2.676
  221    HD1  PHE  29           HD1      PHE  29   0.799   4.259  -0.406
  222    HD2  PHE  29           HD2      PHE  29  -2.167   1.547  -1.790
  223    HE1  PHE  29           HE1      PHE  29   2.101   2.387   0.492
  224    HE2  PHE  29           HE2      PHE  29  -0.869  -0.339  -0.892
  225    HZ   PHE  29           HZ       PHE  29   1.273   0.080   0.252
  226    H    LYS  30           HN       LYS  30  -1.480   5.441  -4.257
  227    HA   LYS  30           HA       LYS  30   0.628   4.342  -5.619
  228   1HB   LYS  30          HB2       LYS  30  -1.138   6.603  -6.551
  229   2HB   LYS  30          HB1       LYS  30  -0.048   5.720  -7.604
  230   1HG   LYS  30          HG2       LYS  30  -1.314   3.652  -7.136
  231   2HG   LYS  30          HG1       LYS  30  -2.436   4.593  -6.147
  232   1HD   LYS  30          HD2       LYS  30  -3.141   5.878  -8.034
  233   2HD   LYS  30          HD1       LYS  30  -1.859   5.214  -9.043
  234   1HE   LYS  30          HE2       LYS  30  -3.823   4.104  -9.708
  235   2HE   LYS  30          HE1       LYS  30  -2.948   2.953  -8.701
  236   1HZ   LYS  30          HZ1       LYS  30  -4.414   3.738  -6.833
  237   2HZ   LYS  30          HZ2       LYS  30  -5.179   2.843  -8.045
  238   3HZ   LYS  30          HZ3       LYS  30  -5.362   4.527  -8.000
  239    H    GLU  31           HN       GLU  31   0.219   7.713  -4.818
  240    HA   GLU  31           HA       GLU  31   2.788   8.377  -6.021
  241   1HB   GLU  31          HB2       GLU  31   2.096  10.727  -5.615
  242   2HB   GLU  31          HB1       GLU  31   0.939   9.823  -6.577
  243   1HG   GLU  31          HG2       GLU  31  -0.322   9.417  -4.416
  244   2HG   GLU  31          HG1       GLU  31   0.720  10.646  -3.702
  245    H    GLN  32           HN       GLN  32   1.488   7.767  -2.956
  246    HA   GLN  32           HA       GLN  32   3.361   9.156  -1.398
  247   1HB   GLN  32          HB2       GLN  32   2.391   8.183   0.402
  248   2HB   GLN  32          HB1       GLN  32   1.084   8.007  -0.751
  249   1HG   GLN  32          HG2       GLN  32   1.279   5.785  -0.847
  250   2HG   GLN  32          HG1       GLN  32   3.031   5.840  -0.691
  251   1HE2  GLN  32          HE21      GLN  32   0.952   7.475   1.534
  252   2HE2  GLN  32          HE22      GLN  32   1.221   6.426   2.886
  253    H    LEU  33           HN       LEU  33   3.413   6.224  -3.247
  254    HA   LEU  33           HA       LEU  33   5.645   4.945  -2.241
  255   1HB   LEU  33          HB2       LEU  33   4.307   4.534  -4.463
  256   2HB   LEU  33          HB1       LEU  33   5.524   5.584  -5.168
  257    HG   LEU  33           HG       LEU  33   5.897   2.918  -3.878
  258   1HD1  LEU  33          HD11      LEU  33   6.910   2.337  -6.017
  259   2HD1  LEU  33          HD12      LEU  33   6.520   3.956  -6.608
  260   3HD1  LEU  33          HD13      LEU  33   5.226   2.839  -6.165
  261   1HD2  LEU  33          HD21      LEU  33   7.719   4.342  -3.091
  262   2HD2  LEU  33          HD22      LEU  33   8.124   4.743  -4.764
  263   3HD2  LEU  33          HD23      LEU  33   8.295   3.084  -4.182
  264    H    LYS  34           HN       LYS  34   5.552   7.392  -4.649
  265    HA   LYS  34           HA       LYS  34   6.674   9.252  -5.101
  266   1HB   LYS  34          HB2       LYS  34   7.383  10.668  -3.253
  267   2HB   LYS  34          HB1       LYS  34   5.820   9.928  -2.961
  268   1HG   LYS  34          HG2       LYS  34   6.746   9.666  -0.902
  269   2HG   LYS  34          HG1       LYS  34   7.304   8.146  -1.639
  270   1HD   LYS  34          HD2       LYS  34   9.459   9.104  -2.076
  271   2HD   LYS  34          HD1       LYS  34   8.917  10.709  -1.580
  272   1HE   LYS  34          HE2       LYS  34   9.149   8.273   0.187
  273   2HE   LYS  34          HE1       LYS  34  10.246   9.653   0.172
  274   1HZ   LYS  34          HZ1       LYS  34   8.798  10.001   1.967
  275   2HZ   LYS  34          HZ2       LYS  34   7.429   9.576   1.070
  276   3HZ   LYS  34          HZ3       LYS  34   8.226  11.032   0.749
  277    H    ILE  35           HN       ILE  35   8.395   6.814  -3.625
  278    HA   ILE  35           HA       ILE  35  10.333   5.828  -4.016
  279    HB   ILE  35           HB       ILE  35  10.803   6.866  -6.689
  280   1HG1  ILE  35          HG12      ILE  35   8.240   5.392  -6.277
  281   2HG1  ILE  35          HG11      ILE  35   8.241   7.155  -6.318
  282   1HG2  ILE  35          HG21      ILE  35  10.609   4.463  -7.182
  283   2HG2  ILE  35          HG22      ILE  35  10.020   4.197  -5.534
  284   3HG2  ILE  35          HG23      ILE  35  11.673   4.761  -5.806
  285   1HD1  ILE  35          HD11      ILE  35   9.110   5.282  -8.512
  286   2HD1  ILE  35          HD12      ILE  35   9.237   7.039  -8.576
  287   3HD1  ILE  35          HD13      ILE  35   7.652   6.274  -8.483
  288    H    ASP  36           HN       ASP  36  12.473   6.285  -5.465
  289    HA   ASP  36           HA       ASP  36  13.736   8.778  -4.811
  290   1HB   ASP  36          HB2       ASP  36  13.744   7.344  -2.683
  291   2HB   ASP  36          HB1       ASP  36  14.801   6.234  -3.543
  292    H    ILE  37           HN       ILE  37  14.148   5.386  -5.443
  293    HA   ILE  37           HA       ILE  37  15.373   5.685  -8.010
  294    HB   ILE  37           HB       ILE  37  17.403   4.387  -7.292
  295   1HG1  ILE  37          HG12      ILE  37  16.260   5.224  -4.691
  296   2HG1  ILE  37          HG11      ILE  37  16.814   3.631  -5.194
  297   1HG2  ILE  37          HG21      ILE  37  17.625   6.703  -7.990
  298   2HG2  ILE  37          HG22      ILE  37  18.724   6.340  -6.661
  299   3HG2  ILE  37          HG23      ILE  37  17.238   7.238  -6.357
  300   1HD1  ILE  37          HD11      ILE  37  19.137   4.403  -5.115
  301   2HD1  ILE  37          HD12      ILE  37  18.332   4.565  -3.555
  302   3HD1  ILE  37          HD13      ILE  37  18.586   5.985  -4.568
  303    H    GLY  38           HN       GLY  38  13.381   4.109  -6.143
  304   1HA   GLY  38          HA2       GLY  38  13.713   1.498  -7.213
  305   2HA   GLY  38          HA1       GLY  38  14.371   1.611  -5.567
  306    H    ASP  39           HN       ASP  39  12.944   3.044  -4.205
  307    HA   ASP  39           HA       ASP  39  10.175   2.961  -4.368
  308   1HB   ASP  39          HB2       ASP  39  10.549   0.563  -4.344
  309   2HB   ASP  39          HB1       ASP  39  11.361   0.720  -2.797
  310    H    VAL  40           HN       VAL  40   9.631   4.392  -3.353
  311    HA   VAL  40           HA       VAL  40   9.188   5.944  -1.836
  312    HB   VAL  40           HB       VAL  40   8.223   4.131  -0.653
  313   1HG1  VAL  40          HG11      VAL  40   9.223   2.804   1.015
  314   2HG1  VAL  40          HG12      VAL  40  10.751   3.664   0.857
  315   3HG1  VAL  40          HG13      VAL  40  10.173   2.641  -0.461
  316   1HG2  VAL  40          HG21      VAL  40   8.232   6.287   0.404
  317   2HG2  VAL  40          HG22      VAL  40   9.749   5.875   1.208
  318   3HG2  VAL  40          HG23      VAL  40   8.275   4.987   1.593
  319    H    THR  41           HN       THR  41  11.798   4.278  -0.436
  320    HA   THR  41           HA       THR  41  13.571   6.534  -0.510
  321    HB   THR  41           HB       THR  41  12.681   5.654   2.238
  322    HG1  THR  41           HG1      THR  41  11.734   7.592   0.546
  323   1HG2  THR  41          HG21      THR  41  14.082   7.505   3.023
  324   2HG2  THR  41          HG22      THR  41  14.574   7.842   1.364
  325   3HG2  THR  41          HG23      THR  41  15.036   6.321   2.128
  326    HA   PRO  42           HA       PRO  42  15.904   2.964   1.248
  327   1HB   PRO  42          HB2       PRO  42  14.711   0.641   1.974
  328   2HB   PRO  42          HB1       PRO  42  14.941   1.996   3.087
  329   1HG   PRO  42          HG2       PRO  42  12.512   1.229   1.517
  330   2HG   PRO  42          HG1       PRO  42  12.634   1.759   3.205
  331   1HD   PRO  42          HD2       PRO  42  11.896   3.423   1.201
  332   2HD   PRO  42          HD1       PRO  42  12.790   3.979   2.627
  333    H    ASP  43           HN       ASP  43  13.623   2.724  -1.289
  334    HA   ASP  43           HA       ASP  43  14.355   2.295  -3.429
  335   1HB   ASP  43          HB2       ASP  43  16.678   2.522  -2.939
  336   2HB   ASP  43          HB1       ASP  43  16.701   1.045  -1.991
  337    H    GLY  44           HN       GLY  44  13.211   0.532  -1.079
  338   1HA   GLY  44          HA2       GLY  44  11.582  -0.943  -2.650
  339   2HA   GLY  44          HA1       GLY  44  12.954  -2.023  -2.376
  340    H    ARG  45           HN       ARG  45  10.752   0.124  -0.664
  341    HA   ARG  45           HA       ARG  45  10.779  -1.551   1.697
  342   1HB   ARG  45          HB2       ARG  45  10.486   1.079   1.485
  343   2HB   ARG  45          HB1       ARG  45   8.811   0.648   1.189
  344   1HG   ARG  45          HG2       ARG  45   9.104   1.173   3.507
  345   2HG   ARG  45          HG1       ARG  45   8.741  -0.544   3.332
  346   1HD   ARG  45          HD2       ARG  45  11.042  -1.126   3.654
  347   2HD   ARG  45          HD1       ARG  45  11.524   0.570   3.616
  348    HE   ARG  45           HE       ARG  45   9.721   0.409   5.667
  349   1HH1  ARG  45          HH11      ARG  45  12.776  -1.144   4.902
  350   2HH1  ARG  45          HH12      ARG  45  13.191  -1.433   6.559
  351   1HH2  ARG  45          HH21      ARG  45  10.272   0.025   7.850
  352   2HH2  ARG  45          HH22      ARG  45  11.772  -0.777   8.239
  353    H    PHE  46           HN       PHE  46   8.300  -0.255  -0.513
  354    HA   PHE  46           HA       PHE  46   6.758  -2.666  -0.015
  355   1HB   PHE  46          HB2       PHE  46   4.807  -1.296  -0.320
  356   2HB   PHE  46          HB1       PHE  46   5.780  -0.740   1.010
  357    HD1  PHE  46           HD1      PHE  46   7.626   1.212  -0.057
  358    HD2  PHE  46           HD2      PHE  46   3.655   0.326  -1.332
  359    HE1  PHE  46           HE1      PHE  46   7.307   3.582  -0.839
  360    HE2  PHE  46           HE2      PHE  46   3.370   2.608  -2.096
  361    HZ   PHE  46           HZ       PHE  46   5.180   4.216  -1.838
  362    H    SER  47           HN       SER  47   6.331  -3.929  -1.643
  363    HA   SER  47           HA       SER  47   6.684  -2.937  -4.394
  364   1HB   SER  47          HB2       SER  47   8.046  -4.919  -3.700
  365   2HB   SER  47          HB1       SER  47   6.549  -5.800  -3.404
  366    HG   SER  47           HG       SER  47   6.144  -5.890  -5.529
  367    H    ILE  48           HN       ILE  48   4.800  -2.144  -5.063
  368    HA   ILE  48           HA       ILE  48   2.320  -2.846  -3.939
  369    HB   ILE  48           HB       ILE  48   1.346  -1.386  -5.728
  370   1HG1  ILE  48          HG12      ILE  48   3.410   0.003  -6.798
  371   2HG1  ILE  48          HG11      ILE  48   4.112  -1.612  -6.773
  372   1HG2  ILE  48          HG21      ILE  48   2.382   0.683  -4.901
  373   2HG2  ILE  48          HG22      ILE  48   3.681  -0.269  -4.181
  374   3HG2  ILE  48          HG23      ILE  48   2.025  -0.453  -3.602
  375   1HD1  ILE  48          HD11      ILE  48   3.066  -1.179  -8.897
  376   2HD1  ILE  48          HD12      ILE  48   1.540  -0.801  -8.100
  377   3HD1  ILE  48          HD13      ILE  48   2.185  -2.441  -8.037
  378    H    ASP  49           HN       ASP  49   1.231  -4.772  -4.260
  379    HA   ASP  49           HA       ASP  49   0.202  -4.965  -6.974
  380   1HB   ASP  49          HB2       ASP  49   2.239  -6.494  -6.880
  381   2HB   ASP  49          HB1       ASP  49   1.288  -7.497  -5.793
  382    H    THR  50           HN       THR  50  -1.748  -5.618  -7.069
  383    HA   THR  50           HA       THR  50  -3.628  -5.893  -5.148
  384    HB   THR  50           HB       THR  50  -3.813  -7.556  -7.627
  385    HG1  THR  50           HG1      THR  50  -3.821  -5.815  -8.866
  386   1HG2  THR  50          HG21      THR  50  -5.760  -5.780  -6.149
  387   2HG2  THR  50          HG22      THR  50  -5.733  -7.546  -6.132
  388   3HG2  THR  50          HG23      THR  50  -6.117  -6.683  -7.621
  389    H    LEU  51           HN       LEU  51  -1.552  -8.608  -6.254
  390    HA   LEU  51           HA       LEU  51  -3.608 -10.441  -6.384
  391   1HB   LEU  51          HB2       LEU  51  -2.031 -12.092  -6.811
  392   2HB   LEU  51          HB1       LEU  51  -1.304 -10.603  -7.371
  393    HG   LEU  51           HG       LEU  51  -0.642 -11.906  -4.725
  394   1HD1  LEU  51          HD11      LEU  51  -0.010 -13.364  -6.567
  395   2HD1  LEU  51          HD12      LEU  51   1.419 -12.657  -5.811
  396   3HD1  LEU  51          HD13      LEU  51   0.833 -12.029  -7.352
  397   1HD2  LEU  51          HD21      LEU  51  -0.184  -9.507  -4.797
  398   2HD2  LEU  51          HD22      LEU  51   0.744  -9.724  -6.281
  399   3HD2  LEU  51          HD23      LEU  51   1.312 -10.442  -4.775
  400    H    ARG  52           HN       ARG  52  -1.528 -10.018  -3.489
  401    HA   ARG  52           HA       ARG  52  -2.505 -12.314  -2.152
  402   1HB   ARG  52          HB2       ARG  52  -1.459  -9.742  -0.956
  403   2HB   ARG  52          HB1       ARG  52  -1.675 -11.251  -0.084
  404   1HG   ARG  52          HG2       ARG  52   0.086 -11.096  -2.499
  405   2HG   ARG  52          HG1       ARG  52   0.671 -10.634  -0.901
  406   1HD   ARG  52          HD2       ARG  52  -0.687 -13.267  -1.264
  407   2HD   ARG  52          HD1       ARG  52   0.985 -13.079  -1.788
  408    HE   ARG  52           HE       ARG  52   1.117 -12.131   0.700
  409   1HH1  ARG  52          HH11      ARG  52  -0.462 -15.018  -0.520
  410   2HH1  ARG  52          HH12      ARG  52  -0.105 -15.957   0.904
  411   1HH2  ARG  52          HH21      ARG  52   1.593 -13.372   2.571
  412   2HH2  ARG  52          HH22      ARG  52   1.037 -15.018   2.657
  413    H    CYS  53           HN       CYS  53  -3.314  -8.962  -1.744
  414    HA   CYS  53           HA       CYS  53  -5.549  -9.266  -0.076
  415   1HB   CYS  53          HB2       CYS  53  -4.117  -7.247  -0.215
  416   2HB   CYS  53          HB1       CYS  53  -4.823  -6.902  -1.794
  417    H    VAL  54           HN       VAL  54  -7.733  -8.101  -0.838
  418    HA   VAL  54           HA       VAL  54  -9.726  -8.687  -1.747
  419    HB   VAL  54           HB       VAL  54  -8.293  -9.807  -4.165
  420   1HG1  VAL  54          HG11      VAL  54 -10.361  -9.222  -5.337
  421   2HG1  VAL  54          HG12      VAL  54 -11.052  -8.640  -3.822
  422   3HG1  VAL  54          HG13      VAL  54 -10.660 -10.349  -4.013
  423   1HG2  VAL  54          HG21      VAL  54  -7.491  -7.528  -3.796
  424   2HG2  VAL  54          HG22      VAL  54  -9.156  -6.949  -3.732
  425   3HG2  VAL  54          HG23      VAL  54  -8.514  -7.626  -5.230
  426    H    GLY  55           HN       GLY  55  -7.977 -10.322  -0.180
  427   1HA   GLY  55          HA2       GLY  55  -9.027 -12.988  -0.832
  428   2HA   GLY  55          HA1       GLY  55  -7.499 -12.713  -0.014
  429    H    GLY  56           HN       GLY  56 -10.979 -11.741   0.494
  430   1HA   GLY  56          HA2       GLY  56 -12.294 -12.155   2.349
  431   2HA   GLY  56          HA1       GLY  56 -11.174 -13.439   2.746
  432    H    CYS  57           HN       CYS  57 -11.314  -9.806   2.937
  433    HA   CYS  57           HA       CYS  57  -9.543 -10.032   5.335
  434   1HB   CYS  57          HB2       CYS  57  -9.345  -7.682   3.566
  435   2HB   CYS  57          HB1       CYS  57  -8.106  -8.474   4.480
  436    H    ALA  58           HN       ALA  58 -11.975  -8.342   3.470
  437    HA   ALA  58           HA       ALA  58 -11.708  -5.761   4.297
  438   1HB   ALA  58          HB1       ALA  58 -13.930  -5.380   3.463
  439   2HB   ALA  58          HB2       ALA  58 -14.290  -7.105   3.557
  440   3HB   ALA  58          HB3       ALA  58 -13.073  -6.518   2.422
  441    H    LEU  59           HN       LEU  59 -13.413  -8.274   6.199
  442    HA   LEU  59           HA       LEU  59 -14.700  -6.309   7.849
  443   1HB   LEU  59          HB2       LEU  59 -14.114  -9.226   8.326
  444   2HB   LEU  59          HB1       LEU  59 -15.061  -8.228   9.413
  445    HG   LEU  59           HG       LEU  59 -15.777  -8.880   6.552
  446   1HD1  LEU  59          HD11      LEU  59 -16.004 -10.789   8.051
  447   2HD1  LEU  59          HD12      LEU  59 -17.582 -10.188   7.547
  448   3HD1  LEU  59          HD13      LEU  59 -16.972  -9.815   9.157
  449   1HD2  LEU  59          HD21      LEU  59 -17.316  -7.355   8.654
  450   2HD2  LEU  59          HD22      LEU  59 -17.891  -7.774   7.040
  451   3HD2  LEU  59          HD23      LEU  59 -16.544  -6.654   7.230
  452    H    ALA  60           HN       ALA  60 -11.488  -6.985   7.561
  453    HA   ALA  60           HA       ALA  60 -11.038  -5.530  10.092
  454   1HB   ALA  60          HB1       ALA  60  -9.059  -7.126   8.447
  455   2HB   ALA  60          HB2       ALA  60  -9.744  -7.616   9.995
  456   3HB   ALA  60          HB3       ALA  60  -8.678  -6.215   9.909
  457    HA   PRO  61           HA       PRO  61  -9.621  -2.390   7.097
  458   1HB   PRO  61          HB2       PRO  61  -7.722  -1.060   8.532
  459   2HB   PRO  61          HB1       PRO  61  -9.451  -0.757   8.729
  460   1HG   PRO  61          HG2       PRO  61  -7.595  -2.342  10.443
  461   2HG   PRO  61          HG1       PRO  61  -8.961  -1.319  10.914
  462   1HD   PRO  61          HD2       PRO  61  -9.047  -4.070  10.791
  463   2HD   PRO  61          HD1       PRO  61 -10.469  -3.018  10.649
  464    H    ILE  62           HN       ILE  62  -8.365  -3.218   5.494
  465    HA   ILE  62           HA       ILE  62  -5.841  -4.492   6.300
  466    HB   ILE  62           HB       ILE  62  -7.346  -6.079   5.295
  467   1HG1  ILE  62          HG12      ILE  62  -5.947  -6.838   3.361
  468   2HG1  ILE  62          HG11      ILE  62  -5.072  -5.312   3.454
  469   1HG2  ILE  62          HG21      ILE  62  -8.746  -4.593   4.018
  470   2HG2  ILE  62          HG22      ILE  62  -8.102  -5.855   2.968
  471   3HG2  ILE  62          HG23      ILE  62  -7.413  -4.231   2.921
  472   1HD1  ILE  62          HD11      ILE  62  -4.331  -5.878   5.710
  473   2HD1  ILE  62          HD12      ILE  62  -3.845  -7.104   4.539
  474   3HD1  ILE  62          HD13      ILE  62  -5.211  -7.402   5.615
  475    H    VAL  63           HN       VAL  63  -4.001  -3.396   5.792
  476    HA   VAL  63           HA       VAL  63  -3.798  -2.920   2.913
  477    HB   VAL  63           HB       VAL  63  -2.465  -1.110   4.952
  478   1HG1  VAL  63          HG11      VAL  63  -1.604   0.087   2.982
  479   2HG1  VAL  63          HG12      VAL  63  -2.327  -1.135   1.936
  480   3HG1  VAL  63          HG13      VAL  63  -1.026  -1.578   3.042
  481   1HG2  VAL  63          HG21      VAL  63  -4.832  -0.563   4.632
  482   2HG2  VAL  63          HG22      VAL  63  -4.571  -0.469   2.890
  483   3HG2  VAL  63          HG23      VAL  63  -3.782   0.685   3.964
  484    H    MET  64           HN       MET  64  -2.195  -4.343   2.172
  485    HA   MET  64           HA       MET  64  -0.461  -5.313   4.342
  486   1HB   MET  64          HB2       MET  64  -1.975  -7.026   3.444
  487   2HB   MET  64          HB1       MET  64  -1.322  -6.752   1.832
  488   1HG   MET  64          HG2       MET  64   0.918  -7.367   2.760
  489   2HG   MET  64          HG1       MET  64   0.085  -7.890   4.223
  490   1HE   MET  64          HE1       MET  64  -2.659  -8.997   2.798
  491   2HE   MET  64          HE2       MET  64  -1.859  -9.725   4.190
  492   3HE   MET  64          HE3       MET  64  -2.259 -10.716   2.786
  493    H    VAL  65           HN       VAL  65   1.587  -5.102   4.180
  494    HA   VAL  65           HA       VAL  65   2.819  -4.742   1.530
  495    HB   VAL  65           HB       VAL  65   4.711  -3.650   2.950
  496   1HG1  VAL  65          HG11      VAL  65   3.633  -1.425   2.894
  497   2HG1  VAL  65          HG12      VAL  65   2.086  -2.212   2.561
  498   3HG1  VAL  65          HG13      VAL  65   3.405  -2.331   1.394
  499   1HG2  VAL  65          HG21      VAL  65   3.880  -2.503   4.976
  500   2HG2  VAL  65          HG22      VAL  65   3.882  -4.263   5.122
  501   3HG2  VAL  65          HG23      VAL  65   2.368  -3.405   4.818
  502    H    GLY  66           HN       GLY  66   3.876  -6.642   1.086
  503   1HA   GLY  66          HA2       GLY  66   4.828  -8.685   1.406
  504   2HA   GLY  66          HA1       GLY  66   5.775  -7.846   2.644
  505    H    GLU  67           HN       GLU  67   5.797  -9.759   3.759
  506    HA   GLU  67           HA       GLU  67   3.374 -10.691   5.051
  507   1HB   GLU  67          HB2       GLU  67   6.291 -11.341   5.556
  508   2HB   GLU  67          HB1       GLU  67   4.946 -12.096   6.401
  509   1HG   GLU  67          HG2       GLU  67   5.448 -12.233   3.436
  510   2HG   GLU  67          HG1       GLU  67   5.822 -13.502   4.601
  511    H    LYS  68           HN       LYS  68   3.877  -7.933   5.251
  512    HA   LYS  68           HA       LYS  68   4.716  -7.576   8.032
  513   1HB   LYS  68          HB2       LYS  68   4.373  -5.412   5.947
  514   2HB   LYS  68          HB1       LYS  68   5.137  -5.253   7.520
  515   1HG   LYS  68          HG2       LYS  68   6.211  -6.817   5.148
  516   2HG   LYS  68          HG1       LYS  68   6.832  -5.298   5.783
  517   1HD   LYS  68          HD2       LYS  68   6.727  -7.888   7.341
  518   2HD   LYS  68          HD1       LYS  68   8.156  -7.248   6.526
  519   1HE   LYS  68          HE2       LYS  68   8.175  -5.315   7.948
  520   2HE   LYS  68          HE1       LYS  68   6.634  -5.776   8.668
  521   1HZ   LYS  68          HZ1       LYS  68   7.669  -7.698   9.643
  522   2HZ   LYS  68          HZ2       LYS  68   8.536  -6.308  10.085
  523   3HZ   LYS  68          HZ3       LYS  68   9.145  -7.343   8.886
  524    H    VAL  69           HN       VAL  69   2.121  -7.352   5.813
  525    HA   VAL  69           HA       VAL  69   0.026  -6.367   5.904
  526    HB   VAL  69           HB       VAL  69  -1.382  -7.377   7.740
  527   1HG1  VAL  69          HG11      VAL  69  -1.095  -8.380   5.534
  528   2HG1  VAL  69          HG12      VAL  69  -1.251  -9.611   6.790
  529   3HG1  VAL  69          HG13      VAL  69   0.336  -9.241   6.109
  530   1HG2  VAL  69          HG21      VAL  69   1.217  -8.739   8.450
  531   2HG2  VAL  69          HG22      VAL  69  -0.376  -9.209   9.043
  532   3HG2  VAL  69          HG23      VAL  69   0.299  -7.639   9.478
  533    H    TYR  70           HN       TYR  70   0.161  -4.186   6.114
  534    HA   TYR  70           HA       TYR  70   0.361  -3.061   8.817
  535   1HB   TYR  70          HB2       TYR  70   1.253  -2.068   6.118
  536   2HB   TYR  70          HB1       TYR  70   0.942  -0.930   7.428
  537    HD1  TYR  70           HD1      TYR  70   2.146  -4.210   8.362
  538    HD2  TYR  70           HD2      TYR  70   3.329  -0.281   7.290
  539    HE1  TYR  70           HE1      TYR  70   4.375  -4.640   9.265
  540    HE2  TYR  70           HE2      TYR  70   5.533  -0.685   8.179
  541    HH   TYR  70           HH       TYR  70   6.551  -2.270  10.000
  542    H    GLY  71           HN       GLY  71  -0.378  -0.487   8.248
  543   1HA   GLY  71          HA2       GLY  71  -3.103  -0.570   7.240
  544   2HA   GLY  71          HA1       GLY  71  -2.856  -0.077   8.913
  545    H    ASN  72           HN       ASN  72  -0.980   0.576   5.958
  546    HA   ASN  72           HA       ASN  72  -0.836   3.381   6.531
  547   1HB   ASN  72          HB2       ASN  72   0.888   3.310   5.086
  548   2HB   ASN  72          HB1       ASN  72   0.561   1.604   4.835
  549   1HD2  ASN  72          HD21      ASN  72   0.134   4.806   3.588
  550   2HD2  ASN  72          HD22      ASN  72  -0.406   4.348   2.014
  551    H    VAL  73           HN       VAL  73  -3.248   1.489   5.600
  552    HA   VAL  73           HA       VAL  73  -5.355   1.797   4.924
  553    HB   VAL  73           HB       VAL  73  -6.223   4.222   5.639
  554   1HG1  VAL  73          HG11      VAL  73  -6.662   3.238   7.853
  555   2HG1  VAL  73          HG12      VAL  73  -5.482   1.972   7.512
  556   3HG1  VAL  73          HG13      VAL  73  -6.955   2.085   6.550
  557   1HG2  VAL  73          HG21      VAL  73  -4.992   5.024   7.589
  558   2HG2  VAL  73          HG22      VAL  73  -3.983   5.093   6.142
  559   3HG2  VAL  73          HG23      VAL  73  -3.746   3.797   7.321
  560    H    THR  74           HN       THR  74  -6.474   4.562   4.378
  561    HA   THR  74           HA       THR  74  -5.504   4.948   1.712
  562    HB   THR  74           HB       THR  74  -6.912   2.950   1.466
  563    HG1  THR  74           HG1      THR  74  -6.851   4.029  -0.378
  564   1HG2  THR  74          HG21      THR  74  -9.201   4.752   2.252
  565   2HG2  THR  74          HG22      THR  74  -8.605   3.365   3.164
  566   3HG2  THR  74          HG23      THR  74  -9.353   3.127   1.585
  567    HA   PRO  75           HA       PRO  75  -8.738   8.298   2.630
  568   1HB   PRO  75          HB2       PRO  75  -9.733   8.324   5.276
  569   2HB   PRO  75          HB1       PRO  75 -10.582   7.791   3.827
  570   1HG   PRO  75          HG2       PRO  75  -9.808   6.169   5.962
  571   2HG   PRO  75          HG1       PRO  75 -10.301   5.609   4.355
  572   1HD   PRO  75          HD2       PRO  75  -7.561   5.961   5.487
  573   2HD   PRO  75          HD1       PRO  75  -8.171   4.727   4.363
  574    H    GLY  76           HN       GLY  76  -6.256   8.974   2.778
  575   1HA   GLY  76          HA2       GLY  76  -5.262  11.024   3.297
  576   2HA   GLY  76          HA1       GLY  76  -6.392  11.211   4.626
  577    H    GLN  77           HN       GLN  77  -5.831   8.659   5.864
  578    HA   GLN  77           HA       GLN  77  -3.657   9.540   7.523
  579   1HB   GLN  77          HB2       GLN  77  -4.865   6.776   7.518
  580   2HB   GLN  77          HB1       GLN  77  -4.159   7.642   8.871
  581   1HG   GLN  77          HG2       GLN  77  -6.018   9.163   8.931
  582   2HG   GLN  77          HG1       GLN  77  -6.707   8.418   7.486
  583   1HE2  GLN  77          HE21      GLN  77  -7.452   6.271   7.616
  584   2HE2  GLN  77          HE22      GLN  77  -7.962   5.611   9.134
  585    H    VAL  78           HN       VAL  78  -3.996   7.927   4.728
  586    HA   VAL  78           HA       VAL  78  -2.154   6.049   4.302
  587    HB   VAL  78           HB       VAL  78  -3.237   8.338   2.755
  588   1HG1  VAL  78          HG11      VAL  78  -1.037   6.597   1.722
  589   2HG1  VAL  78          HG12      VAL  78  -0.948   8.336   2.054
  590   3HG1  VAL  78          HG13      VAL  78  -2.012   7.728   0.761
  591   1HG2  VAL  78          HG21      VAL  78  -4.128   6.610   1.364
  592   2HG2  VAL  78          HG22      VAL  78  -4.440   6.214   3.061
  593   3HG2  VAL  78          HG23      VAL  78  -3.142   5.396   2.182
  594    H    LYS  79           HN       LYS  79  -1.442   9.535   3.959
  595    HA   LYS  79           HA       LYS  79   1.193   9.108   3.094
  596   1HB   LYS  79          HB2       LYS  79  -0.003  11.590   4.334
  597   2HB   LYS  79          HB1       LYS  79   1.452  11.524   3.349
  598   1HG   LYS  79          HG2       LYS  79   0.187  10.879   1.414
  599   2HG   LYS  79          HG1       LYS  79  -1.291  10.740   2.372
  600   1HD   LYS  79          HD2       LYS  79   0.270  13.298   2.015
  601   2HD   LYS  79          HD1       LYS  79  -1.129  12.844   1.039
  602   1HE   LYS  79          HE2       LYS  79  -2.486  12.724   3.093
  603   2HE   LYS  79          HE1       LYS  79  -1.087  13.243   4.029
  604   1HZ   LYS  79          HZ1       LYS  79  -2.335  14.835   1.854
  605   2HZ   LYS  79          HZ2       LYS  79  -1.089  15.338   2.888
  606   3HZ   LYS  79          HZ3       LYS  79  -2.638  15.053   3.504
  607    H    LYS  80           HN       LYS  80  -0.202   9.251   6.176
  608    HA   LYS  80           HA       LYS  80   2.110  10.057   7.636
  609   1HB   LYS  80          HB2       LYS  80  -0.506   8.802   8.481
  610   2HB   LYS  80          HB1       LYS  80   0.658   9.549   9.542
  611   1HG   LYS  80          HG2       LYS  80  -1.126  11.039   9.242
  612   2HG   LYS  80          HG1       LYS  80   0.262  11.707   8.398
  613   1HD   LYS  80          HD2       LYS  80  -0.690  10.920   6.245
  614   2HD   LYS  80          HD1       LYS  80  -2.065  10.248   7.133
  615   1HE   LYS  80          HE2       LYS  80  -2.556  12.458   6.126
  616   2HE   LYS  80          HE1       LYS  80  -2.753  12.430   7.876
  617   1HZ   LYS  80          HZ1       LYS  80  -1.631  14.435   7.168
  618   2HZ   LYS  80          HZ2       LYS  80  -0.417  13.538   6.395
  619   3HZ   LYS  80          HZ3       LYS  80  -0.568  13.483   8.087
  620    H    ILE  81           HN       ILE  81   0.187   7.126   7.385
  621    HA   ILE  81           HA       ILE  81   2.060   5.486   8.717
  622    HB   ILE  81           HB       ILE  81   0.192   4.492   6.582
  623   1HG1  ILE  81          HG12      ILE  81  -1.080   5.929   8.132
  624   2HG1  ILE  81          HG11      ILE  81  -1.522   4.236   8.320
  625   1HG2  ILE  81          HG21      ILE  81   1.793   2.859   7.391
  626   2HG2  ILE  81          HG22      ILE  81   0.184   2.454   7.985
  627   3HG2  ILE  81          HG23      ILE  81   1.352   3.216   9.063
  628   1HD1  ILE  81          HD11      ILE  81  -1.348   5.334  10.467
  629   2HD1  ILE  81          HD12      ILE  81   0.317   5.797  10.114
  630   3HD1  ILE  81          HD13      ILE  81  -0.106   4.094  10.300
  631    H    LEU  82           HN       LEU  82   2.110   6.885   5.564
  632    HA   LEU  82           HA       LEU  82   3.895   5.157   4.271
  633   1HB   LEU  82          HB2       LEU  82   3.048   6.972   3.007
  634   2HB   LEU  82          HB1       LEU  82   3.587   8.151   4.188
  635    HG   LEU  82           HG       LEU  82   5.940   7.598   3.597
  636   1HD1  LEU  82          HD11      LEU  82   5.642   5.373   2.712
  637   2HD1  LEU  82          HD12      LEU  82   6.337   6.414   1.469
  638   3HD1  LEU  82          HD13      LEU  82   4.625   5.991   1.410
  639   1HD2  LEU  82          HD21      LEU  82   5.916   8.817   1.469
  640   2HD2  LEU  82          HD22      LEU  82   4.831   9.545   2.654
  641   3HD2  LEU  82          HD23      LEU  82   4.175   8.559   1.347
  642    H    ALA  83           HN       ALA  83   4.513   7.769   6.626
  643    HA   ALA  83           HA       ALA  83   7.310   7.466   6.743
  644   1HB   ALA  83          HB1       ALA  83   6.187   9.313   7.839
  645   2HB   ALA  83          HB2       ALA  83   7.130   8.403   9.019
  646   3HB   ALA  83          HB3       ALA  83   5.381   8.199   8.942
  647    H    GLU  84           HN       GLU  84   4.684   5.670   8.150
  648    HA   GLU  84           HA       GLU  84   6.272   3.919   9.731
  649   1HB   GLU  84          HB2       GLU  84   3.462   4.198   8.985
  650   2HB   GLU  84          HB1       GLU  84   3.986   2.549   9.281
  651   1HG   GLU  84          HG2       GLU  84   4.945   3.395  11.471
  652   2HG   GLU  84          HG1       GLU  84   4.047   4.886  11.163
  653    H    TYR  85           HN       TYR  85   5.491   4.017   6.362
  654    HA   TYR  85           HA       TYR  85   5.791   1.236   5.959
  655   1HB   TYR  85          HB2       TYR  85   5.055   3.561   4.366
  656   2HB   TYR  85          HB1       TYR  85   5.873   2.267   3.489
  657    HD1  TYR  85           HD1      TYR  85   4.210   1.343   6.404
  658    HD2  TYR  85           HD2      TYR  85   3.741   1.953   2.330
  659    HE1  TYR  85           HE1      TYR  85   2.356  -0.134   6.484
  660    HE2  TYR  85           HE2      TYR  85   1.799   0.474   2.386
  661    HH   TYR  85           HH       TYR  85   0.721  -1.174   3.589
  Start of MODEL    9
    1   1H    MET   1          HT1       MET   1  10.511   0.115 -12.962
    2   2H    MET   1          HT2       MET   1  10.342   1.017 -11.534
    3   3H    MET   1          HT3       MET   1   9.636   1.567 -12.973
    4    HA   MET   1           HA       MET   1   8.018   0.601 -11.440
    5   1HB   MET   1          HB2       MET   1   6.902  -0.826 -13.076
    6   2HB   MET   1          HB1       MET   1   7.594   0.582 -13.866
    7   1HG   MET   1          HG2       MET   1   9.441  -0.741 -14.682
    8   2HG   MET   1          HG1       MET   1   8.846  -2.154 -13.814
    9   1HE   MET   1          HE1       MET   1   8.122   0.397 -16.718
   10   2HE   MET   1          HE2       MET   1   6.672   0.506 -15.721
   11   3HE   MET   1          HE3       MET   1   6.582  -0.201 -17.334
   12    H    VAL   2           HN       VAL   2  10.884  -0.826 -11.205
   13    HA   VAL   2           HA       VAL   2   9.757  -3.333 -10.151
   14    HB   VAL   2           HB       VAL   2  12.434  -3.014 -11.524
   15   1HG1  VAL   2          HG11      VAL   2  11.144  -5.458 -10.319
   16   2HG1  VAL   2          HG12      VAL   2  12.556  -4.610  -9.689
   17   3HG1  VAL   2          HG13      VAL   2  12.645  -5.440 -11.244
   18   1HG2  VAL   2          HG21      VAL   2  10.582  -3.029 -13.102
   19   2HG2  VAL   2          HG22      VAL   2   9.948  -4.504 -12.365
   20   3HG2  VAL   2          HG23      VAL   2  11.499  -4.533 -13.208
   21    HA   PRO   3           HA       PRO   3  12.075  -1.814  -6.581
   22   1HB   PRO   3          HB2       PRO   3  10.059  -2.795  -4.866
   23   2HB   PRO   3          HB1       PRO   3  10.314  -1.117  -5.344
   24   1HG   PRO   3          HG2       PRO   3   8.113  -2.713  -6.026
   25   2HG   PRO   3          HG1       PRO   3   8.551  -1.162  -6.759
   26   1HD   PRO   3          HD2       PRO   3   9.034  -3.933  -7.748
   27   2HD   PRO   3          HD1       PRO   3   8.716  -2.443  -8.665
   28    H    LYS   4           HN       LYS   4  12.085  -3.301  -4.285
   29    HA   LYS   4           HA       LYS   4  13.368  -5.685  -5.277
   30   1HB   LYS   4          HB2       LYS   4  13.271  -4.618  -2.468
   31   2HB   LYS   4          HB1       LYS   4  14.274  -5.954  -3.028
   32   1HG   LYS   4          HG2       LYS   4  14.454  -3.079  -3.914
   33   2HG   LYS   4          HG1       LYS   4  15.602  -3.945  -2.891
   34   1HD   LYS   4          HD2       LYS   4  16.515  -5.078  -4.641
   35   2HD   LYS   4          HD1       LYS   4  15.001  -5.128  -5.543
   36   1HE   LYS   4          HE2       LYS   4  16.667  -3.720  -6.652
   37   2HE   LYS   4          HE1       LYS   4  15.261  -2.787  -6.147
   38   1HZ   LYS   4          HZ1       LYS   4  17.880  -2.903  -4.749
   39   2HZ   LYS   4          HZ2       LYS   4  16.523  -2.036  -4.214
   40   3HZ   LYS   4          HZ3       LYS   4  17.283  -1.599  -5.657
   41    H    GLY   5           HN       GLY   5  11.201  -5.187  -2.543
   42   1HA   GLY   5          HA2       GLY   5   8.976  -6.199  -2.654
   43   2HA   GLY   5          HA1       GLY   5   9.728  -7.557  -3.455
   44    H    LYS   6           HN       LYS   6  11.038  -6.006  -0.660
   45    HA   LYS   6           HA       LYS   6  11.172  -8.338   0.866
   46   1HB   LYS   6          HB2       LYS   6  12.621  -6.336   1.154
   47   2HB   LYS   6          HB1       LYS   6  11.232  -5.462   1.795
   48   1HG   LYS   6          HG2       LYS   6  12.740  -6.325   3.538
   49   2HG   LYS   6          HG1       LYS   6  11.091  -6.942   3.647
   50   1HD   LYS   6          HD2       LYS   6  12.533  -8.794   4.013
   51   2HD   LYS   6          HD1       LYS   6  11.859  -8.962   2.390
   52   1HE   LYS   6          HE2       LYS   6  14.206  -9.495   2.332
   53   2HE   LYS   6          HE1       LYS   6  13.931  -7.985   1.466
   54   1HZ   LYS   6          HZ1       LYS   6  14.774  -6.753   3.303
   55   2HZ   LYS   6          HZ2       LYS   6  15.895  -7.977   2.956
   56   3HZ   LYS   6          HZ3       LYS   6  14.853  -8.133   4.285
   57    H    TYR   7           HN       TYR   7   9.008  -5.526   1.146
   58    HA   TYR   7           HA       TYR   7   7.042  -7.231   2.414
   59   1HB   TYR   7          HB2       TYR   7   6.946  -4.234   2.112
   60   2HB   TYR   7          HB1       TYR   7   6.104  -5.242   3.291
   61    HD1  TYR   7           HD1      TYR   7   8.349  -6.996   4.070
   62    HD2  TYR   7           HD2      TYR   7   8.171  -2.808   3.476
   63    HE1  TYR   7           HE1      TYR   7  10.182  -6.730   5.607
   64    HE2  TYR   7           HE2      TYR   7  10.044  -2.495   5.006
   65    HH   TYR   7           HH       TYR   7  11.929  -5.172   6.158
   66    HA   PRO   8           HA       PRO   8   5.206  -7.081  -1.927
   67   1HB   PRO   8          HB2       PRO   8   4.018  -9.420  -0.466
   68   2HB   PRO   8          HB1       PRO   8   4.448  -9.271  -2.180
   69   1HG   PRO   8          HG2       PRO   8   6.034 -10.618  -0.573
   70   2HG   PRO   8          HG1       PRO   8   6.744  -9.473  -1.732
   71   1HD   PRO   8          HD2       PRO   8   6.300  -9.163   1.212
   72   2HD   PRO   8          HD1       PRO   8   7.682  -8.649   0.220
   73    H    ILE   9           HN       ILE   9   3.926  -5.282  -1.603
   74    HA   ILE   9           HA       ILE   9   2.028  -5.259   0.566
   75    HB   ILE   9           HB       ILE   9   2.845  -3.179   0.640
   76   1HG1  ILE   9          HG12      ILE   9   0.936  -2.816  -1.686
   77   2HG1  ILE   9          HG11      ILE   9   0.533  -2.740   0.027
   78   1HG2  ILE   9          HG21      ILE   9   4.575  -3.586  -0.989
   79   2HG2  ILE   9          HG22      ILE   9   3.872  -1.990  -1.260
   80   3HG2  ILE   9          HG23      ILE   9   3.438  -3.337  -2.315
   81   1HD1  ILE   9          HD11      ILE   9   0.680  -0.526  -0.940
   82   2HD1  ILE   9          HD12      ILE   9   2.335  -0.848  -1.457
   83   3HD1  ILE   9          HD13      ILE   9   1.949  -0.766   0.263
   84    H    SER  10           HN       SER  10  -0.074  -5.603   0.421
   85    HA   SER  10           HA       SER  10  -1.292  -5.934  -2.205
   86   1HB   SER  10          HB2       SER  10  -3.165  -6.908  -1.087
   87   2HB   SER  10          HB1       SER  10  -1.720  -7.579  -0.326
   88    HG   SER  10           HG       SER  10  -3.703  -6.039   0.740
   89    H    VAL  11           HN       VAL  11  -2.741  -4.564  -3.049
   90    HA   VAL  11           HA       VAL  11  -3.337  -2.166  -1.460
   91    HB   VAL  11           HB       VAL  11  -3.169  -2.266  -4.467
   92   1HG1  VAL  11          HG11      VAL  11  -3.052   0.029  -2.509
   93   2HG1  VAL  11          HG12      VAL  11  -4.430  -0.394  -3.526
   94   3HG1  VAL  11          HG13      VAL  11  -2.926   0.155  -4.264
   95   1HG2  VAL  11          HG21      VAL  11  -1.011  -2.823  -3.951
   96   2HG2  VAL  11          HG22      VAL  11  -1.057  -2.004  -2.384
   97   3HG2  VAL  11          HG23      VAL  11  -0.907  -1.058  -3.878
   98    H    CYS  12           HN       CYS  12  -5.403  -1.797  -1.050
   99    HA   CYS  12           HA       CYS  12  -7.316  -3.743  -1.739
  100   1HB   CYS  12          HB2       CYS  12  -7.501  -2.670   0.382
  101   2HB   CYS  12          HB1       CYS  12  -7.567  -1.074  -0.365
  102    H    MET  13           HN       MET  13  -8.242  -3.935  -3.621
  103    HA   MET  13           HA       MET  13  -9.791  -1.606  -4.526
  104   1HB   MET  13          HB2       MET  13  -8.684  -3.903  -6.153
  105   2HB   MET  13          HB1       MET  13  -9.988  -2.877  -6.734
  106   1HG   MET  13          HG2       MET  13  -7.247  -1.914  -5.957
  107   2HG   MET  13          HG1       MET  13  -7.784  -2.236  -7.604
  108   1HE   MET  13          HE1       MET  13  -6.537   0.574  -6.627
  109   2HE   MET  13          HE2       MET  13  -7.596   1.666  -7.516
  110   3HE   MET  13          HE3       MET  13  -7.016   0.188  -8.282
  111    H    GLY  14           HN       GLY  14 -10.172  -3.589  -2.401
  112   1HA   GLY  14          HA2       GLY  14 -11.806  -5.730  -3.293
  113   2HA   GLY  14          HA1       GLY  14 -11.571  -5.225  -1.631
  114    H    THR  15           HN       THR  15 -13.915  -6.083  -1.987
  115    HA   THR  15           HA       THR  15 -15.802  -4.341  -3.153
  116    HB   THR  15           HB       THR  15 -16.344  -6.659  -2.926
  117    HG1  THR  15           HG1      THR  15 -18.088  -5.155  -2.729
  118   1HG2  THR  15          HG21      THR  15 -16.176  -6.281   0.069
  119   2HG2  THR  15          HG22      THR  15 -15.029  -7.179  -0.926
  120   3HG2  THR  15          HG23      THR  15 -16.689  -7.752  -0.763
  121    H    ALA  16           HN       ALA  16 -14.642  -4.707   0.184
  122    HA   ALA  16           HA       ALA  16 -16.749  -3.137   1.299
  123   1HB   ALA  16          HB1       ALA  16 -15.549  -3.359   3.394
  124   2HB   ALA  16          HB2       ALA  16 -14.135  -3.970   2.538
  125   3HB   ALA  16          HB3       ALA  16 -15.626  -4.909   2.557
  126    H    CYS  17           HN       CYS  17 -13.253  -2.526   0.954
  127    HA   CYS  17           HA       CYS  17 -13.344   0.027   2.151
  128   1HB   CYS  17          HB2       CYS  17 -11.333  -1.156   0.255
  129   2HB   CYS  17          HB1       CYS  17 -11.082   0.277   1.205
  130    H    PHE  18           HN       PHE  18 -13.693  -1.053  -1.150
  131    HA   PHE  18           HA       PHE  18 -12.903   1.246  -2.527
  132   1HB   PHE  18          HB2       PHE  18 -13.173  -1.008  -3.525
  133   2HB   PHE  18          HB1       PHE  18 -14.918  -0.833  -3.403
  134    HD1  PHE  18           HD1      PHE  18 -11.900   0.215  -5.186
  135    HD2  PHE  18           HD2      PHE  18 -16.128   0.622  -4.896
  136    HE1  PHE  18           HE1      PHE  18 -11.945   1.290  -7.396
  137    HE2  PHE  18           HE2      PHE  18 -16.179   1.693  -7.108
  138    HZ   PHE  18           HZ       PHE  18 -14.072   1.971  -8.389
  139    H    VAL  19           HN       VAL  19 -15.928   0.506  -0.971
  140    HA   VAL  19           HA       VAL  19 -17.575   2.143  -2.616
  141    HB   VAL  19           HB       VAL  19 -18.149   1.241   0.214
  142   1HG1  VAL  19          HG11      VAL  19 -20.496   1.367  -0.482
  143   2HG1  VAL  19          HG12      VAL  19 -19.989   1.970  -2.061
  144   3HG1  VAL  19          HG13      VAL  19 -19.692   2.930  -0.612
  145   1HG2  VAL  19          HG21      VAL  19 -17.510  -0.683  -1.113
  146   2HG2  VAL  19          HG22      VAL  19 -18.643  -0.212  -2.380
  147   3HG2  VAL  19          HG23      VAL  19 -19.247  -0.710  -0.799
  148    H    LYS  20           HN       LYS  20 -15.526   2.779   0.086
  149    HA   LYS  20           HA       LYS  20 -16.912   5.205   0.876
  150   1HB   LYS  20          HB2       LYS  20 -14.235   4.173   1.822
  151   2HB   LYS  20          HB1       LYS  20 -15.278   5.334   2.634
  152   1HG   LYS  20          HG2       LYS  20 -15.995   2.451   2.131
  153   2HG   LYS  20          HG1       LYS  20 -15.342   3.080   3.645
  154   1HD   LYS  20          HD2       LYS  20 -17.844   4.179   2.393
  155   2HD   LYS  20          HD1       LYS  20 -17.870   2.802   3.497
  156   1HE   LYS  20          HE2       LYS  20 -16.681   5.496   4.150
  157   2HE   LYS  20          HE1       LYS  20 -18.311   4.993   4.600
  158   1HZ   LYS  20          HZ1       LYS  20 -17.336   3.154   5.851
  159   2HZ   LYS  20          HZ2       LYS  20 -16.795   4.655   6.423
  160   3HZ   LYS  20          HZ3       LYS  20 -15.779   3.695   5.464
  161    H    GLY  21           HN       GLY  21 -15.210   4.608  -1.736
  162   1HA   GLY  21          HA2       GLY  21 -14.269   6.098  -3.252
  163   2HA   GLY  21          HA1       GLY  21 -14.261   7.331  -1.993
  164    H    ALA  22           HN       ALA  22 -12.937   4.160  -1.518
  165    HA   ALA  22           HA       ALA  22 -10.527   5.302  -0.505
  166   1HB   ALA  22          HB1       ALA  22  -9.885   3.000  -0.020
  167   2HB   ALA  22          HB2       ALA  22 -11.255   2.415  -0.967
  168   3HB   ALA  22          HB3       ALA  22 -11.533   3.333   0.514
  169    H    ASP  23           HN       ASP  23 -11.539   4.172  -3.552
  170    HA   ASP  23           HA       ASP  23  -9.122   3.130  -4.540
  171   1HB   ASP  23          HB2       ASP  23 -10.113   3.317  -6.741
  172   2HB   ASP  23          HB1       ASP  23 -11.338   2.760  -5.604
  173    H    LYS  24           HN       LYS  24 -10.440   6.454  -4.518
  174    HA   LYS  24           HA       LYS  24  -8.323   7.484  -6.129
  175   1HB   LYS  24          HB2       LYS  24  -9.915   9.008  -4.067
  176   2HB   LYS  24          HB1       LYS  24  -9.110   9.655  -5.492
  177   1HG   LYS  24          HG2       LYS  24 -10.669   8.358  -6.908
  178   2HG   LYS  24          HG1       LYS  24 -11.515   7.849  -5.445
  179   1HD   LYS  24          HD2       LYS  24 -12.682   9.693  -6.416
  180   2HD   LYS  24          HD1       LYS  24 -11.927  10.234  -4.919
  181   1HE   LYS  24          HE2       LYS  24 -10.101  11.237  -6.172
  182   2HE   LYS  24          HE1       LYS  24 -10.788  10.649  -7.683
  183   1HZ   LYS  24          HZ1       LYS  24 -12.038  12.635  -5.855
  184   2HZ   LYS  24          HZ2       LYS  24 -12.725  12.052  -7.294
  185   3HZ   LYS  24          HZ3       LYS  24 -11.302  12.969  -7.347
  186    H    VAL  25           HN       VAL  25  -8.726   6.969  -2.700
  187    HA   VAL  25           HA       VAL  25  -6.368   8.410  -2.050
  188    HB   VAL  25           HB       VAL  25  -7.494   6.311  -0.248
  189   1HG1  VAL  25          HG11      VAL  25  -6.734   7.888   1.466
  190   2HG1  VAL  25          HG12      VAL  25  -6.214   9.007   0.206
  191   3HG1  VAL  25          HG13      VAL  25  -5.423   7.441   0.377
  192   1HG2  VAL  25          HG21      VAL  25  -9.415   7.595  -1.082
  193   2HG2  VAL  25          HG22      VAL  25  -8.600   9.097  -0.644
  194   3HG2  VAL  25          HG23      VAL  25  -9.089   7.960   0.612
  195    H    VAL  26           HN       VAL  26  -6.988   5.032  -2.945
  196    HA   VAL  26           HA       VAL  26  -4.418   4.120  -2.166
  197    HB   VAL  26           HB       VAL  26  -4.643   2.259  -3.586
  198   1HG1  VAL  26          HG11      VAL  26  -7.426   3.064  -2.765
  199   2HG1  VAL  26          HG12      VAL  26  -6.233   2.222  -1.775
  200   3HG1  VAL  26          HG13      VAL  26  -6.917   1.431  -3.196
  201   1HG2  VAL  26          HG21      VAL  26  -5.044   3.305  -5.697
  202   2HG2  VAL  26          HG22      VAL  26  -6.653   3.819  -5.188
  203   3HG2  VAL  26          HG23      VAL  26  -6.306   2.101  -5.415
  204    H    HIS  27           HN       HIS  27  -5.660   5.824  -5.026
  205    HA   HIS  27           HA       HIS  27  -3.251   5.981  -6.453
  206   1HB   HIS  27          HB2       HIS  27  -5.506   6.672  -7.339
  207   2HB   HIS  27          HB1       HIS  27  -5.361   8.136  -6.364
  208    HD1  HIS  27           HD1      HIS  27  -3.697   9.944  -7.161
  209    HD2  HIS  27           HD2      HIS  27  -3.868   6.599  -9.635
  210    HE1  HIS  27           HE1      HIS  27  -2.433  10.565  -9.231
  211    HE2  HIS  27           HE2      HIS  27  -2.633   8.577 -10.765
  212    H    ALA  28           HN       ALA  28  -4.572   7.930  -3.892
  213    HA   ALA  28           HA       ALA  28  -2.645   9.938  -3.754
  214   1HB   ALA  28          HB1       ALA  28  -4.026   8.633  -1.404
  215   2HB   ALA  28          HB2       ALA  28  -4.698   9.937  -2.385
  216   3HB   ALA  28          HB3       ALA  28  -3.251  10.218  -1.415
  217    H    PHE  29           HN       PHE  29  -2.676   6.711  -2.256
  218    HA   PHE  29           HA       PHE  29  -0.188   6.617  -1.035
  219   1HB   PHE  29          HB2       PHE  29  -1.601   4.675  -0.962
  220   2HB   PHE  29          HB1       PHE  29  -1.579   4.515  -2.707
  221    HD1  PHE  29           HD1      PHE  29   1.198   5.196  -0.379
  222    HD2  PHE  29           HD2      PHE  29  -0.551   2.464  -3.124
  223    HE1  PHE  29           HE1      PHE  29   3.212   3.838  -0.287
  224    HE2  PHE  29           HE2      PHE  29   1.478   1.069  -3.030
  225    HZ   PHE  29           HZ       PHE  29   3.373   1.759  -1.611
  226    H    LYS  30           HN       LYS  30  -0.926   5.657  -4.321
  227    HA   LYS  30           HA       LYS  30   1.600   5.128  -5.209
  228   1HB   LYS  30          HB2       LYS  30  -0.607   6.423  -6.786
  229   2HB   LYS  30          HB1       LYS  30   0.830   5.701  -7.498
  230   1HG   LYS  30          HG2       LYS  30   0.195   3.540  -6.461
  231   2HG   LYS  30          HG1       LYS  30  -1.300   4.292  -5.905
  232   1HD   LYS  30          HD2       LYS  30  -1.962   4.730  -8.196
  233   2HD   LYS  30          HD1       LYS  30  -0.434   4.072  -8.785
  234   1HE   LYS  30          HE2       LYS  30  -1.025   1.893  -7.790
  235   2HE   LYS  30          HE1       LYS  30  -2.573   2.567  -7.284
  236   1HZ   LYS  30          HZ1       LYS  30  -2.811   1.332  -9.328
  237   2HZ   LYS  30          HZ2       LYS  30  -1.627   2.283 -10.086
  238   3HZ   LYS  30          HZ3       LYS  30  -3.103   2.979  -9.617
  239    H    GLU  31           HN       GLU  31   0.107   8.276  -5.120
  240    HA   GLU  31           HA       GLU  31   2.402   9.576  -6.287
  241   1HB   GLU  31          HB2       GLU  31  -0.045  10.760  -4.984
  242   2HB   GLU  31          HB1       GLU  31   1.164  11.665  -5.882
  243   1HG   GLU  31          HG2       GLU  31  -0.568   9.487  -7.020
  244   2HG   GLU  31          HG1       GLU  31  -0.849  11.218  -7.200
  245    H    GLN  32           HN       GLN  32   1.035   9.363  -3.062
  246    HA   GLN  32           HA       GLN  32   2.926  11.020  -1.848
  247   1HB   GLN  32          HB2       GLN  32   2.119  10.245   0.192
  248   2HB   GLN  32          HB1       GLN  32   0.732  10.284  -0.854
  249   1HG   GLN  32          HG2       GLN  32   0.333   8.201  -0.272
  250   2HG   GLN  32          HG1       GLN  32   1.783   7.779  -1.185
  251   1HE2  GLN  32          HE21      GLN  32   1.861   9.689   1.717
  252   2HE2  GLN  32          HE22      GLN  32   2.641   8.503   2.685
  253    H    LEU  33           HN       LEU  33   2.983   7.737  -2.950
  254    HA   LEU  33           HA       LEU  33   5.297   6.884  -1.575
  255   1HB   LEU  33          HB2       LEU  33   4.136   5.156  -2.662
  256   2HB   LEU  33          HB1       LEU  33   4.012   6.070  -4.162
  257    HG   LEU  33           HG       LEU  33   6.388   5.797  -4.556
  258   1HD1  LEU  33          HD11      LEU  33   7.791   4.461  -3.135
  259   2HD1  LEU  33          HD12      LEU  33   6.436   4.175  -2.036
  260   3HD1  LEU  33          HD13      LEU  33   7.096   5.799  -2.216
  261   1HD2  LEU  33          HD21      LEU  33   5.037   4.083  -5.460
  262   2HD2  LEU  33          HD22      LEU  33   4.973   3.249  -3.903
  263   3HD2  LEU  33          HD23      LEU  33   6.504   3.356  -4.785
  264    H    LYS  34           HN       LYS  34   4.808   8.264  -4.788
  265    HA   LYS  34           HA       LYS  34   6.073   9.557  -6.140
  266   1HB   LYS  34          HB2       LYS  34   7.287  11.239  -5.221
  267   2HB   LYS  34          HB1       LYS  34   6.560  10.655  -3.735
  268   1HG   LYS  34          HG2       LYS  34   8.921   9.135  -4.166
  269   2HG   LYS  34          HG1       LYS  34   9.331  10.832  -4.428
  270   1HD   LYS  34          HD2       LYS  34   8.745  11.432  -2.244
  271   2HD   LYS  34          HD1       LYS  34   7.772   9.980  -2.008
  272   1HE   LYS  34          HE2       LYS  34   9.775   9.736  -0.728
  273   2HE   LYS  34          HE1       LYS  34   9.889   8.623  -2.098
  274   1HZ   LYS  34          HZ1       LYS  34  11.164  10.568  -3.194
  275   2HZ   LYS  34          HZ2       LYS  34  11.965   9.637  -2.027
  276   3HZ   LYS  34          HZ3       LYS  34  11.343  11.160  -1.613
  277    H    ILE  35           HN       ILE  35   7.169   7.035  -4.429
  278    HA   ILE  35           HA       ILE  35   8.384   5.257  -4.751
  279    HB   ILE  35           HB       ILE  35   9.105   5.657  -7.511
  280   1HG1  ILE  35          HG12      ILE  35   6.215   5.846  -6.642
  281   2HG1  ILE  35          HG11      ILE  35   7.119   6.931  -7.690
  282   1HG2  ILE  35          HG21      ILE  35   7.917   3.432  -7.585
  283   2HG2  ILE  35          HG22      ILE  35   7.585   3.661  -5.857
  284   3HG2  ILE  35          HG23      ILE  35   9.254   3.537  -6.435
  285   1HD1  ILE  35          HD11      ILE  35   5.562   5.593  -8.974
  286   2HD1  ILE  35          HD12      ILE  35   6.312   4.117  -8.367
  287   3HD1  ILE  35          HD13      ILE  35   7.227   5.205  -9.411
  288    H    ASP  36           HN       ASP  36   9.702   8.212  -5.315
  289    HA   ASP  36           HA       ASP  36  11.688   9.109  -4.737
  290   1HB   ASP  36          HB2       ASP  36  11.519   7.353  -2.955
  291   2HB   ASP  36          HB1       ASP  36  12.469   6.300  -3.984
  292    H    ILE  37           HN       ILE  37  12.384   5.888  -5.888
  293    HA   ILE  37           HA       ILE  37  13.367   6.682  -8.457
  294    HB   ILE  37           HB       ILE  37  15.568   5.552  -8.061
  295   1HG1  ILE  37          HG12      ILE  37  14.534   5.808  -5.295
  296   2HG1  ILE  37          HG11      ILE  37  15.196   4.388  -6.095
  297   1HG2  ILE  37          HG21      ILE  37  16.712   7.516  -7.135
  298   2HG2  ILE  37          HG22      ILE  37  15.153   8.162  -6.631
  299   3HG2  ILE  37          HG23      ILE  37  15.510   7.963  -8.345
  300   1HD1  ILE  37          HD11      ILE  37  16.777   6.780  -5.160
  301   2HD1  ILE  37          HD12      ILE  37  17.436   5.377  -6.002
  302   3HD1  ILE  37          HD13      ILE  37  16.728   5.188  -4.398
  303    H    GLY  38           HN       GLY  38  11.685   4.606  -6.670
  304   1HA   GLY  38          HA2       GLY  38  12.127   2.232  -8.136
  305   2HA   GLY  38          HA1       GLY  38  13.147   2.216  -6.691
  306    H    ASP  39           HN       ASP  39  11.168   3.684  -5.098
  307    HA   ASP  39           HA       ASP  39   9.407   1.541  -4.351
  308   1HB   ASP  39          HB2       ASP  39  11.501   0.486  -4.123
  309   2HB   ASP  39          HB1       ASP  39  12.170   1.865  -3.286
  310    H    VAL  40           HN       VAL  40   9.028   1.641  -2.046
  311    HA   VAL  40           HA       VAL  40   7.555   3.528  -0.988
  312    HB   VAL  40           HB       VAL  40   9.665   1.793   0.095
  313   1HG1  VAL  40          HG11      VAL  40   9.335   2.508   2.383
  314   2HG1  VAL  40          HG12      VAL  40   8.279   3.815   1.842
  315   3HG1  VAL  40          HG13      VAL  40   9.991   3.824   1.410
  316   1HG2  VAL  40          HG21      VAL  40   7.533   0.931  -0.337
  317   2HG2  VAL  40          HG22      VAL  40   6.762   2.191   0.629
  318   3HG2  VAL  40          HG23      VAL  40   7.776   0.969   1.406
  319    H    THR  41           HN       THR  41  10.901   3.560  -0.957
  320    HA   THR  41           HA       THR  41  11.445   6.226  -1.186
  321    HB   THR  41           HB       THR  41  12.025   5.410   1.658
  322    HG1  THR  41           HG1      THR  41   9.633   6.262   0.660
  323   1HG2  THR  41          HG21      THR  41  13.420   7.168   0.643
  324   2HG2  THR  41          HG22      THR  41  12.436   7.791   1.969
  325   3HG2  THR  41          HG23      THR  41  11.967   8.109   0.297
  326    HA   PRO  42           HA       PRO  42  15.329   4.027  -0.086
  327   1HB   PRO  42          HB2       PRO  42  14.970   1.360   0.924
  328   2HB   PRO  42          HB1       PRO  42  15.643   2.769   1.743
  329   1HG   PRO  42          HG2       PRO  42  13.232   1.625   2.373
  330   2HG   PRO  42          HG1       PRO  42  13.650   3.318   2.699
  331   1HD   PRO  42          HD2       PRO  42  12.042   2.162   0.460
  332   2HD   PRO  42          HD1       PRO  42  11.773   3.649   1.392
  333    H    ASP  43           HN       ASP  43  13.039   2.363  -2.081
  334    HA   ASP  43           HA       ASP  43  13.481   1.584  -4.184
  335   1HB   ASP  43          HB2       ASP  43  15.488   2.972  -4.415
  336   2HB   ASP  43          HB1       ASP  43  16.419   1.835  -3.451
  337    H    GLY  44           HN       GLY  44  13.415   0.335  -1.432
  338   1HA   GLY  44          HA2       GLY  44  13.184  -2.249  -2.399
  339   2HA   GLY  44          HA1       GLY  44  14.729  -2.166  -1.549
  340    H    ARG  45           HN       ARG  45  11.320  -1.487  -1.279
  341    HA   ARG  45           HA       ARG  45  11.310  -2.416   1.502
  342   1HB   ARG  45          HB2       ARG  45  11.539   0.096   1.187
  343   2HB   ARG  45          HB1       ARG  45   9.938   0.083   0.480
  344   1HG   ARG  45          HG2       ARG  45   9.652   0.729   2.724
  345   2HG   ARG  45          HG1       ARG  45   9.178  -0.974   2.687
  346   1HD   ARG  45          HD2       ARG  45  11.142  -1.671   3.731
  347   2HD   ARG  45          HD1       ARG  45  11.996  -0.182   3.328
  348    HE   ARG  45           HE       ARG  45   9.777   0.304   5.054
  349   1HH1  ARG  45          HH11      ARG  45  13.112  -0.807   5.011
  350   2HH1  ARG  45          HH12      ARG  45  13.418  -0.301   6.645
  351   1HH2  ARG  45          HH21      ARG  45  10.191   0.956   7.182
  352   2HH2  ARG  45          HH22      ARG  45  11.761   0.681   7.878
  353    H    PHE  46           HN       PHE  46   9.277  -1.045  -1.031
  354    HA   PHE  46           HA       PHE  46   7.091  -2.852  -0.330
  355   1HB   PHE  46          HB2       PHE  46   5.728  -1.094  -0.776
  356   2HB   PHE  46          HB1       PHE  46   7.186  -0.156  -0.519
  357    HD1  PHE  46           HD1      PHE  46   8.675  -0.121  -2.786
  358    HD2  PHE  46           HD2      PHE  46   4.433  -0.290  -2.538
  359    HE1  PHE  46           HE1      PHE  46   8.488   0.855  -5.054
  360    HE2  PHE  46           HE2      PHE  46   4.245   0.639  -4.794
  361    HZ   PHE  46           HZ       PHE  46   6.274   1.216  -6.059
  362    H    SER  47           HN       SER  47   5.900  -3.908  -1.974
  363    HA   SER  47           HA       SER  47   6.326  -3.451  -4.765
  364   1HB   SER  47          HB2       SER  47   7.209  -6.112  -3.592
  365   2HB   SER  47          HB1       SER  47   6.821  -5.887  -5.298
  366    HG   SER  47           HG       SER  47   8.615  -4.072  -4.197
  367    H    ILE  48           HN       ILE  48   4.320  -3.543  -5.565
  368    HA   ILE  48           HA       ILE  48   2.327  -4.406  -3.616
  369    HB   ILE  48           HB       ILE  48   0.769  -3.009  -4.849
  370   1HG1  ILE  48          HG12      ILE  48   3.083  -2.272  -6.635
  371   2HG1  ILE  48          HG11      ILE  48   1.866  -3.466  -7.081
  372   1HG2  ILE  48          HG21      ILE  48   2.111  -1.966  -3.118
  373   2HG2  ILE  48          HG22      ILE  48   1.837  -0.833  -4.444
  374   3HG2  ILE  48          HG23      ILE  48   3.396  -1.645  -4.283
  375   1HD1  ILE  48          HD11      ILE  48   1.359  -1.330  -8.048
  376   2HD1  ILE  48          HD12      ILE  48   1.384  -0.581  -6.453
  377   3HD1  ILE  48          HD13      ILE  48   0.143  -1.773  -6.849
  378    H    ASP  49           HN       ASP  49   0.521  -5.602  -4.078
  379    HA   ASP  49           HA       ASP  49  -0.256  -6.034  -6.807
  380   1HB   ASP  49          HB2       ASP  49  -0.270  -8.437  -6.841
  381   2HB   ASP  49          HB1       ASP  49   1.356  -7.911  -6.423
  382    H    THR  50           HN       THR  50  -2.366  -6.012  -6.937
  383    HA   THR  50           HA       THR  50  -4.333  -6.006  -5.082
  384    HB   THR  50           HB       THR  50  -5.833  -6.964  -6.835
  385    HG1  THR  50           HG1      THR  50  -4.683  -8.274  -8.094
  386   1HG2  THR  50          HG21      THR  50  -5.508  -5.088  -8.408
  387   2HG2  THR  50          HG22      THR  50  -3.942  -4.761  -7.662
  388   3HG2  THR  50          HG23      THR  50  -5.423  -4.574  -6.721
  389    H    LEU  51           HN       LEU  51  -2.665  -8.868  -6.222
  390    HA   LEU  51           HA       LEU  51  -4.683 -10.733  -6.106
  391   1HB   LEU  51          HB2       LEU  51  -1.720 -11.120  -5.775
  392   2HB   LEU  51          HB1       LEU  51  -2.853 -12.440  -5.964
  393    HG   LEU  51           HG       LEU  51  -1.886 -12.101  -8.087
  394   1HD1  LEU  51          HD11      LEU  51  -4.289 -12.444  -8.158
  395   2HD1  LEU  51          HD12      LEU  51  -3.756 -11.415  -9.489
  396   3HD1  LEU  51          HD13      LEU  51  -4.549 -10.701  -8.086
  397   1HD2  LEU  51          HD21      LEU  51  -1.794  -9.949  -9.229
  398   2HD2  LEU  51          HD22      LEU  51  -0.914  -9.899  -7.701
  399   3HD2  LEU  51          HD23      LEU  51  -2.513  -9.165  -7.821
  400    H    ARG  52           HN       ARG  52  -2.646  -9.687  -3.456
  401    HA   ARG  52           HA       ARG  52  -3.159 -11.693  -1.607
  402   1HB   ARG  52          HB2       ARG  52  -2.968  -8.742  -1.025
  403   2HB   ARG  52          HB1       ARG  52  -2.723 -10.045   0.129
  404   1HG   ARG  52          HG2       ARG  52  -1.025  -9.540  -2.305
  405   2HG   ARG  52          HG1       ARG  52  -0.621  -9.057  -0.657
  406   1HD   ARG  52          HD2       ARG  52  -0.599 -11.380   0.042
  407   2HD   ARG  52          HD1       ARG  52  -1.087 -11.893  -1.572
  408    HE   ARG  52           HE       ARG  52   1.121 -10.722  -2.242
  409   1HH1  ARG  52          HH11      ARG  52   0.578 -12.489   0.724
  410   2HH1  ARG  52          HH12      ARG  52   2.220 -13.034   0.865
  411   1HH2  ARG  52          HH21      ARG  52   3.286 -11.437  -2.089
  412   2HH2  ARG  52          HH22      ARG  52   3.777 -12.410  -0.727
  413    H    CYS  53           HN       CYS  53  -5.085  -8.836  -2.355
  414    HA   CYS  53           HA       CYS  53  -7.040  -9.084  -0.379
  415   1HB   CYS  53          HB2       CYS  53  -6.715  -7.036  -1.671
  416   2HB   CYS  53          HB1       CYS  53  -7.303  -7.852  -3.119
  417    H    VAL  54           HN       VAL  54  -9.402  -9.465  -0.818
  418    HA   VAL  54           HA       VAL  54 -10.918 -11.120  -0.717
  419    HB   VAL  54           HB       VAL  54 -10.556 -11.006  -3.331
  420   1HG1  VAL  54          HG11      VAL  54  -9.521 -13.770  -2.732
  421   2HG1  VAL  54          HG12      VAL  54  -8.621 -12.456  -3.490
  422   3HG1  VAL  54          HG13      VAL  54  -9.997 -13.178  -4.323
  423   1HG2  VAL  54          HG21      VAL  54 -12.244 -12.798  -3.592
  424   2HG2  VAL  54          HG22      VAL  54 -12.615 -11.651  -2.307
  425   3HG2  VAL  54          HG23      VAL  54 -11.973 -13.244  -1.906
  426    H    GLY  55           HN       GLY  55  -8.261 -11.185   0.353
  427   1HA   GLY  55          HA2       GLY  55  -7.948 -14.051   0.900
  428   2HA   GLY  55          HA1       GLY  55  -6.637 -12.880   0.953
  429    H    GLY  56           HN       GLY  56  -9.868 -13.439   2.479
  430   1HA   GLY  56          HA2       GLY  56 -10.415 -13.357   4.713
  431   2HA   GLY  56          HA1       GLY  56  -8.706 -13.513   5.057
  432    H    CYS  57           HN       CYS  57 -10.905 -10.923   3.784
  433    HA   CYS  57           HA       CYS  57  -9.437  -9.044   5.557
  434   1HB   CYS  57          HB2       CYS  57 -10.547  -8.235   2.912
  435   2HB   CYS  57          HB1       CYS  57  -9.420  -7.385   3.910
  436    H    ALA  58           HN       ALA  58 -12.562  -9.835   3.992
  437    HA   ALA  58           HA       ALA  58 -13.274  -7.268   3.374
  438   1HB   ALA  58          HB1       ALA  58 -15.175  -9.489   4.039
  439   2HB   ALA  58          HB2       ALA  58 -14.347  -9.263   2.498
  440   3HB   ALA  58          HB3       ALA  58 -15.514  -8.064   3.057
  441    H    LEU  59           HN       LEU  59 -13.981  -8.758   6.610
  442    HA   LEU  59           HA       LEU  59 -15.605  -6.460   7.272
  443   1HB   LEU  59          HB2       LEU  59 -14.448  -8.625   9.021
  444   2HB   LEU  59          HB1       LEU  59 -15.538  -7.374   9.586
  445    HG   LEU  59           HG       LEU  59 -16.204  -9.462   7.508
  446   1HD1  LEU  59          HD11      LEU  59 -15.994 -10.420   9.733
  447   2HD1  LEU  59          HD12      LEU  59 -17.685 -10.378   9.227
  448   3HD1  LEU  59          HD13      LEU  59 -17.078  -9.188  10.379
  449   1HD2  LEU  59          HD21      LEU  59 -17.919  -7.342   8.802
  450   2HD2  LEU  59          HD22      LEU  59 -18.498  -8.619   7.733
  451   3HD2  LEU  59          HD23      LEU  59 -17.404  -7.383   7.113
  452    H    ALA  60           HN       ALA  60 -12.344  -6.709   6.913
  453    HA   ALA  60           HA       ALA  60 -11.949  -4.310   8.581
  454   1HB   ALA  60          HB1       ALA  60  -9.877  -6.363   7.797
  455   2HB   ALA  60          HB2       ALA  60 -10.579  -6.166   9.404
  456   3HB   ALA  60          HB3       ALA  60  -9.574  -4.889   8.715
  457    HA   PRO  61           HA       PRO  61 -10.258  -2.743   4.598
  458   1HB   PRO  61          HB2       PRO  61  -8.754  -0.686   5.506
  459   2HB   PRO  61          HB1       PRO  61 -10.506  -0.557   5.322
  460   1HG   PRO  61          HG2       PRO  61  -8.883  -0.955   7.790
  461   2HG   PRO  61          HG1       PRO  61 -10.371  -0.023   7.561
  462   1HD   PRO  61          HD2       PRO  61 -10.236  -2.559   8.678
  463   2HD   PRO  61          HD1       PRO  61 -11.693  -1.834   7.974
  464    H    ILE  62           HN       ILE  62  -8.571  -3.898   3.705
  465    HA   ILE  62           HA       ILE  62  -6.240  -4.382   5.429
  466    HB   ILE  62           HB       ILE  62  -7.568  -6.067   3.403
  467   1HG1  ILE  62          HG12      ILE  62  -6.725  -7.852   4.897
  468   2HG1  ILE  62          HG11      ILE  62  -5.868  -6.640   5.839
  469   1HG2  ILE  62          HG21      ILE  62  -5.537  -7.330   2.866
  470   2HG2  ILE  62          HG22      ILE  62  -4.565  -6.117   3.698
  471   3HG2  ILE  62          HG23      ILE  62  -5.464  -5.681   2.245
  472   1HD1  ILE  62          HD11      ILE  62  -8.847  -6.876   5.513
  473   2HD1  ILE  62          HD12      ILE  62  -8.016  -5.606   6.410
  474   3HD1  ILE  62          HD13      ILE  62  -7.903  -7.283   6.947
  475    H    VAL  63           HN       VAL  63  -4.315  -3.423   4.975
  476    HA   VAL  63           HA       VAL  63  -3.643  -3.404   2.136
  477    HB   VAL  63           HB       VAL  63  -3.299  -1.226   1.960
  478   1HG1  VAL  63          HG11      VAL  63  -4.068  -0.986   4.856
  479   2HG1  VAL  63          HG12      VAL  63  -5.153  -0.924   3.466
  480   3HG1  VAL  63          HG13      VAL  63  -3.958   0.349   3.708
  481   1HG2  VAL  63          HG21      VAL  63  -1.528  -1.381   4.391
  482   2HG2  VAL  63          HG22      VAL  63  -1.605  -0.036   3.253
  483   3HG2  VAL  63          HG23      VAL  63  -1.029  -1.613   2.716
  484    H    MET  64           HN       MET  64  -1.699  -4.438   1.778
  485    HA   MET  64           HA       MET  64  -0.474  -5.369   4.309
  486   1HB   MET  64          HB2       MET  64  -1.685  -7.156   3.171
  487   2HB   MET  64          HB1       MET  64  -0.810  -6.826   1.684
  488   1HG   MET  64          HG2       MET  64   1.277  -7.436   2.829
  489   2HG   MET  64          HG1       MET  64   0.331  -7.884   4.248
  490   1HE   MET  64          HE1       MET  64  -1.812 -10.869   2.941
  491   2HE   MET  64          HE2       MET  64  -2.275  -9.166   2.916
  492   3HE   MET  64          HE3       MET  64  -1.424  -9.827   4.313
  493    H    VAL  65           HN       VAL  65   1.772  -5.095   4.523
  494    HA   VAL  65           HA       VAL  65   3.157  -5.155   1.908
  495    HB   VAL  65           HB       VAL  65   5.170  -4.450   3.514
  496   1HG1  VAL  65          HG11      VAL  65   3.221  -2.536   2.285
  497   2HG1  VAL  65          HG12      VAL  65   4.549  -3.356   1.463
  498   3HG1  VAL  65          HG13      VAL  65   4.889  -2.171   2.725
  499   1HG2  VAL  65          HG21      VAL  65   4.486  -2.742   5.082
  500   2HG2  VAL  65          HG22      VAL  65   3.758  -4.298   5.490
  501   3HG2  VAL  65          HG23      VAL  65   2.792  -3.051   4.698
  502    H    GLY  66           HN       GLY  66   3.946  -7.153   1.601
  503   1HA   GLY  66          HA2       GLY  66   4.644  -9.280   2.053
  504   2HA   GLY  66          HA1       GLY  66   5.719  -8.459   3.198
  505    H    GLU  67           HN       GLU  67   5.602 -10.133   4.539
  506    HA   GLU  67           HA       GLU  67   3.155 -10.855   5.864
  507   1HB   GLU  67          HB2       GLU  67   5.888 -11.293   7.036
  508   2HB   GLU  67          HB1       GLU  67   4.455 -12.297   7.181
  509   1HG   GLU  67          HG2       GLU  67   5.666 -13.577   5.758
  510   2HG   GLU  67          HG1       GLU  67   4.817 -12.576   4.582
  511    H    LYS  68           HN       LYS  68   3.808  -7.978   5.722
  512    HA   LYS  68           HA       LYS  68   4.448  -7.414   8.528
  513   1HB   LYS  68          HB2       LYS  68   4.595  -5.366   6.329
  514   2HB   LYS  68          HB1       LYS  68   5.428  -5.370   7.872
  515   1HG   LYS  68          HG2       LYS  68   6.081  -7.094   5.451
  516   2HG   LYS  68          HG1       LYS  68   7.038  -5.769   6.106
  517   1HD   LYS  68          HD2       LYS  68   7.647  -6.977   8.026
  518   2HD   LYS  68          HD1       LYS  68   6.347  -8.151   7.814
  519   1HE   LYS  68          HE2       LYS  68   7.461  -9.089   5.884
  520   2HE   LYS  68          HE1       LYS  68   8.714  -7.851   5.969
  521   1HZ   LYS  68          HZ1       LYS  68   9.473  -8.736   8.038
  522   2HZ   LYS  68          HZ2       LYS  68   9.387 -10.011   6.924
  523   3HZ   LYS  68          HZ3       LYS  68   8.189  -9.843   8.113
  524    H    VAL  69           HN       VAL  69   2.209  -6.930   5.935
  525    HA   VAL  69           HA       VAL  69   0.146  -5.922   5.755
  526    HB   VAL  69           HB       VAL  69  -0.124  -7.277   8.426
  527   1HG1  VAL  69          HG11      VAL  69  -2.291  -6.309   6.556
  528   2HG1  VAL  69          HG12      VAL  69  -1.921  -5.648   8.150
  529   3HG1  VAL  69          HG13      VAL  69  -2.537  -7.293   8.000
  530   1HG2  VAL  69          HG21      VAL  69   0.534  -8.771   6.639
  531   2HG2  VAL  69          HG22      VAL  69  -0.761  -8.151   5.611
  532   3HG2  VAL  69          HG23      VAL  69  -1.150  -9.066   7.072
  533    H    TYR  70           HN       TYR  70  -0.330  -3.800   5.724
  534    HA   TYR  70           HA       TYR  70  -0.130  -2.251   8.225
  535   1HB   TYR  70          HB2       TYR  70   1.098  -1.560   5.536
  536   2HB   TYR  70          HB1       TYR  70   0.746  -0.333   6.750
  537    HD1  TYR  70           HD1      TYR  70   1.896  -3.728   7.442
  538    HD2  TYR  70           HD2      TYR  70   3.005   0.353   7.252
  539    HE1  TYR  70           HE1      TYR  70   3.983  -4.278   8.484
  540    HE2  TYR  70           HE2      TYR  70   5.116  -0.183   8.336
  541    HH   TYR  70           HH       TYR  70   6.087  -1.910   9.791
  542    H    GLY  71           HN       GLY  71  -0.602   0.237   6.940
  543   1HA   GLY  71          HA2       GLY  71  -3.138   0.052   5.532
  544   2HA   GLY  71          HA1       GLY  71  -3.178   0.828   7.107
  545    H    ASN  72           HN       ASN  72  -0.798   0.969   4.441
  546    HA   ASN  72           HA       ASN  72  -0.690   3.861   4.856
  547   1HB   ASN  72          HB2       ASN  72   1.531   3.232   4.941
  548   2HB   ASN  72          HB1       ASN  72   1.266   1.784   3.980
  549   1HD2  ASN  72          HD21      ASN  72   1.918   5.192   3.884
  550   2HD2  ASN  72          HD22      ASN  72   2.403   5.253   2.219
  551    H    VAL  73           HN       VAL  73  -2.568   2.059   2.908
  552    HA   VAL  73           HA       VAL  73  -1.870   3.609   0.502
  553    HB   VAL  73           HB       VAL  73  -2.235   1.779  -0.889
  554   1HG1  VAL  73          HG11      VAL  73  -0.892   0.906   1.652
  555   2HG1  VAL  73          HG12      VAL  73  -0.142   1.618   0.220
  556   3HG1  VAL  73          HG13      VAL  73  -0.817  -0.010   0.143
  557   1HG2  VAL  73          HG21      VAL  73  -4.324   0.954   0.065
  558   2HG2  VAL  73          HG22      VAL  73  -3.445   0.307   1.453
  559   3HG2  VAL  73          HG23      VAL  73  -3.172  -0.363  -0.157
  560    H    THR  74           HN       THR  74  -4.130   4.074   2.565
  561    HA   THR  74           HA       THR  74  -6.203   4.441   0.586
  562    HB   THR  74           HB       THR  74  -6.138   2.040   1.512
  563    HG1  THR  74           HG1      THR  74  -7.871   2.286   0.336
  564   1HG2  THR  74          HG21      THR  74  -6.058   2.496   3.866
  565   2HG2  THR  74          HG22      THR  74  -7.597   1.707   3.509
  566   3HG2  THR  74          HG23      THR  74  -7.540   3.450   3.782
  567    HA   PRO  75           HA       PRO  75  -8.388   7.846   2.276
  568   1HB   PRO  75          HB2       PRO  75  -9.247   6.370   4.730
  569   2HB   PRO  75          HB1       PRO  75 -10.132   7.558   3.766
  570   1HG   PRO  75          HG2       PRO  75 -10.273   4.778   3.470
  571   2HG   PRO  75          HG1       PRO  75 -10.837   5.982   2.300
  572   1HD   PRO  75          HD2       PRO  75  -8.757   4.146   1.899
  573   2HD   PRO  75          HD1       PRO  75  -9.072   5.589   0.916
  574    H    GLY  76           HN       GLY  76  -6.270   8.807   2.580
  575   1HA   GLY  76          HA2       GLY  76  -5.342  10.545   3.765
  576   2HA   GLY  76          HA1       GLY  76  -6.398  10.144   5.103
  577    H    GLN  77           HN       GLN  77  -5.244   7.317   4.964
  578    HA   GLN  77           HA       GLN  77  -3.571   7.985   7.228
  579   1HB   GLN  77          HB2       GLN  77  -3.638   5.539   7.672
  580   2HB   GLN  77          HB1       GLN  77  -5.241   6.230   7.534
  581   1HG   GLN  77          HG2       GLN  77  -5.156   5.424   5.111
  582   2HG   GLN  77          HG1       GLN  77  -3.792   4.428   5.645
  583   1HE2  GLN  77          HE21      GLN  77  -4.673   2.467   5.689
  584   2HE2  GLN  77          HE22      GLN  77  -6.026   2.030   6.655
  585    H    VAL  78           HN       VAL  78  -3.382   7.332   4.027
  586    HA   VAL  78           HA       VAL  78  -1.224   5.813   3.504
  587    HB   VAL  78           HB       VAL  78  -0.990   7.331   1.534
  588   1HG1  VAL  78          HG11      VAL  78  -3.100   6.749   0.523
  589   2HG1  VAL  78          HG12      VAL  78  -3.750   6.393   2.122
  590   3HG1  VAL  78          HG13      VAL  78  -2.446   5.409   1.461
  591   1HG2  VAL  78          HG21      VAL  78  -2.956   8.915   1.256
  592   2HG2  VAL  78          HG22      VAL  78  -1.577   9.418   2.242
  593   3HG2  VAL  78          HG23      VAL  78  -3.042   8.824   3.028
  594    H    LYS  79           HN       LYS  79  -1.233   9.324   4.111
  595    HA   LYS  79           HA       LYS  79   1.442   9.735   3.411
  596   1HB   LYS  79          HB2       LYS  79  -0.125  11.397   5.390
  597   2HB   LYS  79          HB1       LYS  79   1.166  11.932   4.327
  598   1HG   LYS  79          HG2       LYS  79  -0.221  11.804   2.417
  599   2HG   LYS  79          HG1       LYS  79  -1.470  10.911   3.297
  600   1HD   LYS  79          HD2       LYS  79  -0.620  13.733   3.943
  601   2HD   LYS  79          HD1       LYS  79  -2.015  13.314   2.946
  602   1HE   LYS  79          HE2       LYS  79  -3.094  12.226   4.764
  603   2HE   LYS  79          HE1       LYS  79  -1.638  12.298   5.753
  604   1HZ   LYS  79          HZ1       LYS  79  -3.183  14.665   4.843
  605   2HZ   LYS  79          HZ2       LYS  79  -1.850  14.664   5.893
  606   3HZ   LYS  79          HZ3       LYS  79  -3.309  13.954   6.378
  607    H    LYS  80           HN       LYS  80  -0.177   9.062   6.360
  608    HA   LYS  80           HA       LYS  80   2.022   9.610   8.114
  609   1HB   LYS  80          HB2       LYS  80  -0.488   8.126   8.803
  610   2HB   LYS  80          HB1       LYS  80   0.395   9.311   9.748
  611   1HG   LYS  80          HG2       LYS  80  -0.722  11.012   8.894
  612   2HG   LYS  80          HG1       LYS  80  -0.663  10.386   7.259
  613   1HD   LYS  80          HD2       LYS  80  -2.951  10.596   8.109
  614   2HD   LYS  80          HD1       LYS  80  -2.533   8.930   7.708
  615   1HE   LYS  80          HE2       LYS  80  -3.770   8.996   9.794
  616   2HE   LYS  80          HE1       LYS  80  -2.106   8.513  10.118
  617   1HZ   LYS  80          HZ1       LYS  80  -1.607  10.710  10.893
  618   2HZ   LYS  80          HZ2       LYS  80  -2.991  10.166  11.705
  619   3HZ   LYS  80          HZ3       LYS  80  -3.138  11.281  10.439
  620    H    ILE  81           HN       ILE  81   0.142   6.905   7.066
  621    HA   ILE  81           HA       ILE  81   1.696   4.983   8.489
  622    HB   ILE  81           HB       ILE  81  -0.205   4.537   6.177
  623   1HG1  ILE  81          HG12      ILE  81  -1.320   5.670   8.031
  624   2HG1  ILE  81          HG11      ILE  81  -1.844   3.992   7.972
  625   1HG2  ILE  81          HG21      ILE  81  -0.365   2.242   7.096
  626   2HG2  ILE  81          HG22      ILE  81   0.834   2.650   8.322
  627   3HG2  ILE  81          HG23      ILE  81   1.291   2.620   6.620
  628   1HD1  ILE  81          HD11      ILE  81   0.200   5.137   9.859
  629   2HD1  ILE  81          HD12      ILE  81  -0.334   3.458   9.809
  630   3HD1  ILE  81          HD13      ILE  81  -1.471   4.732  10.253
  631    H    LEU  82           HN       LEU  82   2.206   6.720   5.595
  632    HA   LEU  82           HA       LEU  82   4.072   4.946   4.412
  633   1HB   LEU  82          HB2       LEU  82   3.300   6.957   3.250
  634   2HB   LEU  82          HB1       LEU  82   4.060   7.974   4.465
  635    HG   LEU  82           HG       LEU  82   6.263   6.987   3.807
  636   1HD1  LEU  82          HD11      LEU  82   6.426   5.880   1.639
  637   2HD1  LEU  82          HD12      LEU  82   4.671   5.903   1.488
  638   3HD1  LEU  82          HD13      LEU  82   5.432   4.950   2.760
  639   1HD2  LEU  82          HD21      LEU  82   5.587   9.189   3.037
  640   2HD2  LEU  82          HD22      LEU  82   4.706   8.469   1.689
  641   3HD2  LEU  82          HD23      LEU  82   6.464   8.343   1.761
  642    H    ALA  83           HN       ALA  83   4.334   7.284   7.077
  643    HA   ALA  83           HA       ALA  83   7.085   6.922   7.592
  644   1HB   ALA  83          HB1       ALA  83   4.858   7.377   9.586
  645   2HB   ALA  83          HB2       ALA  83   5.757   8.636   8.739
  646   3HB   ALA  83          HB3       ALA  83   6.579   7.589   9.894
  647    H    GLU  84           HN       GLU  84   4.285   4.972   8.141
  648    HA   GLU  84           HA       GLU  84   5.496   2.985   9.743
  649   1HB   GLU  84          HB2       GLU  84   3.064   3.034   7.998
  650   2HB   GLU  84          HB1       GLU  84   3.555   1.605   8.874
  651   1HG   GLU  84          HG2       GLU  84   2.899   4.267  10.111
  652   2HG   GLU  84          HG1       GLU  84   1.804   2.884  10.026
  653    H    TYR  85           HN       TYR  85   5.165   3.461   6.235
  654    HA   TYR  85           HA       TYR  85   6.180   0.906   5.625
  655   1HB   TYR  85          HB2       TYR  85   5.237   3.287   4.173
  656   2HB   TYR  85          HB1       TYR  85   6.275   2.162   3.323
  657    HD1  TYR  85           HD1      TYR  85   4.524   0.660   5.831
  658    HD2  TYR  85           HD2      TYR  85   4.241   1.953   1.936
  659    HE1  TYR  85           HE1      TYR  85   2.801  -0.953   5.496
  660    HE2  TYR  85           HE2      TYR  85   2.434   0.354   1.574
  661    HH   TYR  85           HH       TYR  85   1.581  -1.755   2.436
  Start of MODEL   10
    1   1H    MET   1          HT1       MET   1   9.534 -12.693   9.998
    2   2H    MET   1          HT2       MET   1   8.967 -13.968   9.040
    3   3H    MET   1          HT3       MET   1   8.681 -12.361   8.569
    4    HA   MET   1           HA       MET   1  11.247 -13.837   8.601
    5   1HB   MET   1          HB2       MET   1   9.867 -14.128   6.610
    6   2HB   MET   1          HB1       MET   1   9.682 -12.387   6.448
    7   1HG   MET   1          HG2       MET   1  12.087 -12.179   6.034
    8   2HG   MET   1          HG1       MET   1  12.254 -13.928   6.181
    9   1HE   MET   1          HE1       MET   1  10.293 -15.237   3.082
   10   2HE   MET   1          HE2       MET   1   9.728 -15.060   4.742
   11   3HE   MET   1          HE3       MET   1  11.352 -15.667   4.427
   12    H    VAL   2           HN       VAL   2  13.152 -12.642   8.322
   13    HA   VAL   2           HA       VAL   2  13.473 -10.324   9.742
   14    HB   VAL   2           HB       VAL   2  15.391 -11.633   9.180
   15   1HG1  VAL   2          HG11      VAL   2  14.668 -12.475   7.009
   16   2HG1  VAL   2          HG12      VAL   2  16.296 -11.803   6.918
   17   3HG1  VAL   2          HG13      VAL   2  14.927 -10.882   6.296
   18   1HG2  VAL   2          HG21      VAL   2  15.576  -8.930   7.857
   19   2HG2  VAL   2          HG22      VAL   2  16.949  -9.920   8.353
   20   3HG2  VAL   2          HG23      VAL   2  15.837  -9.283   9.565
   21    HA   PRO   3           HA       PRO   3  11.517  -7.343   7.072
   22   1HB   PRO   3          HB2       PRO   3  12.265  -5.376   9.089
   23   2HB   PRO   3          HB1       PRO   3  10.659  -5.967   8.657
   24   1HG   PRO   3          HG2       PRO   3  11.844  -6.537  11.025
   25   2HG   PRO   3          HG1       PRO   3  10.709  -7.638  10.224
   26   1HD   PRO   3          HD2       PRO   3  13.706  -7.719  10.279
   27   2HD   PRO   3          HD1       PRO   3  12.540  -9.050  10.451
   28    H    LYS   4           HN       LYS   4  13.579  -7.781   5.744
   29    HA   LYS   4           HA       LYS   4  15.770  -6.033   6.013
   30   1HB   LYS   4          HB2       LYS   4  14.792  -7.765   3.787
   31   2HB   LYS   4          HB1       LYS   4  16.173  -6.701   3.569
   32   1HG   LYS   4          HG2       LYS   4  17.203  -7.797   5.585
   33   2HG   LYS   4          HG1       LYS   4  15.884  -8.964   5.526
   34   1HD   LYS   4          HD2       LYS   4  16.573  -9.643   3.288
   35   2HD   LYS   4          HD1       LYS   4  17.875  -8.448   3.319
   36   1HE   LYS   4          HE2       LYS   4  18.792  -9.590   5.329
   37   2HE   LYS   4          HE1       LYS   4  17.559 -10.834   5.134
   38   1HZ   LYS   4          HZ1       LYS   4  18.482 -11.306   2.927
   39   2HZ   LYS   4          HZ2       LYS   4  19.612 -11.552   4.165
   40   3HZ   LYS   4          HZ3       LYS   4  19.707 -10.159   3.201
   41    H    GLY   5           HN       GLY   5  12.922  -5.903   4.002
   42   1HA   GLY   5          HA2       GLY   5  12.229  -3.394   4.539
   43   2HA   GLY   5          HA1       GLY   5  13.506  -3.124   3.375
   44    H    LYS   6           HN       LYS   6  12.247  -5.794   2.144
   45    HA   LYS   6           HA       LYS   6  10.857  -4.047   0.268
   46   1HB   LYS   6          HB2       LYS   6  11.594  -5.396  -1.483
   47   2HB   LYS   6          HB1       LYS   6  12.943  -5.385  -0.351
   48   1HG   LYS   6          HG2       LYS   6  10.901  -7.563  -0.651
   49   2HG   LYS   6          HG1       LYS   6  12.562  -7.614  -1.241
   50   1HD   LYS   6          HD2       LYS   6  13.395  -7.588   1.033
   51   2HD   LYS   6          HD1       LYS   6  11.751  -7.369   1.674
   52   1HE   LYS   6          HE2       LYS   6  12.472  -9.694   1.843
   53   2HE   LYS   6          HE1       LYS   6  11.098  -9.516   0.753
   54   1HZ   LYS   6          HZ1       LYS   6  13.926  -9.727  -0.137
   55   2HZ   LYS   6          HZ2       LYS   6  12.549  -9.713  -1.133
   56   3HZ   LYS   6          HZ3       LYS   6  12.839 -11.024  -0.095
   57    H    TYR   7           HN       TYR   7   9.230  -4.764   2.257
   58    HA   TYR   7           HA       TYR   7   7.670  -6.969   2.182
   59   1HB   TYR   7          HB2       TYR   7   6.553  -4.220   2.586
   60   2HB   TYR   7          HB1       TYR   7   6.227  -5.706   3.494
   61    HD1  TYR   7           HD1      TYR   7   8.489  -6.786   4.467
   62    HD2  TYR   7           HD2      TYR   7   7.780  -2.702   3.626
   63    HE1  TYR   7           HE1      TYR   7  10.170  -6.180   6.120
   64    HE2  TYR   7           HE2      TYR   7   9.414  -2.047   5.264
   65    HH   TYR   7           HH       TYR   7  10.536  -3.003   7.296
   66    HA   PRO   8           HA       PRO   8   5.563  -6.685  -1.916
   67   1HB   PRO   8          HB2       PRO   8   4.437  -9.091  -0.512
   68   2HB   PRO   8          HB1       PRO   8   4.914  -8.910  -2.212
   69   1HG   PRO   8          HG2       PRO   8   6.489 -10.228  -0.581
   70   2HG   PRO   8          HG1       PRO   8   7.205  -9.037  -1.687
   71   1HD   PRO   8          HD2       PRO   8   6.601  -8.778   1.242
   72   2HD   PRO   8          HD1       PRO   8   8.038  -8.248   0.338
   73    H    ILE   9           HN       ILE   9   4.147  -4.912  -1.532
   74    HA   ILE   9           HA       ILE   9   2.228  -5.185   0.606
   75    HB   ILE   9           HB       ILE   9   2.964  -3.031   0.651
   76   1HG1  ILE   9          HG12      ILE   9   0.410  -3.147  -0.921
   77   2HG1  ILE   9          HG11      ILE   9   0.640  -2.846   0.799
   78   1HG2  ILE   9          HG21      ILE   9   3.267  -1.580  -1.287
   79   2HG2  ILE   9          HG22      ILE   9   2.764  -2.900  -2.346
   80   3HG2  ILE   9          HG23      ILE   9   4.244  -3.045  -1.394
   81   1HD1  ILE   9          HD11      ILE   9  -0.009  -0.837  -0.374
   82   2HD1  ILE   9          HD12      ILE   9   1.397  -0.996  -1.438
   83   3HD1  ILE   9          HD13      ILE   9   1.620  -0.686   0.288
   84    H    SER  10           HN       SER  10   0.301  -5.921   0.434
   85    HA   SER  10           HA       SER  10  -0.912  -6.246  -2.203
   86   1HB   SER  10          HB2       SER  10  -1.784  -7.247   0.511
   87   2HB   SER  10          HB1       SER  10  -2.532  -7.667  -1.035
   88    HG   SER  10           HG       SER  10   0.158  -8.080  -1.042
   89    H    VAL  11           HN       VAL  11  -2.591  -5.095  -2.901
   90    HA   VAL  11           HA       VAL  11  -3.505  -2.914  -1.138
   91    HB   VAL  11           HB       VAL  11  -3.845  -1.674  -3.398
   92   1HG1  VAL  11          HG11      VAL  11  -2.404  -0.749  -1.834
   93   2HG1  VAL  11          HG12      VAL  11  -1.355  -1.007  -3.231
   94   3HG1  VAL  11          HG13      VAL  11  -1.313  -2.137  -1.870
   95   1HG2  VAL  11          HG21      VAL  11  -2.132  -2.251  -5.067
   96   2HG2  VAL  11          HG22      VAL  11  -3.308  -3.549  -4.860
   97   3HG2  VAL  11          HG23      VAL  11  -1.710  -3.683  -4.127
   98    H    CYS  12           HN       CYS  12  -5.588  -2.637  -0.783
   99    HA   CYS  12           HA       CYS  12  -7.599  -4.305  -1.836
  100   1HB   CYS  12          HB2       CYS  12  -7.945  -3.219   0.280
  101   2HB   CYS  12          HB1       CYS  12  -7.673  -1.630  -0.419
  102    H    MET  13           HN       MET  13  -8.169  -4.329  -3.908
  103    HA   MET  13           HA       MET  13  -9.040  -1.783  -5.083
  104   1HB   MET  13          HB2       MET  13  -7.638  -4.058  -6.500
  105   2HB   MET  13          HB1       MET  13  -8.459  -2.743  -7.332
  106   1HG   MET  13          HG2       MET  13  -6.945  -1.132  -6.323
  107   2HG   MET  13          HG1       MET  13  -6.142  -2.426  -5.437
  108   1HE   MET  13          HE1       MET  13  -4.644  -4.286  -6.550
  109   2HE   MET  13          HE2       MET  13  -4.434  -4.465  -8.293
  110   3HE   MET  13          HE3       MET  13  -6.009  -4.764  -7.561
  111    H    GLY  14           HN       GLY  14 -10.454  -3.897  -3.527
  112   1HA   GLY  14          HA2       GLY  14 -11.709  -5.712  -5.307
  113   2HA   GLY  14          HA1       GLY  14 -12.209  -5.382  -3.659
  114    H    THR  15           HN       THR  15 -14.214  -5.910  -5.179
  115    HA   THR  15           HA       THR  15 -15.183  -3.875  -6.884
  116    HB   THR  15           HB       THR  15 -17.397  -5.173  -6.508
  117    HG1  THR  15           HG1      THR  15 -17.021  -7.261  -5.589
  118   1HG2  THR  15          HG21      THR  15 -15.989  -5.427  -8.490
  119   2HG2  THR  15          HG22      THR  15 -16.617  -6.993  -7.969
  120   3HG2  THR  15          HG23      THR  15 -14.944  -6.548  -7.615
  121    H    ALA  16           HN       ALA  16 -15.938  -4.747  -3.543
  122    HA   ALA  16           HA       ALA  16 -18.022  -2.850  -3.229
  123   1HB   ALA  16          HB1       ALA  16 -17.879  -4.870  -1.863
  124   2HB   ALA  16          HB2       ALA  16 -17.924  -3.420  -0.859
  125   3HB   ALA  16          HB3       ALA  16 -16.398  -4.267  -1.120
  126    H    CYS  17           HN       CYS  17 -14.663  -2.920  -2.097
  127    HA   CYS  17           HA       CYS  17 -14.761  -0.473  -0.714
  128   1HB   CYS  17          HB2       CYS  17 -12.445  -1.951  -1.938
  129   2HB   CYS  17          HB1       CYS  17 -12.283  -0.617  -0.835
  130    H    PHE  18           HN       PHE  18 -13.896  -1.261  -4.048
  131    HA   PHE  18           HA       PHE  18 -12.558   1.145  -4.669
  132   1HB   PHE  18          HB2       PHE  18 -12.482  -1.093  -5.903
  133   2HB   PHE  18          HB1       PHE  18 -13.975  -0.585  -6.683
  134    HD1  PHE  18           HD1      PHE  18 -10.385   0.038  -6.359
  135    HD2  PHE  18           HD2      PHE  18 -13.972   1.137  -8.362
  136    HE1  PHE  18           HE1      PHE  18  -9.065   1.234  -8.053
  137    HE2  PHE  18           HE2      PHE  18 -12.659   2.338 -10.062
  138    HZ   PHE  18           HZ       PHE  18 -10.201   2.387  -9.909
  139    H    VAL  19           HN       VAL  19 -15.960   0.343  -4.694
  140    HA   VAL  19           HA       VAL  19 -16.663   2.158  -6.774
  141    HB   VAL  19           HB       VAL  19 -17.941   0.085  -6.224
  142   1HG1  VAL  19          HG11      VAL  19 -17.991   0.258  -3.809
  143   2HG1  VAL  19          HG12      VAL  19 -19.630   0.173  -4.454
  144   3HG1  VAL  19          HG13      VAL  19 -18.974   1.720  -3.916
  145   1HG2  VAL  19          HG21      VAL  19 -20.131   1.034  -6.711
  146   2HG2  VAL  19          HG22      VAL  19 -18.873   1.820  -7.666
  147   3HG2  VAL  19          HG23      VAL  19 -19.550   2.633  -6.254
  148    H    LYS  20           HN       LYS  20 -16.289   2.507  -3.355
  149    HA   LYS  20           HA       LYS  20 -17.953   4.873  -3.224
  150   1HB   LYS  20          HB2       LYS  20 -16.202   3.543  -1.159
  151   2HB   LYS  20          HB1       LYS  20 -17.149   4.995  -0.852
  152   1HG   LYS  20          HG2       LYS  20 -18.187   2.264  -1.577
  153   2HG   LYS  20          HG1       LYS  20 -18.377   3.116  -0.043
  154   1HD   LYS  20          HD2       LYS  20 -19.728   4.822  -1.130
  155   2HD   LYS  20          HD1       LYS  20 -19.489   4.044  -2.695
  156   1HE   LYS  20          HE2       LYS  20 -21.642   3.409  -1.932
  157   2HE   LYS  20          HE1       LYS  20 -20.595   2.005  -1.732
  158   1HZ   LYS  20          HZ1       LYS  20 -20.320   2.745   0.638
  159   2HZ   LYS  20          HZ2       LYS  20 -21.861   2.187   0.222
  160   3HZ   LYS  20          HZ3       LYS  20 -21.579   3.852   0.364
  161    H    GLY  21           HN       GLY  21 -15.307   4.566  -4.788
  162   1HA   GLY  21          HA2       GLY  21 -14.039   6.319  -5.663
  163   2HA   GLY  21          HA1       GLY  21 -14.517   7.320  -4.292
  164    H    ALA  22           HN       ALA  22 -13.231   4.104  -3.921
  165    HA   ALA  22           HA       ALA  22 -11.215   5.049  -2.139
  166   1HB   ALA  22          HB1       ALA  22 -12.283   2.869  -1.819
  167   2HB   ALA  22          HB2       ALA  22 -10.534   2.707  -1.979
  168   3HB   ALA  22          HB3       ALA  22 -11.584   2.302  -3.335
  169    H    ASP  23           HN       ASP  23 -11.444   4.523  -5.486
  170    HA   ASP  23           HA       ASP  23  -8.873   3.932  -6.285
  171   1HB   ASP  23          HB2       ASP  23 -10.639   4.003  -7.903
  172   2HB   ASP  23          HB1       ASP  23 -10.984   5.693  -7.539
  173    H    LYS  24           HN       LYS  24 -10.269   7.172  -5.641
  174    HA   LYS  24           HA       LYS  24  -7.875   8.502  -6.399
  175   1HB   LYS  24          HB2       LYS  24 -10.373   9.346  -4.984
  176   2HB   LYS  24          HB1       LYS  24  -8.973  10.411  -4.960
  177   1HG   LYS  24          HG2       LYS  24 -10.353  11.090  -6.758
  178   2HG   LYS  24          HG1       LYS  24  -8.942  10.293  -7.452
  179   1HD   LYS  24          HD2       LYS  24 -10.530   8.180  -7.330
  180   2HD   LYS  24          HD1       LYS  24 -11.783   9.422  -7.378
  181   1HE   LYS  24          HE2       LYS  24  -9.578   8.990  -9.383
  182   2HE   LYS  24          HE1       LYS  24 -11.297   8.692  -9.621
  183   1HZ   LYS  24          HZ1       LYS  24 -10.486  10.783 -10.615
  184   2HZ   LYS  24          HZ2       LYS  24 -10.136  11.370  -9.063
  185   3HZ   LYS  24          HZ3       LYS  24 -11.740  11.018  -9.497
  186    H    VAL  25           HN       VAL  25  -9.093   7.311  -3.338
  187    HA   VAL  25           HA       VAL  25  -7.060   8.605  -1.822
  188    HB   VAL  25           HB       VAL  25  -7.947   6.601  -0.216
  189   1HG1  VAL  25          HG11      VAL  25  -9.221   9.295  -0.671
  190   2HG1  VAL  25          HG12      VAL  25  -7.803   8.980   0.329
  191   3HG1  VAL  25          HG13      VAL  25  -9.372   8.320   0.792
  192   1HG2  VAL  25          HG21      VAL  25  -9.543   5.828  -1.913
  193   2HG2  VAL  25          HG22      VAL  25 -10.290   7.427  -1.911
  194   3HG2  VAL  25          HG23      VAL  25 -10.343   6.427  -0.460
  195    H    VAL  26           HN       VAL  26  -7.429   5.325  -3.190
  196    HA   VAL  26           HA       VAL  26  -4.921   4.470  -2.096
  197    HB   VAL  26           HB       VAL  26  -6.558   2.807  -2.947
  198   1HG1  VAL  26          HG11      VAL  26  -6.710   2.371  -5.356
  199   2HG1  VAL  26          HG12      VAL  26  -5.754   3.821  -5.666
  200   3HG1  VAL  26          HG13      VAL  26  -7.349   3.959  -4.926
  201   1HG2  VAL  26          HG21      VAL  26  -3.867   2.715  -4.295
  202   2HG2  VAL  26          HG22      VAL  26  -4.940   1.339  -4.044
  203   3HG2  VAL  26          HG23      VAL  26  -4.237   2.173  -2.658
  204    H    HIS  27           HN       HIS  27  -5.938   6.321  -4.910
  205    HA   HIS  27           HA       HIS  27  -3.507   6.274  -6.309
  206   1HB   HIS  27          HB2       HIS  27  -5.675   7.204  -7.203
  207   2HB   HIS  27          HB1       HIS  27  -5.380   8.634  -6.211
  208    HD1  HIS  27           HD1      HIS  27  -3.187  10.030  -6.821
  209    HD2  HIS  27           HD2      HIS  27  -4.348   7.160  -9.595
  210    HE1  HIS  27           HE1      HIS  27  -1.850  10.511  -8.890
  211    HE2  HIS  27           HE2      HIS  27  -2.776   8.937 -10.632
  212    H    ALA  28           HN       ALA  28  -4.636   8.201  -3.652
  213    HA   ALA  28           HA       ALA  28  -2.522  10.004  -3.412
  214   1HB   ALA  28          HB1       ALA  28  -4.557  10.142  -2.039
  215   2HB   ALA  28          HB2       ALA  28  -3.104  10.148  -1.040
  216   3HB   ALA  28          HB3       ALA  28  -4.073   8.681  -1.177
  217    H    PHE  29           HN       PHE  29  -2.956   6.759  -2.092
  218    HA   PHE  29           HA       PHE  29  -0.507   6.253  -0.900
  219   1HB   PHE  29          HB2       PHE  29  -2.295   4.631  -0.880
  220   2HB   PHE  29          HB1       PHE  29  -2.198   4.442  -2.621
  221    HD1  PHE  29           HD1      PHE  29   0.159   4.443   0.220
  222    HD2  PHE  29           HD2      PHE  29  -1.170   2.524  -3.326
  223    HE1  PHE  29           HE1      PHE  29   1.934   2.808   0.456
  224    HE2  PHE  29           HE2      PHE  29   0.616   0.851  -3.092
  225    HZ   PHE  29           HZ       PHE  29   2.181   0.991  -1.192
  226    H    LYS  30           HN       LYS  30  -1.446   5.680  -4.231
  227    HA   LYS  30           HA       LYS  30   0.872   4.725  -5.315
  228   1HB   LYS  30          HB2       LYS  30  -1.077   4.884  -6.688
  229   2HB   LYS  30          HB1       LYS  30  -1.113   6.632  -6.528
  230   1HG   LYS  30          HG2       LYS  30  -0.339   6.100  -8.715
  231   2HG   LYS  30          HG1       LYS  30   1.024   6.737  -7.794
  232   1HD   LYS  30          HD2       LYS  30   1.766   4.844  -9.073
  233   2HD   LYS  30          HD1       LYS  30   1.757   4.407  -7.366
  234   1HE   LYS  30          HE2       LYS  30  -0.260   3.160  -7.618
  235   2HE   LYS  30          HE1       LYS  30  -0.504   3.769  -9.253
  236   1HZ   LYS  30          HZ1       LYS  30   0.376   1.500  -9.223
  237   2HZ   LYS  30          HZ2       LYS  30   1.760   2.037  -8.402
  238   3HZ   LYS  30          HZ3       LYS  30   1.441   2.576  -9.981
  239    H    GLU  31           HN       GLU  31   0.084   8.090  -4.868
  240    HA   GLU  31           HA       GLU  31   2.663   8.970  -5.822
  241   1HB   GLU  31          HB2       GLU  31   0.492  10.582  -4.485
  242   2HB   GLU  31          HB1       GLU  31   1.841  11.211  -5.421
  243   1HG   GLU  31          HG2       GLU  31   0.977  10.049  -7.408
  244   2HG   GLU  31          HG1       GLU  31  -0.421   9.532  -6.466
  245    H    GLN  32           HN       GLN  32   1.148   8.409  -2.788
  246    HA   GLN  32           HA       GLN  32   3.010   9.489  -1.044
  247   1HB   GLN  32          HB2       GLN  32   1.083   7.216  -0.900
  248   2HB   GLN  32          HB1       GLN  32   2.183   7.506   0.402
  249   1HG   GLN  32          HG2       GLN  32   0.359   9.615  -0.676
  250   2HG   GLN  32          HG1       GLN  32  -0.117   8.506   0.613
  251   1HE2  GLN  32          HE21      GLN  32   2.499   8.349   1.735
  252   2HE2  GLN  32          HE22      GLN  32   2.770   9.830   2.534
  253    H    LEU  33           HN       LEU  33   3.042   6.540  -2.961
  254    HA   LEU  33           HA       LEU  33   5.216   5.199  -1.862
  255   1HB   LEU  33          HB2       LEU  33   3.771   4.629  -3.944
  256   2HB   LEU  33          HB1       LEU  33   4.977   5.558  -4.820
  257    HG   LEU  33           HG       LEU  33   5.438   3.083  -3.205
  258   1HD1  LEU  33          HD11      LEU  33   5.625   3.609  -6.135
  259   2HD1  LEU  33          HD12      LEU  33   4.388   2.648  -5.310
  260   3HD1  LEU  33          HD13      LEU  33   6.069   2.098  -5.332
  261   1HD2  LEU  33          HD21      LEU  33   7.476   4.640  -4.774
  262   2HD2  LEU  33          HD22      LEU  33   7.737   3.086  -3.979
  263   3HD2  LEU  33          HD23      LEU  33   7.388   4.518  -3.014
  264    H    LYS  34           HN       LYS  34   5.125   7.518  -4.376
  265    HA   LYS  34           HA       LYS  34   6.394   9.158  -5.123
  266   1HB   LYS  34          HB2       LYS  34   7.804  10.459  -3.478
  267   2HB   LYS  34          HB1       LYS  34   6.090  10.312  -3.129
  268   1HG   LYS  34          HG2       LYS  34   6.546   9.523  -1.116
  269   2HG   LYS  34          HG1       LYS  34   7.464   8.174  -1.811
  270   1HD   LYS  34          HD2       LYS  34   8.752  10.871  -1.594
  271   2HD   LYS  34          HD1       LYS  34   8.579   9.884  -0.143
  272   1HE   LYS  34          HE2       LYS  34   9.711   8.025  -1.339
  273   2HE   LYS  34          HE1       LYS  34   9.976   9.112  -2.700
  274   1HZ   LYS  34          HZ1       LYS  34  11.879   8.859  -1.103
  275   2HZ   LYS  34          HZ2       LYS  34  10.951   9.706   0.038
  276   3HZ   LYS  34          HZ3       LYS  34  11.401  10.455  -1.418
  277    H    ILE  35           HN       ILE  35   7.928   6.539  -3.802
  278    HA   ILE  35           HA       ILE  35   9.626   5.267  -4.473
  279    HB   ILE  35           HB       ILE  35   9.918   6.334  -7.163
  280   1HG1  ILE  35          HG12      ILE  35   7.216   5.255  -6.453
  281   2HG1  ILE  35          HG11      ILE  35   7.496   6.995  -6.500
  282   1HG2  ILE  35          HG21      ILE  35   9.329   4.018  -7.693
  283   2HG2  ILE  35          HG22      ILE  35   8.859   3.770  -6.005
  284   3HG2  ILE  35          HG23      ILE  35  10.548   4.092  -6.417
  285   1HD1  ILE  35          HD11      ILE  35   8.116   6.820  -8.849
  286   2HD1  ILE  35          HD12      ILE  35   6.506   6.154  -8.571
  287   3HD1  ILE  35          HD13      ILE  35   7.883   5.074  -8.787
  288    H    ASP  36           HN       ASP  36  11.545   5.657  -6.384
  289    HA   ASP  36           HA       ASP  36  13.198   7.917  -5.749
  290   1HB   ASP  36          HB2       ASP  36  13.514   6.219  -3.849
  291   2HB   ASP  36          HB1       ASP  36  14.186   5.135  -5.061
  292    H    ILE  37           HN       ILE  37  13.240   4.609  -6.690
  293    HA   ILE  37           HA       ILE  37  13.248   4.878  -9.464
  294    HB   ILE  37           HB       ILE  37  15.492   3.654  -9.704
  295   1HG1  ILE  37          HG12      ILE  37  16.280   5.257  -7.332
  296   2HG1  ILE  37          HG11      ILE  37  15.524   3.674  -7.137
  297   1HG2  ILE  37          HG21      ILE  37  15.141   5.827 -10.730
  298   2HG2  ILE  37          HG22      ILE  37  16.767   5.712 -10.060
  299   3HG2  ILE  37          HG23      ILE  37  15.522   6.618  -9.201
  300   1HD1  ILE  37          HD11      ILE  37  17.989   3.575  -7.075
  301   2HD1  ILE  37          HD12      ILE  37  18.043   4.237  -8.709
  302   3HD1  ILE  37          HD13      ILE  37  17.321   2.654  -8.421
  303    H    GLY  38           HN       GLY  38  12.098   3.535  -7.174
  304   1HA   GLY  38          HA2       GLY  38  12.295   0.771  -7.815
  305   2HA   GLY  38          HA1       GLY  38  13.214   1.194  -6.354
  306    H    ASP  39           HN       ASP  39  12.131   2.565  -4.861
  307    HA   ASP  39           HA       ASP  39   9.376   2.838  -4.510
  308   1HB   ASP  39          HB2       ASP  39  10.578   0.358  -3.350
  309   2HB   ASP  39          HB1       ASP  39   9.278   1.209  -2.542
  310    H    VAL  40           HN       VAL  40   9.274   4.444  -3.347
  311    HA   VAL  40           HA       VAL  40   9.295   5.847  -1.627
  312    HB   VAL  40           HB       VAL  40   8.321   4.144  -0.422
  313   1HG1  VAL  40          HG11      VAL  40  10.977   2.885   0.138
  314   2HG1  VAL  40          HG12      VAL  40   9.750   2.272  -0.971
  315   3HG1  VAL  40          HG13      VAL  40   9.407   2.357   0.761
  316   1HG2  VAL  40          HG21      VAL  40  10.615   5.050   1.237
  317   2HG2  VAL  40          HG22      VAL  40   9.108   4.370   1.844
  318   3HG2  VAL  40          HG23      VAL  40   9.099   5.923   1.001
  319    H    THR  41           HN       THR  41  12.174   4.554  -2.489
  320    HA   THR  41           HA       THR  41  14.152   5.860  -2.598
  321    HB   THR  41           HB       THR  41  13.456   6.778   0.188
  322    HG1  THR  41           HG1      THR  41  14.013   8.341  -2.125
  323   1HG2  THR  41          HG21      THR  41  15.858   6.348   0.079
  324   2HG2  THR  41          HG22      THR  41  15.543   8.084   0.105
  325   3HG2  THR  41          HG23      THR  41  15.969   7.289  -1.410
  326    HA   PRO  42           HA       PRO  42  15.651   2.523   0.593
  327   1HB   PRO  42          HB2       PRO  42  12.980   1.194   0.625
  328   2HB   PRO  42          HB1       PRO  42  14.278   1.122   1.825
  329   1HG   PRO  42          HG2       PRO  42  12.157   2.674   2.224
  330   2HG   PRO  42          HG1       PRO  42  13.784   3.216   2.683
  331   1HD   PRO  42          HD2       PRO  42  12.088   4.047   0.382
  332   2HD   PRO  42          HD1       PRO  42  13.271   4.985   1.311
  333    H    ASP  43           HN       ASP  43  13.242   2.345  -2.023
  334    HA   ASP  43           HA       ASP  43  13.924   2.033  -4.215
  335   1HB   ASP  43          HB2       ASP  43  16.318   2.288  -3.600
  336   2HB   ASP  43          HB1       ASP  43  16.351   0.609  -3.077
  337    H    GLY  44           HN       GLY  44  12.790   0.410  -1.939
  338   1HA   GLY  44          HA2       GLY  44  11.297  -1.364  -3.265
  339   2HA   GLY  44          HA1       GLY  44  12.795  -2.277  -3.038
  340    H    ARG  45           HN       ARG  45  10.333  -0.439  -1.391
  341    HA   ARG  45           HA       ARG  45  10.801  -2.074   0.991
  342   1HB   ARG  45          HB2       ARG  45  11.433   0.217   1.349
  343   2HB   ARG  45          HB1       ARG  45   9.909   0.796   0.782
  344   1HG   ARG  45          HG2       ARG  45   8.885   0.400   2.749
  345   2HG   ARG  45          HG1       ARG  45   9.806  -1.078   3.050
  346   1HD   ARG  45          HD2       ARG  45  11.570   0.054   4.002
  347   2HD   ARG  45          HD1       ARG  45  11.210   1.552   3.143
  348    HE   ARG  45           HE       ARG  45   9.132   1.530   4.680
  349   1HH1  ARG  45          HH11      ARG  45  12.380   0.540   5.591
  350   2HH1  ARG  45          HH12      ARG  45  12.167   0.999   7.261
  351   1HH2  ARG  45          HH21      ARG  45   8.857   2.092   6.824
  352   2HH2  ARG  45          HH22      ARG  45  10.151   1.865   7.966
  353    H    PHE  46           HN       PHE  46   8.310  -0.041  -0.534
  354    HA   PHE  46           HA       PHE  46   6.574  -2.331  -0.147
  355   1HB   PHE  46          HB2       PHE  46   4.702  -0.819  -0.379
  356   2HB   PHE  46          HB1       PHE  46   5.646  -0.557   1.056
  357    HD1  PHE  46           HD1      PHE  46   7.697   1.207  -0.913
  358    HD2  PHE  46           HD2      PHE  46   3.596   1.249   0.150
  359    HE1  PHE  46           HE1      PHE  46   7.604   3.678  -1.221
  360    HE2  PHE  46           HE2      PHE  46   3.512   3.653  -0.151
  361    HZ   PHE  46           HZ       PHE  46   5.518   4.861  -0.831
  362    H    SER  47           HN       SER  47   6.346  -3.498  -1.814
  363    HA   SER  47           HA       SER  47   6.046  -2.261  -4.476
  364   1HB   SER  47          HB2       SER  47   7.102  -5.038  -3.880
  365   2HB   SER  47          HB1       SER  47   7.049  -4.243  -5.452
  366    HG   SER  47           HG       SER  47   8.410  -2.563  -4.210
  367    H    ILE  48           HN       ILE  48   3.952  -2.338  -5.036
  368    HA   ILE  48           HA       ILE  48   2.131  -3.860  -3.475
  369    HB   ILE  48           HB       ILE  48   0.328  -2.836  -4.635
  370   1HG1  ILE  48          HG12      ILE  48   1.148  -3.111  -6.951
  371   2HG1  ILE  48          HG11      ILE  48   0.580  -1.472  -6.641
  372   1HG2  ILE  48          HG21      ILE  48   0.879  -0.455  -4.409
  373   2HG2  ILE  48          HG22      ILE  48   2.590  -0.873  -4.320
  374   3HG2  ILE  48          HG23      ILE  48   1.484  -1.417  -3.059
  375   1HD1  ILE  48          HD11      ILE  48   2.934  -0.803  -6.276
  376   2HD1  ILE  48          HD12      ILE  48   2.581  -1.357  -7.918
  377   3HD1  ILE  48          HD13      ILE  48   3.414  -2.425  -6.782
  378    H    ASP  49           HN       ASP  49   0.793  -5.454  -3.933
  379    HA   ASP  49           HA       ASP  49   0.610  -6.639  -6.562
  380   1HB   ASP  49          HB2       ASP  49   2.605  -7.737  -5.625
  381   2HB   ASP  49          HB1       ASP  49   1.650  -8.279  -4.252
  382    H    THR  50           HN       THR  50  -1.065  -7.817  -6.875
  383    HA   THR  50           HA       THR  50  -3.513  -7.537  -5.832
  384    HB   THR  50           HB       THR  50  -2.505 -10.050  -7.149
  385    HG1  THR  50           HG1      THR  50  -2.582  -8.942  -9.003
  386   1HG2  THR  50          HG21      THR  50  -4.778 -10.274  -6.263
  387   2HG2  THR  50          HG22      THR  50  -4.803 -10.201  -8.026
  388   3HG2  THR  50          HG23      THR  50  -5.251  -8.783  -7.077
  389    H    LEU  51           HN       LEU  51  -1.220  -9.974  -4.479
  390    HA   LEU  51           HA       LEU  51  -3.011 -12.051  -4.414
  391   1HB   LEU  51          HB2       LEU  51  -0.640 -11.524  -2.663
  392   2HB   LEU  51          HB1       LEU  51  -1.545 -13.023  -2.592
  393    HG   LEU  51           HG       LEU  51  -0.063 -11.954  -4.996
  394   1HD1  LEU  51          HD11      LEU  51   1.376 -13.903  -4.640
  395   2HD1  LEU  51          HD12      LEU  51   0.468 -14.300  -3.181
  396   3HD1  LEU  51          HD13      LEU  51   1.404 -12.807  -3.257
  397   1HD2  LEU  51          HD21      LEU  51  -2.096 -13.166  -5.636
  398   2HD2  LEU  51          HD22      LEU  51  -1.588 -14.532  -4.645
  399   3HD2  LEU  51          HD23      LEU  51  -0.642 -14.070  -6.058
  400    H    ARG  52           HN       ARG  52  -2.602  -9.778  -1.658
  401    HA   ARG  52           HA       ARG  52  -4.241 -11.214   0.127
  402   1HB   ARG  52          HB2       ARG  52  -2.912  -9.370   0.931
  403   2HB   ARG  52          HB1       ARG  52  -3.783  -8.241  -0.089
  404   1HG   ARG  52          HG2       ARG  52  -4.544  -7.958   2.142
  405   2HG   ARG  52          HG1       ARG  52  -5.838  -8.726   1.223
  406   1HD   ARG  52          HD2       ARG  52  -3.892 -10.348   2.824
  407   2HD   ARG  52          HD1       ARG  52  -5.297  -9.607   3.583
  408    HE   ARG  52           HE       ARG  52  -6.201 -11.023   1.360
  409   1HH1  ARG  52          HH11      ARG  52  -4.641 -11.666   4.428
  410   2HH1  ARG  52          HH12      ARG  52  -5.372 -13.236   4.612
  411   1HH2  ARG  52          HH21      ARG  52  -7.174 -13.086   1.617
  412   2HH2  ARG  52          HH22      ARG  52  -6.793 -14.039   3.012
  413    H    CYS  53           HN       CYS  53  -5.029  -8.733  -2.219
  414    HA   CYS  53           HA       CYS  53  -7.644  -8.270  -1.339
  415   1HB   CYS  53          HB2       CYS  53  -6.364  -6.624  -2.600
  416   2HB   CYS  53          HB1       CYS  53  -6.441  -7.659  -4.028
  417    H    VAL  54           HN       VAL  54  -9.607  -8.512  -2.508
  418    HA   VAL  54           HA       VAL  54 -11.312  -9.839  -3.173
  419    HB   VAL  54           HB       VAL  54  -9.358 -11.290  -4.975
  420   1HG1  VAL  54          HG11      VAL  54 -11.560 -12.292  -4.873
  421   2HG1  VAL  54          HG12      VAL  54 -11.326 -11.525  -6.443
  422   3HG1  VAL  54          HG13      VAL  54 -12.315 -10.735  -5.215
  423   1HG2  VAL  54          HG21      VAL  54 -10.772  -8.679  -5.525
  424   2HG2  VAL  54          HG22      VAL  54  -9.849  -9.617  -6.701
  425   3HG2  VAL  54          HG23      VAL  54  -9.035  -8.901  -5.310
  426    H    GLY  55           HN       GLY  55  -9.287 -10.572  -1.099
  427   1HA   GLY  55          HA2       GLY  55  -9.932 -13.434  -0.919
  428   2HA   GLY  55          HA1       GLY  55  -8.446 -12.734  -0.300
  429    H    GLY  56           HN       GLY  56 -11.993 -11.991   0.102
  430   1HA   GLY  56          HA2       GLY  56 -13.223 -12.060   2.058
  431   2HA   GLY  56          HA1       GLY  56 -12.032 -13.214   2.624
  432    H    CYS  57           HN       CYS  57 -12.394  -9.568   2.311
  433    HA   CYS  57           HA       CYS  57 -10.197  -9.468   4.328
  434   1HB   CYS  57          HB2       CYS  57 -10.500  -7.383   2.237
  435   2HB   CYS  57          HB1       CYS  57  -9.074  -7.889   3.077
  436    H    ALA  58           HN       ALA  58 -13.039  -7.967   2.900
  437    HA   ALA  58           HA       ALA  58 -12.616  -5.322   3.410
  438   1HB   ALA  58          HB1       ALA  58 -15.309  -6.637   3.400
  439   2HB   ALA  58          HB2       ALA  58 -14.356  -6.263   1.964
  440   3HB   ALA  58          HB3       ALA  58 -14.929  -4.961   3.004
  441    H    LEU  59           HN       LEU  59 -13.790  -7.604   5.924
  442    HA   LEU  59           HA       LEU  59 -14.811  -5.441   7.519
  443   1HB   LEU  59          HB2       LEU  59 -14.180  -8.307   8.060
  444   2HB   LEU  59          HB1       LEU  59 -14.468  -7.225   9.407
  445    HG   LEU  59           HG       LEU  59 -16.407  -7.838   7.177
  446   1HD1  LEU  59          HD11      LEU  59 -16.410  -8.564  10.105
  447   2HD1  LEU  59          HD12      LEU  59 -16.149  -9.670   8.757
  448   3HD1  LEU  59          HD13      LEU  59 -17.716  -8.888   8.965
  449   1HD2  LEU  59          HD21      LEU  59 -17.993  -6.489   8.453
  450   2HD2  LEU  59          HD22      LEU  59 -16.606  -5.523   7.945
  451   3HD2  LEU  59          HD23      LEU  59 -16.728  -6.084   9.614
  452    H    ALA  60           HN       ALA  60 -11.681  -6.124   6.691
  453    HA   ALA  60           HA       ALA  60 -10.858  -4.280   8.839
  454   1HB   ALA  60          HB1       ALA  60  -9.120  -6.154   7.222
  455   2HB   ALA  60          HB2       ALA  60  -9.556  -6.356   8.919
  456   3HB   ALA  60          HB3       ALA  60  -8.543  -4.998   8.423
  457    HA   PRO  61           HA       PRO  61  -9.656  -1.849   5.126
  458   1HB   PRO  61          HB2       PRO  61  -7.848  -0.157   6.261
  459   2HB   PRO  61          HB1       PRO  61  -9.589   0.138   6.330
  460   1HG   PRO  61          HG2       PRO  61  -7.763  -0.932   8.426
  461   2HG   PRO  61          HG1       PRO  61  -9.168   0.131   8.597
  462   1HD   PRO  61          HD2       PRO  61  -9.184  -2.578   9.127
  463   2HD   PRO  61          HD1       PRO  61 -10.624  -1.624   8.723
  464    H    ILE  62           HN       ILE  62  -8.184  -2.900   3.779
  465    HA   ILE  62           HA       ILE  62  -5.909  -4.127   5.188
  466    HB   ILE  62           HB       ILE  62  -5.719  -5.704   3.321
  467   1HG1  ILE  62          HG12      ILE  62  -8.327  -4.555   2.314
  468   2HG1  ILE  62          HG11      ILE  62  -6.761  -4.162   1.614
  469   1HG2  ILE  62          HG21      ILE  62  -8.440  -5.566   4.608
  470   2HG2  ILE  62          HG22      ILE  62  -6.996  -6.336   5.266
  471   3HG2  ILE  62          HG23      ILE  62  -7.763  -6.989   3.818
  472   1HD1  ILE  62          HD11      ILE  62  -7.989  -6.903   1.755
  473   2HD1  ILE  62          HD12      ILE  62  -6.424  -6.503   1.045
  474   3HD1  ILE  62          HD13      ILE  62  -7.906  -5.867   0.330
  475    H    VAL  63           HN       VAL  63  -3.974  -3.155   4.937
  476    HA   VAL  63           HA       VAL  63  -3.151  -3.315   2.154
  477    HB   VAL  63           HB       VAL  63  -1.368  -1.452   3.094
  478   1HG1  VAL  63          HG11      VAL  63  -2.447   0.058   1.490
  479   2HG1  VAL  63          HG12      VAL  63  -3.867  -0.987   1.462
  480   3HG1  VAL  63          HG13      VAL  63  -2.323  -1.579   0.848
  481   1HG2  VAL  63          HG21      VAL  63  -2.724   0.413   3.924
  482   2HG2  VAL  63          HG22      VAL  63  -2.753  -0.962   5.028
  483   3HG2  VAL  63          HG23      VAL  63  -4.134  -0.644   3.977
  484    H    MET  64           HN       MET  64  -1.555  -4.777   2.058
  485    HA   MET  64           HA       MET  64  -0.300  -5.410   4.650
  486   1HB   MET  64          HB2       MET  64  -1.768  -7.172   3.780
  487   2HB   MET  64          HB1       MET  64  -0.919  -7.140   2.243
  488   1HG   MET  64          HG2       MET  64   1.092  -7.942   3.347
  489   2HG   MET  64          HG1       MET  64   0.222  -7.997   4.882
  490   1HE   MET  64          HE1       MET  64   0.506 -11.814   4.053
  491   2HE   MET  64          HE2       MET  64   0.755 -10.569   5.275
  492   3HE   MET  64          HE3       MET  64   1.724 -10.565   3.803
  493    H    VAL  65           HN       VAL  65   1.975  -5.166   4.702
  494    HA   VAL  65           HA       VAL  65   3.234  -5.193   2.015
  495    HB   VAL  65           HB       VAL  65   5.190  -4.116   3.506
  496   1HG1  VAL  65          HG11      VAL  65   2.907  -2.483   2.420
  497   2HG1  VAL  65          HG12      VAL  65   4.256  -3.112   1.474
  498   3HG1  VAL  65          HG13      VAL  65   4.547  -1.914   2.736
  499   1HG2  VAL  65          HG21      VAL  65   4.203  -2.458   5.041
  500   2HG2  VAL  65          HG22      VAL  65   3.982  -4.134   5.559
  501   3HG2  VAL  65          HG23      VAL  65   2.643  -3.251   4.819
  502    H    GLY  66           HN       GLY  66   4.264  -7.073   1.720
  503   1HA   GLY  66          HA2       GLY  66   5.075  -9.144   2.209
  504   2HA   GLY  66          HA1       GLY  66   6.005  -8.298   3.462
  505    H    GLU  67           HN       GLU  67   5.662 -10.280   4.593
  506    HA   GLU  67           HA       GLU  67   3.081 -10.694   5.796
  507   1HB   GLU  67          HB2       GLU  67   4.682 -12.020   7.494
  508   2HB   GLU  67          HB1       GLU  67   4.134 -12.693   5.969
  509   1HG   GLU  67          HG2       GLU  67   6.473 -13.127   6.245
  510   2HG   GLU  67          HG1       GLU  67   6.245 -11.985   4.923
  511    H    LYS  68           HN       LYS  68   3.905  -8.029   5.928
  512    HA   LYS  68           HA       LYS  68   4.437  -7.618   8.779
  513   1HB   LYS  68          HB2       LYS  68   4.537  -5.557   6.573
  514   2HB   LYS  68          HB1       LYS  68   5.052  -5.331   8.235
  515   1HG   LYS  68          HG2       LYS  68   6.381  -6.992   6.092
  516   2HG   LYS  68          HG1       LYS  68   7.019  -5.572   6.927
  517   1HD   LYS  68          HD2       LYS  68   7.048  -6.796   9.037
  518   2HD   LYS  68          HD1       LYS  68   6.366  -8.213   8.239
  519   1HE   LYS  68          HE2       LYS  68   8.440  -8.006   6.692
  520   2HE   LYS  68          HE1       LYS  68   9.102  -7.043   8.015
  521   1HZ   LYS  68          HZ1       LYS  68   8.604  -8.931   9.508
  522   2HZ   LYS  68          HZ2       LYS  68   9.744  -9.309   8.313
  523   3HZ   LYS  68          HZ3       LYS  68   8.147  -9.850   8.157
  524    H    VAL  69           HN       VAL  69   2.198  -6.933   6.204
  525    HA   VAL  69           HA       VAL  69   0.069  -6.059   6.140
  526    HB   VAL  69           HB       VAL  69  -0.068  -7.319   8.874
  527   1HG1  VAL  69          HG11      VAL  69  -1.889  -5.718   8.582
  528   2HG1  VAL  69          HG12      VAL  69  -2.498  -7.373   8.528
  529   3HG1  VAL  69          HG13      VAL  69  -2.302  -6.455   7.034
  530   1HG2  VAL  69          HG21      VAL  69   0.542  -8.880   7.120
  531   2HG2  VAL  69          HG22      VAL  69  -0.808  -8.326   6.128
  532   3HG2  VAL  69          HG23      VAL  69  -1.116  -9.179   7.643
  533    H    TYR  70           HN       TYR  70  -0.297  -3.902   6.081
  534    HA   TYR  70           HA       TYR  70   0.060  -2.328   8.554
  535   1HB   TYR  70          HB2       TYR  70   1.028  -1.669   5.771
  536   2HB   TYR  70          HB1       TYR  70   0.811  -0.434   7.005
  537    HD1  TYR  70           HD1      TYR  70   1.891  -3.738   7.995
  538    HD2  TYR  70           HD2      TYR  70   3.214   0.124   6.876
  539    HE1  TYR  70           HE1      TYR  70   4.085  -4.283   8.807
  540    HE2  TYR  70           HE2      TYR  70   5.431  -0.400   7.717
  541    HH   TYR  70           HH       TYR  70   6.597  -1.864   9.141
  542    H    GLY  71           HN       GLY  71  -0.606   0.115   7.751
  543   1HA   GLY  71          HA2       GLY  71  -3.341  -0.076   6.677
  544   2HA   GLY  71          HA1       GLY  71  -2.975   0.853   8.122
  545    H    ASN  72           HN       ASN  72  -0.751   0.806   5.402
  546    HA   ASN  72           HA       ASN  72  -1.361   3.618   4.876
  547   1HB   ASN  72          HB2       ASN  72   1.065   2.904   4.967
  548   2HB   ASN  72          HB1       ASN  72   0.796   1.888   3.556
  549   1HD2  ASN  72          HD21      ASN  72  -1.073   3.866   2.358
  550   2HD2  ASN  72          HD22      ASN  72  -0.084   5.147   1.781
  551    H    VAL  73           HN       VAL  73  -3.314   3.591   3.940
  552    HA   VAL  73           HA       VAL  73  -3.806   1.757   1.685
  553    HB   VAL  73           HB       VAL  73  -6.203   2.812   2.744
  554   1HG1  VAL  73          HG11      VAL  73  -6.744   0.457   3.166
  555   2HG1  VAL  73          HG12      VAL  73  -5.079   0.026   2.771
  556   3HG1  VAL  73          HG13      VAL  73  -6.122   0.748   1.545
  557   1HG2  VAL  73          HG21      VAL  73  -4.459   1.489   4.809
  558   2HG2  VAL  73          HG22      VAL  73  -6.144   1.979   5.024
  559   3HG2  VAL  73          HG23      VAL  73  -4.888   3.198   4.766
  560    H    THR  74           HN       THR  74  -5.914   4.184   2.810
  561    HA   THR  74           HA       THR  74  -5.736   5.534   0.240
  562    HB   THR  74           HB       THR  74  -8.232   5.400   0.038
  563    HG1  THR  74           HG1      THR  74  -9.222   3.679   1.271
  564   1HG2  THR  74          HG21      THR  74  -8.265   3.106  -0.773
  565   2HG2  THR  74          HG22      THR  74  -6.796   2.753   0.135
  566   3HG2  THR  74          HG23      THR  74  -6.747   3.891  -1.211
  567    HA   PRO  75           HA       PRO  75  -8.346   8.520   2.657
  568   1HB   PRO  75          HB2       PRO  75  -9.339   7.886   5.164
  569   2HB   PRO  75          HB1       PRO  75 -10.137   7.533   3.633
  570   1HG   PRO  75          HG2       PRO  75  -9.035   5.680   5.504
  571   2HG   PRO  75          HG1       PRO  75  -9.803   5.327   3.950
  572   1HD   PRO  75          HD2       PRO  75  -6.933   5.492   4.640
  573   2HD   PRO  75          HD1       PRO  75  -7.730   4.608   3.324
  574    H    GLY  76           HN       GLY  76  -5.905   9.136   2.865
  575   1HA   GLY  76          HA2       GLY  76  -4.602  10.701   3.939
  576   2HA   GLY  76          HA1       GLY  76  -5.747  10.702   5.271
  577    H    GLN  77           HN       GLN  77  -5.129   7.584   4.923
  578    HA   GLN  77           HA       GLN  77  -3.588   7.571   7.367
  579   1HB   GLN  77          HB2       GLN  77  -4.268   5.154   5.665
  580   2HB   GLN  77          HB1       GLN  77  -3.898   5.183   7.381
  581   1HG   GLN  77          HG2       GLN  77  -6.044   6.572   7.613
  582   2HG   GLN  77          HG1       GLN  77  -6.402   6.009   5.979
  583   1HE2  GLN  77          HE21      GLN  77  -6.984   3.904   5.636
  584   2HE2  GLN  77          HE22      GLN  77  -7.334   2.807   6.927
  585    H    VAL  78           HN       VAL  78  -3.278   7.335   4.084
  586    HA   VAL  78           HA       VAL  78  -1.115   5.868   3.469
  587    HB   VAL  78           HB       VAL  78  -0.920   7.515   1.591
  588   1HG1  VAL  78          HG11      VAL  78  -3.209   7.074   0.674
  589   2HG1  VAL  78          HG12      VAL  78  -3.591   6.362   2.245
  590   3HG1  VAL  78          HG13      VAL  78  -2.331   5.649   1.239
  591   1HG2  VAL  78          HG21      VAL  78  -1.517   9.548   2.422
  592   2HG2  VAL  78          HG22      VAL  78  -2.919   8.884   3.260
  593   3HG2  VAL  78          HG23      VAL  78  -2.947   9.079   1.491
  594    H    LYS  79           HN       LYS  79  -1.086   9.386   4.252
  595    HA   LYS  79           HA       LYS  79   1.612   9.672   3.596
  596   1HB   LYS  79          HB2       LYS  79   1.401  11.831   4.969
  597   2HB   LYS  79          HB1       LYS  79   0.354  11.650   3.571
  598   1HG   LYS  79          HG2       LYS  79  -1.532  11.198   4.915
  599   2HG   LYS  79          HG1       LYS  79  -0.540  10.959   6.355
  600   1HD   LYS  79          HD2       LYS  79   0.063  13.309   6.362
  601   2HD   LYS  79          HD1       LYS  79  -0.843  13.568   4.869
  602   1HE   LYS  79          HE2       LYS  79  -2.096  12.543   7.410
  603   2HE   LYS  79          HE1       LYS  79  -2.009  14.257   6.999
  604   1HZ   LYS  79          HZ1       LYS  79  -4.130  13.295   6.356
  605   2HZ   LYS  79          HZ2       LYS  79  -3.345  12.158   5.375
  606   3HZ   LYS  79          HZ3       LYS  79  -3.265  13.804   4.986
  607    H    LYS  80           HN       LYS  80  -0.003   8.889   6.549
  608    HA   LYS  80           HA       LYS  80   2.304   9.405   8.207
  609   1HB   LYS  80          HB2       LYS  80  -0.002   7.928   9.299
  610   2HB   LYS  80          HB1       LYS  80   0.807   9.359   9.904
  611   1HG   LYS  80          HG2       LYS  80  -0.763  10.663   9.120
  612   2HG   LYS  80          HG1       LYS  80  -0.593  10.017   7.501
  613   1HD   LYS  80          HD2       LYS  80  -2.770   9.484   7.942
  614   2HD   LYS  80          HD1       LYS  80  -1.962   8.024   8.513
  615   1HE   LYS  80          HE2       LYS  80  -1.981   8.904  10.806
  616   2HE   LYS  80          HE1       LYS  80  -2.820  10.346  10.241
  617   1HZ   LYS  80          HZ1       LYS  80  -4.307   8.681  11.238
  618   2HZ   LYS  80          HZ2       LYS  80  -3.880   7.580  10.022
  619   3HZ   LYS  80          HZ3       LYS  80  -4.699   9.010   9.626
  620    H    ILE  81           HN       ILE  81   0.344   6.756   7.147
  621    HA   ILE  81           HA       ILE  81   2.008   4.792   8.390
  622    HB   ILE  81           HB       ILE  81   0.022   4.391   6.146
  623   1HG1  ILE  81          HG12      ILE  81  -1.012   5.468   8.111
  624   2HG1  ILE  81          HG11      ILE  81  -1.571   3.808   7.930
  625   1HG2  ILE  81          HG21      ILE  81  -0.034   2.065   7.032
  626   2HG2  ILE  81          HG22      ILE  81   1.200   2.494   8.218
  627   3HG2  ILE  81          HG23      ILE  81   1.588   2.508   6.497
  628   1HD1  ILE  81          HD11      ILE  81  -0.020   3.106   9.682
  629   2HD1  ILE  81          HD12      ILE  81  -1.154   4.333  10.252
  630   3HD1  ILE  81          HD13      ILE  81   0.511   4.777   9.873
  631    H    LEU  82           HN       LEU  82   2.298   6.683   5.557
  632    HA   LEU  82           HA       LEU  82   4.057   5.012   4.117
  633   1HB   LEU  82          HB2       LEU  82   3.309   7.031   3.058
  634   2HB   LEU  82          HB1       LEU  82   3.919   8.026   4.372
  635    HG   LEU  82           HG       LEU  82   6.233   7.257   3.744
  636   1HD1  LEU  82          HD11      LEU  82   5.602   5.273   2.479
  637   2HD1  LEU  82          HD12      LEU  82   6.561   6.377   1.494
  638   3HD1  LEU  82          HD13      LEU  82   4.815   6.284   1.269
  639   1HD2  LEU  82          HD21      LEU  82   4.664   8.817   1.691
  640   2HD2  LEU  82          HD22      LEU  82   6.420   8.818   1.859
  641   3HD2  LEU  82          HD23      LEU  82   5.410   9.467   3.151
  642    H    ALA  83           HN       ALA  83   4.545   7.113   6.941
  643    HA   ALA  83           HA       ALA  83   7.319   6.727   7.160
  644   1HB   ALA  83          HB1       ALA  83   7.068   7.157   9.542
  645   2HB   ALA  83          HB2       ALA  83   5.329   6.886   9.423
  646   3HB   ALA  83          HB3       ALA  83   6.063   8.273   8.614
  647    H    GLU  84           HN       GLU  84   4.590   4.732   7.922
  648    HA   GLU  84           HA       GLU  84   6.046   2.553   8.999
  649   1HB   GLU  84          HB2       GLU  84   3.316   3.166   8.325
  650   2HB   GLU  84          HB1       GLU  84   3.740   1.539   7.805
  651   1HG   GLU  84          HG2       GLU  84   2.813   1.438   9.995
  652   2HG   GLU  84          HG1       GLU  84   4.535   1.077  10.104
  653    H    TYR  85           HN       TYR  85   4.977   3.405   5.693
  654    HA   TYR  85           HA       TYR  85   5.950   0.960   4.637
  655   1HB   TYR  85          HB2       TYR  85   4.589   3.350   3.557
  656   2HB   TYR  85          HB1       TYR  85   5.363   2.214   2.487
  657    HD1  TYR  85           HD1      TYR  85   4.400   0.650   5.323
  658    HD2  TYR  85           HD2      TYR  85   2.988   2.061   1.731
  659    HE1  TYR  85           HE1      TYR  85   2.678  -1.006   5.432
  660    HE2  TYR  85           HE2      TYR  85   1.187   0.431   1.810
  661    HH   TYR  85           HH       TYR  85   0.649  -1.711   2.784
  Start of MODEL   11
    1   1H    MET   1          HT1       MET   1  17.859 -10.764   3.454
    2   2H    MET   1          HT2       MET   1  16.977 -11.213   2.081
    3   3H    MET   1          HT3       MET   1  18.658 -11.426   2.113
    4    HA   MET   1           HA       MET   1  17.482 -13.513   2.421
    5   1HB   MET   1          HB2       MET   1  18.962 -12.529   4.872
    6   2HB   MET   1          HB1       MET   1  18.629 -14.217   4.507
    7   1HG   MET   1          HG2       MET   1  20.318 -12.344   2.866
    8   2HG   MET   1          HG1       MET   1  20.904 -13.621   3.928
    9   1HE   MET   1          HE1       MET   1  21.691 -14.917   0.287
   10   2HE   MET   1          HE2       MET   1  22.380 -14.523   1.860
   11   3HE   MET   1          HE3       MET   1  21.717 -13.244   0.842
   12    H    VAL   2           HN       VAL   2  17.379 -12.711   5.803
   13    HA   VAL   2           HA       VAL   2  14.574 -13.385   5.878
   14    HB   VAL   2           HB       VAL   2  16.395 -12.556   8.148
   15   1HG1  VAL   2          HG11      VAL   2  14.102 -12.069   8.714
   16   2HG1  VAL   2          HG12      VAL   2  14.625 -13.503   9.597
   17   3HG1  VAL   2          HG13      VAL   2  13.592 -13.669   8.178
   18   1HG2  VAL   2          HG21      VAL   2  17.090 -14.650   7.149
   19   2HG2  VAL   2          HG22      VAL   2  15.442 -15.272   7.246
   20   3HG2  VAL   2          HG23      VAL   2  16.351 -14.950   8.723
   21    HA   PRO   3           HA       PRO   3  14.069  -8.757   7.012
   22   1HB   PRO   3          HB2       PRO   3  16.229  -7.126   7.009
   23   2HB   PRO   3          HB1       PRO   3  15.720  -8.015   8.448
   24   1HG   PRO   3          HG2       PRO   3  17.910  -8.637   6.511
   25   2HG   PRO   3          HG1       PRO   3  17.896  -8.793   8.278
   26   1HD   PRO   3          HD2       PRO   3  17.530 -10.893   6.561
   27   2HD   PRO   3          HD1       PRO   3  16.876 -10.842   8.207
   28    H    LYS   4           HN       LYS   4  13.317  -9.314   4.833
   29    HA   LYS   4           HA       LYS   4  14.832  -8.857   2.517
   30   1HB   LYS   4          HB2       LYS   4  11.843  -8.945   2.870
   31   2HB   LYS   4          HB1       LYS   4  12.686  -9.044   1.326
   32   1HG   LYS   4          HG2       LYS   4  13.653 -11.131   1.879
   33   2HG   LYS   4          HG1       LYS   4  13.165 -10.988   3.567
   34   1HD   LYS   4          HD2       LYS   4  10.805 -11.127   2.870
   35   2HD   LYS   4          HD1       LYS   4  11.329 -11.329   1.194
   36   1HE   LYS   4          HE2       LYS   4  12.418 -13.395   1.714
   37   2HE   LYS   4          HE1       LYS   4  12.156 -13.159   3.441
   38   1HZ   LYS   4          HZ1       LYS   4   9.998 -13.545   1.429
   39   2HZ   LYS   4          HZ2       LYS   4   9.798 -13.412   3.110
   40   3HZ   LYS   4          HZ3       LYS   4  10.605 -14.749   2.458
   41    H    GLY   5           HN       GLY   5  11.945  -7.039   3.323
   42   1HA   GLY   5          HA2       GLY   5  12.105  -4.686   3.922
   43   2HA   GLY   5          HA1       GLY   5  13.470  -4.561   2.825
   44    H    LYS   6           HN       LYS   6  11.735  -6.334   1.020
   45    HA   LYS   6           HA       LYS   6  10.665  -4.030  -0.419
   46   1HB   LYS   6          HB2       LYS   6  10.775  -6.095  -2.207
   47   2HB   LYS   6          HB1       LYS   6  12.073  -4.928  -1.956
   48   1HG   LYS   6          HG2       LYS   6  13.049  -7.091  -1.849
   49   2HG   LYS   6          HG1       LYS   6  12.955  -6.448  -0.205
   50   1HD   LYS   6          HD2       LYS   6  12.330  -8.829  -0.319
   51   2HD   LYS   6          HD1       LYS   6  11.020  -7.803   0.301
   52   1HE   LYS   6          HE2       LYS   6  10.167  -9.466  -1.281
   53   2HE   LYS   6          HE1       LYS   6   9.984  -7.841  -1.939
   54   1HZ   LYS   6          HZ1       LYS   6  10.809  -9.549  -3.532
   55   2HZ   LYS   6          HZ2       LYS   6  12.246  -9.631  -2.633
   56   3HZ   LYS   6          HZ3       LYS   6  11.804  -8.182  -3.396
   57    H    TYR   7           HN       TYR   7   9.016  -4.709   1.371
   58    HA   TYR   7           HA       TYR   7   7.301  -6.807   1.236
   59   1HB   TYR   7          HB2       TYR   7   6.391  -4.038   1.913
   60   2HB   TYR   7          HB1       TYR   7   6.004  -5.566   2.710
   61    HD1  TYR   7           HD1      TYR   7   8.411  -6.828   3.205
   62    HD2  TYR   7           HD2      TYR   7   7.615  -2.672   3.283
   63    HE1  TYR   7           HE1      TYR   7  10.280  -6.532   4.693
   64    HE2  TYR   7           HE2      TYR   7   9.471  -2.325   4.826
   65    HH   TYR   7           HH       TYR   7  11.818  -4.695   5.444
   66    HA   PRO   8           HA       PRO   8   4.997  -5.808  -2.612
   67   1HB   PRO   8          HB2       PRO   8   3.780  -8.412  -1.889
   68   2HB   PRO   8          HB1       PRO   8   4.455  -7.876  -3.432
   69   1HG   PRO   8          HG2       PRO   8   5.735  -9.651  -1.880
   70   2HG   PRO   8          HG1       PRO   8   6.616  -8.444  -2.836
   71   1HD   PRO   8          HD2       PRO   8   6.014  -8.479   0.092
   72   2HD   PRO   8          HD1       PRO   8   7.477  -7.934  -0.752
   73    H    ILE   9           HN       ILE   9   3.651  -4.230  -1.916
   74    HA   ILE   9           HA       ILE   9   1.845  -4.657   0.276
   75    HB   ILE   9           HB       ILE   9   2.336  -2.481   0.427
   76   1HG1  ILE   9          HG12      ILE   9   0.114  -2.529  -1.597
   77   2HG1  ILE   9          HG11      ILE   9   0.048  -2.155   0.121
   78   1HG2  ILE   9          HG21      ILE   9   3.086  -1.064  -1.430
   79   2HG2  ILE   9          HG22      ILE   9   2.769  -2.389  -2.554
   80   3HG2  ILE   9          HG23      ILE   9   4.004  -2.566  -1.305
   81   1HD1  ILE   9          HD11      ILE   9   1.294  -0.058  -0.366
   82   2HD1  ILE   9          HD12      ILE   9  -0.304  -0.148  -1.105
   83   3HD1  ILE   9          HD13      ILE   9   1.137  -0.427  -2.087
   84    H    SER  10           HN       SER  10   0.078  -5.674   0.100
   85    HA   SER  10           HA       SER  10  -1.224  -6.061  -2.465
   86   1HB   SER  10          HB2       SER  10  -1.877  -7.312   0.205
   87   2HB   SER  10          HB1       SER  10  -2.340  -7.890  -1.402
   88    HG   SER  10           HG       SER  10  -0.103  -8.214  -1.830
   89    H    VAL  11           HN       VAL  11  -2.567  -4.496  -2.987
   90    HA   VAL  11           HA       VAL  11  -4.482  -3.516  -0.961
   91    HB   VAL  11           HB       VAL  11  -4.190  -1.856  -3.360
   92   1HG1  VAL  11          HG11      VAL  11  -4.156  -0.056  -1.691
   93   2HG1  VAL  11          HG12      VAL  11  -4.083  -1.264  -0.408
   94   3HG1  VAL  11          HG13      VAL  11  -5.504  -1.167  -1.448
   95   1HG2  VAL  11          HG21      VAL  11  -1.854  -2.164  -1.484
   96   2HG2  VAL  11          HG22      VAL  11  -2.051  -0.836  -2.635
   97   3HG2  VAL  11          HG23      VAL  11  -1.883  -2.495  -3.222
   98    H    CYS  12           HN       CYS  12  -6.586  -4.146  -1.394
   99    HA   CYS  12           HA       CYS  12  -7.240  -5.480  -3.806
  100   1HB   CYS  12          HB2       CYS  12  -8.517  -5.989  -1.826
  101   2HB   CYS  12          HB1       CYS  12  -9.017  -4.307  -1.661
  102    H    MET  13           HN       MET  13  -7.434  -4.583  -5.714
  103    HA   MET  13           HA       MET  13  -9.010  -2.109  -5.919
  104   1HB   MET  13          HB2       MET  13  -6.556  -1.943  -6.631
  105   2HB   MET  13          HB1       MET  13  -6.966  -3.030  -7.950
  106   1HG   MET  13          HG2       MET  13  -8.518  -1.436  -8.854
  107   2HG   MET  13          HG1       MET  13  -8.288  -0.371  -7.468
  108   1HE   MET  13          HE1       MET  13  -5.020  -1.228 -10.623
  109   2HE   MET  13          HE2       MET  13  -6.635  -1.939 -10.661
  110   3HE   MET  13          HE3       MET  13  -5.494  -2.404  -9.399
  111    H    GLY  14           HN       GLY  14  -9.699  -4.985  -5.769
  112   1HA   GLY  14          HA2       GLY  14 -10.409  -5.961  -8.341
  113   2HA   GLY  14          HA1       GLY  14 -11.019  -6.556  -6.803
  114    H    THR  15           HN       THR  15 -12.912  -6.703  -8.489
  115    HA   THR  15           HA       THR  15 -14.068  -4.355  -9.498
  116    HB   THR  15           HB       THR  15 -15.672  -6.838  -8.962
  117    HG1  THR  15           HG1      THR  15 -14.132  -7.891  -9.986
  118   1HG2  THR  15          HG21      THR  15 -16.826  -4.968  -9.994
  119   2HG2  THR  15          HG22      THR  15 -16.617  -6.267 -11.171
  120   3HG2  THR  15          HG23      THR  15 -15.573  -4.846 -11.228
  121    H    ALA  16           HN       ALA  16 -14.818  -6.233  -6.587
  122    HA   ALA  16           HA       ALA  16 -17.184  -4.785  -5.972
  123   1HB   ALA  16          HB1       ALA  16 -15.490  -6.503  -4.169
  124   2HB   ALA  16          HB2       ALA  16 -16.811  -7.072  -5.190
  125   3HB   ALA  16          HB3       ALA  16 -17.141  -5.973  -3.853
  126    H    CYS  17           HN       CYS  17 -13.954  -4.764  -4.463
  127    HA   CYS  17           HA       CYS  17 -14.627  -2.685  -2.663
  128   1HB   CYS  17          HB2       CYS  17 -11.969  -3.782  -3.525
  129   2HB   CYS  17          HB1       CYS  17 -12.183  -2.650  -2.218
  130    H    PHE  18           HN       PHE  18 -13.063  -2.690  -5.836
  131    HA   PHE  18           HA       PHE  18 -12.019  -0.071  -5.765
  132   1HB   PHE  18          HB2       PHE  18 -11.166  -1.586  -7.387
  133   2HB   PHE  18          HB1       PHE  18 -12.764  -1.876  -8.060
  134    HD1  PHE  18           HD1      PHE  18 -10.097   0.667  -7.707
  135    HD2  PHE  18           HD2      PHE  18 -13.597  -0.543  -9.806
  136    HE1  PHE  18           HE1      PHE  18  -9.697   2.429  -9.378
  137    HE2  PHE  18           HE2      PHE  18 -13.203   1.215 -11.479
  138    HZ   PHE  18           HZ       PHE  18 -11.253   2.685 -11.287
  139    H    VAL  19           HN       VAL  19 -15.235  -1.212  -6.432
  140    HA   VAL  19           HA       VAL  19 -15.986   0.856  -8.224
  141    HB   VAL  19           HB       VAL  19 -17.071  -1.428  -8.027
  142   1HG1  VAL  19          HG11      VAL  19 -18.503  -0.111  -5.727
  143   2HG1  VAL  19          HG12      VAL  19 -17.427  -1.504  -5.637
  144   3HG1  VAL  19          HG13      VAL  19 -18.971  -1.635  -6.482
  145   1HG2  VAL  19          HG21      VAL  19 -17.989   0.328  -9.434
  146   2HG2  VAL  19          HG22      VAL  19 -18.877   0.985  -8.060
  147   3HG2  VAL  19          HG23      VAL  19 -19.280  -0.611  -8.686
  148    H    LYS  20           HN       LYS  20 -15.764   0.703  -4.828
  149    HA   LYS  20           HA       LYS  20 -17.767   2.707  -4.267
  150   1HB   LYS  20          HB2       LYS  20 -15.651   1.554  -2.437
  151   2HB   LYS  20          HB1       LYS  20 -17.085   2.449  -1.952
  152   1HG   LYS  20          HG2       LYS  20 -18.499   0.664  -2.813
  153   2HG   LYS  20          HG1       LYS  20 -17.065  -0.239  -3.305
  154   1HD   LYS  20          HD2       LYS  20 -16.337  -0.345  -0.969
  155   2HD   LYS  20          HD1       LYS  20 -17.775   0.555  -0.481
  156   1HE   LYS  20          HE2       LYS  20 -18.159  -1.779  -0.088
  157   2HE   LYS  20          HE1       LYS  20 -19.169  -1.259  -1.435
  158   1HZ   LYS  20          HZ1       LYS  20 -17.320  -2.131  -2.906
  159   2HZ   LYS  20          HZ2       LYS  20 -18.254  -3.285  -2.098
  160   3HZ   LYS  20          HZ3       LYS  20 -16.704  -2.899  -1.524
  161    H    GLY  21           HN       GLY  21 -15.120   3.121  -5.873
  162   1HA   GLY  21          HA2       GLY  21 -14.093   5.155  -6.380
  163   2HA   GLY  21          HA1       GLY  21 -14.710   5.817  -4.867
  164    H    ALA  22           HN       ALA  22 -12.963   2.807  -5.120
  165    HA   ALA  22           HA       ALA  22 -11.309   3.589  -2.937
  166   1HB   ALA  22          HB1       ALA  22 -10.361   1.360  -3.096
  167   2HB   ALA  22          HB2       ALA  22 -11.137   1.124  -4.663
  168   3HB   ALA  22          HB3       ALA  22 -12.119   1.294  -3.208
  169    H    ASP  23           HN       ASP  23 -10.963   3.774  -6.361
  170    HA   ASP  23           HA       ASP  23  -8.207   3.470  -6.612
  171   1HB   ASP  23          HB2       ASP  23  -9.483   3.594  -8.625
  172   2HB   ASP  23          HB1       ASP  23 -10.103   5.194  -8.207
  173    H    LYS  24           HN       LYS  24 -10.090   6.350  -5.702
  174    HA   LYS  24           HA       LYS  24  -7.886   8.090  -6.088
  175   1HB   LYS  24          HB2       LYS  24 -10.555   8.374  -4.787
  176   2HB   LYS  24          HB1       LYS  24  -9.329   9.596  -4.472
  177   1HG   LYS  24          HG2       LYS  24 -10.721  10.296  -6.311
  178   2HG   LYS  24          HG1       LYS  24  -9.091   9.956  -6.896
  179   1HD   LYS  24          HD2       LYS  24 -10.094   7.578  -7.373
  180   2HD   LYS  24          HD1       LYS  24 -11.630   8.447  -7.347
  181   1HE   LYS  24          HE2       LYS  24 -10.891   8.388  -9.608
  182   2HE   LYS  24          HE1       LYS  24 -10.654  10.033  -9.022
  183   1HZ   LYS  24          HZ1       LYS  24  -8.562   7.937  -9.282
  184   2HZ   LYS  24          HZ2       LYS  24  -8.308   9.484  -8.629
  185   3HZ   LYS  24          HZ3       LYS  24  -8.733   9.315 -10.263
  186    H    VAL  25           HN       VAL  25  -9.037   6.335  -3.231
  187    HA   VAL  25           HA       VAL  25  -7.190   7.609  -1.487
  188    HB   VAL  25           HB       VAL  25  -7.653   5.447  -0.122
  189   1HG1  VAL  25          HG11      VAL  25  -9.775   7.500  -0.685
  190   2HG1  VAL  25          HG12      VAL  25  -8.459   7.656   0.476
  191   3HG1  VAL  25          HG13      VAL  25  -9.727   6.459   0.736
  192   1HG2  VAL  25          HG21      VAL  25  -9.968   5.381  -2.022
  193   2HG2  VAL  25          HG22      VAL  25  -9.774   4.394  -0.573
  194   3HG2  VAL  25          HG23      VAL  25  -8.678   4.181  -1.940
  195    H    VAL  26           HN       VAL  26  -7.193   4.545  -3.282
  196    HA   VAL  26           HA       VAL  26  -4.603   3.809  -2.362
  197    HB   VAL  26           HB       VAL  26  -4.543   2.124  -4.085
  198   1HG1  VAL  26          HG11      VAL  26  -7.302   2.389  -2.902
  199   2HG1  VAL  26          HG12      VAL  26  -5.900   1.638  -2.139
  200   3HG1  VAL  26          HG13      VAL  26  -6.616   0.909  -3.577
  201   1HG2  VAL  26          HG21      VAL  26  -6.971   3.486  -5.229
  202   2HG2  VAL  26          HG22      VAL  26  -6.333   1.929  -5.765
  203   3HG2  VAL  26          HG23      VAL  26  -5.371   3.396  -5.965
  204    H    HIS  27           HN       HIS  27  -5.759   5.961  -4.844
  205    HA   HIS  27           HA       HIS  27  -3.432   6.101  -6.402
  206   1HB   HIS  27          HB2       HIS  27  -5.652   7.141  -7.003
  207   2HB   HIS  27          HB1       HIS  27  -5.274   8.423  -5.848
  208    HD1  HIS  27           HD1      HIS  27  -3.126   9.896  -6.415
  209    HD2  HIS  27           HD2      HIS  27  -4.476   7.423  -9.475
  210    HE1  HIS  27           HE1      HIS  27  -1.922  10.652  -8.469
  211    HE2  HIS  27           HE2      HIS  27  -2.612   9.040 -10.275
  212    H    ALA  28           HN       ALA  28  -4.456   7.846  -3.586
  213    HA   ALA  28           HA       ALA  28  -2.229   9.488  -3.218
  214   1HB   ALA  28          HB1       ALA  28  -4.273   9.727  -1.904
  215   2HB   ALA  28          HB2       ALA  28  -2.868   9.557  -0.852
  216   3HB   ALA  28          HB3       ALA  28  -3.951   8.188  -1.106
  217    H    PHE  29           HN       PHE  29  -2.854   6.168  -2.290
  218    HA   PHE  29           HA       PHE  29  -0.464   5.594  -0.922
  219   1HB   PHE  29          HB2       PHE  29  -2.745   4.229  -1.551
  220   2HB   PHE  29          HB1       PHE  29  -1.576   3.460  -2.625
  221    HD1  PHE  29           HD1      PHE  29   0.834   3.730  -0.881
  222    HD2  PHE  29           HD2      PHE  29  -3.138   2.482  -0.046
  223    HE1  PHE  29           HE1      PHE  29   1.658   2.367   0.969
  224    HE2  PHE  29           HE2      PHE  29  -2.315   1.109   1.813
  225    HZ   PHE  29           HZ       PHE  29   0.090   1.046   2.326
  226    H    LYS  30           HN       LYS  30  -1.351   5.237  -4.327
  227    HA   LYS  30           HA       LYS  30   1.017   4.209  -5.305
  228   1HB   LYS  30          HB2       LYS  30  -0.894   6.120  -6.651
  229   2HB   LYS  30          HB1       LYS  30   0.338   5.181  -7.489
  230   1HG   LYS  30          HG2       LYS  30  -0.741   3.132  -6.971
  231   2HG   LYS  30          HG1       LYS  30  -1.824   3.915  -5.824
  232   1HD   LYS  30          HD2       LYS  30  -2.830   5.178  -7.726
  233   2HD   LYS  30          HD1       LYS  30  -1.820   4.235  -8.828
  234   1HE   LYS  30          HE2       LYS  30  -2.869   2.175  -8.068
  235   2HE   LYS  30          HE1       LYS  30  -3.825   3.070  -6.891
  236   1HZ   LYS  30          HZ1       LYS  30  -4.028   3.365  -9.847
  237   2HZ   LYS  30          HZ2       LYS  30  -4.985   4.170  -8.700
  238   3HZ   LYS  30          HZ3       LYS  30  -5.103   2.497  -8.869
  239    H    GLU  31           HN       GLU  31   0.157   7.497  -4.621
  240    HA   GLU  31           HA       GLU  31   2.656   8.571  -5.629
  241   1HB   GLU  31          HB2       GLU  31   0.471   9.949  -4.077
  242   2HB   GLU  31          HB1       GLU  31   1.776  10.734  -4.950
  243   1HG   GLU  31          HG2       GLU  31   0.891   9.994  -7.045
  244   2HG   GLU  31          HG1       GLU  31  -0.358   9.053  -6.223
  245    H    GLN  32           HN       GLN  32   1.328   7.650  -2.604
  246    HA   GLN  32           HA       GLN  32   3.176   8.957  -0.961
  247   1HB   GLN  32          HB2       GLN  32   2.103   7.949   0.746
  248   2HB   GLN  32          HB1       GLN  32   0.879   7.697  -0.486
  249   1HG   GLN  32          HG2       GLN  32   1.200   5.498  -0.552
  250   2HG   GLN  32          HG1       GLN  32   2.941   5.657  -0.357
  251   1HE2  GLN  32          HE21      GLN  32   0.638   7.106   1.763
  252   2HE2  GLN  32          HE22      GLN  32   0.950   6.110   3.144
  253    H    LEU  33           HN       LEU  33   3.258   6.077  -2.923
  254    HA   LEU  33           HA       LEU  33   5.475   4.791  -1.875
  255   1HB   LEU  33          HB2       LEU  33   4.677   3.684  -3.736
  256   2HB   LEU  33          HB1       LEU  33   4.433   5.162  -4.645
  257    HG   LEU  33           HG       LEU  33   6.846   5.315  -5.054
  258   1HD1  LEU  33          HD11      LEU  33   7.571   4.100  -2.999
  259   2HD1  LEU  33          HD12      LEU  33   8.396   3.601  -4.482
  260   3HD1  LEU  33          HD13      LEU  33   7.107   2.600  -3.800
  261   1HD2  LEU  33          HD21      LEU  33   5.688   2.650  -5.777
  262   2HD2  LEU  33          HD22      LEU  33   7.057   3.434  -6.564
  263   3HD2  LEU  33          HD23      LEU  33   5.449   4.161  -6.658
  264    H    LYS  34           HN       LYS  34   5.342   7.381  -4.247
  265    HA   LYS  34           HA       LYS  34   6.473   9.265  -4.574
  266   1HB   LYS  34          HB2       LYS  34   6.958  10.537  -2.710
  267   2HB   LYS  34          HB1       LYS  34   5.827   9.336  -2.106
  268   1HG   LYS  34          HG2       LYS  34   7.384   9.370  -0.430
  269   2HG   LYS  34          HG1       LYS  34   7.982   8.038  -1.421
  270   1HD   LYS  34          HD2       LYS  34   9.526   9.659  -2.531
  271   2HD   LYS  34          HD1       LYS  34   8.999  10.880  -1.370
  272   1HE   LYS  34          HE2       LYS  34  10.348   8.259  -0.729
  273   2HE   LYS  34          HE1       LYS  34  11.092   9.856  -0.666
  274   1HZ   LYS  34          HZ1       LYS  34   8.876   8.877   1.051
  275   2HZ   LYS  34          HZ2       LYS  34   9.489  10.455   1.077
  276   3HZ   LYS  34          HZ3       LYS  34  10.477   9.154   1.527
  277    H    ILE  35           HN       ILE  35   8.300   6.778  -3.225
  278    HA   ILE  35           HA       ILE  35  10.150   5.724  -3.813
  279    HB   ILE  35           HB       ILE  35  10.506   6.720  -6.459
  280   1HG1  ILE  35          HG12      ILE  35   7.802   5.561  -5.989
  281   2HG1  ILE  35          HG11      ILE  35   8.024   7.307  -6.030
  282   1HG2  ILE  35          HG21      ILE  35  10.058   4.373  -6.975
  283   2HG2  ILE  35          HG22      ILE  35   9.525   4.142  -5.303
  284   3HG2  ILE  35          HG23      ILE  35  11.204   4.566  -5.648
  285   1HD1  ILE  35          HD11      ILE  35   8.617   5.358  -8.243
  286   2HD1  ILE  35          HD12      ILE  35   8.934   7.091  -8.305
  287   3HD1  ILE  35          HD13      ILE  35   7.277   6.502  -8.172
  288    H    ASP  36           HN       ASP  36  12.173   6.082  -5.401
  289    HA   ASP  36           HA       ASP  36  13.583   8.537  -4.914
  290   1HB   ASP  36          HB2       ASP  36  13.656   7.064  -2.755
  291   2HB   ASP  36          HB1       ASP  36  14.740   6.046  -3.684
  292    H    ILE  37           HN       ILE  37  13.592   5.141  -5.626
  293    HA   ILE  37           HA       ILE  37  14.907   5.448  -8.143
  294    HB   ILE  37           HB       ILE  37  16.622   3.723  -7.530
  295   1HG1  ILE  37          HG12      ILE  37  15.631   4.566  -4.858
  296   2HG1  ILE  37          HG11      ILE  37  15.695   2.939  -5.524
  297   1HG2  ILE  37          HG21      ILE  37  17.303   6.008  -7.964
  298   2HG2  ILE  37          HG22      ILE  37  18.232   5.334  -6.624
  299   3HG2  ILE  37          HG23      ILE  37  16.905   6.451  -6.305
  300   1HD1  ILE  37          HD11      ILE  37  18.069   4.613  -4.703
  301   2HD1  ILE  37          HD12      ILE  37  18.146   2.997  -5.405
  302   3HD1  ILE  37          HD13      ILE  37  17.402   3.236  -3.823
  303    H    GLY  38           HN       GLY  38  12.724   3.898  -6.299
  304   1HA   GLY  38          HA2       GLY  38  12.339   1.705  -7.999
  305   2HA   GLY  38          HA1       GLY  38  13.273   1.189  -6.599
  306    H    ASP  39           HN       ASP  39  12.359   2.342  -4.540
  307    HA   ASP  39           HA       ASP  39   9.525   2.494  -4.296
  308   1HB   ASP  39          HB2       ASP  39  10.891   0.024  -3.306
  309   2HB   ASP  39          HB1       ASP  39   9.350   0.602  -2.713
  310    H    VAL  40           HN       VAL  40   9.347   4.008  -3.003
  311    HA   VAL  40           HA       VAL  40   9.204   5.161  -1.058
  312    HB   VAL  40           HB       VAL  40  10.299   2.603  -0.094
  313   1HG1  VAL  40          HG11      VAL  40  11.915   4.075   0.978
  314   2HG1  VAL  40          HG12      VAL  40  10.765   3.459   2.168
  315   3HG1  VAL  40          HG13      VAL  40  10.609   5.106   1.560
  316   1HG2  VAL  40          HG21      VAL  40   7.980   3.137  -0.075
  317   2HG2  VAL  40          HG22      VAL  40   8.295   4.505   0.989
  318   3HG2  VAL  40          HG23      VAL  40   8.596   2.857   1.548
  319    H    THR  41           HN       THR  41  12.214   3.611  -1.232
  320    HA   THR  41           HA       THR  41  13.788   5.886  -1.671
  321    HB   THR  41           HB       THR  41  13.902   4.920   1.186
  322    HG1  THR  41           HG1      THR  41  12.423   6.868   0.029
  323   1HG2  THR  41          HG21      THR  41  15.541   6.712   1.502
  324   2HG2  THR  41          HG22      THR  41  15.455   7.096  -0.216
  325   3HG2  THR  41          HG23      THR  41  16.095   5.539   0.308
  326    HA   PRO  42           HA       PRO  42  16.652   2.386  -0.830
  327   1HB   PRO  42          HB2       PRO  42  15.926   0.077   0.356
  328   2HB   PRO  42          HB1       PRO  42  16.376   1.516   1.283
  329   1HG   PRO  42          HG2       PRO  42  13.654   0.481   0.587
  330   2HG   PRO  42          HG1       PRO  42  14.242   1.144   2.125
  331   1HD   PRO  42          HD2       PRO  42  12.796   2.596   0.321
  332   2HD   PRO  42          HD1       PRO  42  13.974   3.313   1.433
  333    H    ASP  43           HN       ASP  43  13.797   2.097  -2.483
  334    HA   ASP  43           HA       ASP  43  13.702   1.443  -4.690
  335   1HB   ASP  43          HB2       ASP  43  16.123   1.409  -4.962
  336   2HB   ASP  43          HB1       ASP  43  16.241  -0.100  -4.068
  337    H    GLY  44           HN       GLY  44  13.070   0.147  -1.971
  338   1HA   GLY  44          HA2       GLY  44  11.204  -1.577  -2.854
  339   2HA   GLY  44          HA1       GLY  44  12.627  -2.611  -2.649
  340    H    ARG  45           HN       ARG  45  10.647  -0.237  -1.101
  341    HA   ARG  45           HA       ARG  45  10.599  -1.867   1.352
  342   1HB   ARG  45          HB2       ARG  45  11.375   0.449   1.608
  343   2HB   ARG  45          HB1       ARG  45   9.915   1.021   0.832
  344   1HG   ARG  45          HG2       ARG  45   8.681   0.787   2.712
  345   2HG   ARG  45          HG1       ARG  45   9.535  -0.672   3.219
  346   1HD   ARG  45          HD2       ARG  45  10.710   2.098   3.360
  347   2HD   ARG  45          HD1       ARG  45   9.875   1.318   4.703
  348    HE   ARG  45           HE       ARG  45  12.316   0.207   3.471
  349   1HH1  ARG  45          HH11      ARG  45  10.356   1.023   6.247
  350   2HH1  ARG  45          HH12      ARG  45  11.485   0.360   7.399
  351   1HH2  ARG  45          HH21      ARG  45  13.813  -0.684   4.978
  352   2HH2  ARG  45          HH22      ARG  45  13.445  -0.620   6.677
  353    H    PHE  46           HN       PHE  46   9.369  -1.426  -1.432
  354    HA   PHE  46           HA       PHE  46   6.536  -1.663  -0.773
  355   1HB   PHE  46          HB2       PHE  46   8.078   0.286  -2.360
  356   2HB   PHE  46          HB1       PHE  46   6.696  -0.394  -3.214
  357    HD1  PHE  46           HD1      PHE  46   7.840   2.231  -1.569
  358    HD2  PHE  46           HD2      PHE  46   4.462  -0.319  -1.503
  359    HE1  PHE  46           HE1      PHE  46   6.468   4.098  -0.663
  360    HE2  PHE  46           HE2      PHE  46   3.084   1.480  -0.542
  361    HZ   PHE  46           HZ       PHE  46   4.084   3.695  -0.120
  362    H    SER  47           HN       SER  47   5.295  -2.559  -2.568
  363    HA   SER  47           HA       SER  47   6.239  -3.122  -5.103
  364   1HB   SER  47          HB2       SER  47   7.419  -4.977  -3.601
  365   2HB   SER  47          HB1       SER  47   5.839  -5.753  -3.717
  366    HG   SER  47           HG       SER  47   7.357  -4.837  -5.945
  367    H    ILE  48           HN       ILE  48   4.291  -1.971  -5.216
  368    HA   ILE  48           HA       ILE  48   1.946  -2.776  -3.854
  369    HB   ILE  48           HB       ILE  48   0.836  -1.001  -5.234
  370   1HG1  ILE  48          HG12      ILE  48   2.903   0.436  -6.305
  371   2HG1  ILE  48          HG11      ILE  48   3.367  -1.215  -6.707
  372   1HG2  ILE  48          HG21      ILE  48   3.411  -0.206  -3.892
  373   2HG2  ILE  48          HG22      ILE  48   1.856  -0.455  -3.100
  374   3HG2  ILE  48          HG23      ILE  48   2.059   0.867  -4.248
  375   1HD1  ILE  48          HD11      ILE  48   0.735   0.075  -7.349
  376   2HD1  ILE  48          HD12      ILE  48   1.221  -1.569  -7.764
  377   3HD1  ILE  48          HD13      ILE  48   2.066  -0.193  -8.479
  378    H    ASP  49           HN       ASP  49   0.754  -4.541  -4.337
  379    HA   ASP  49           HA       ASP  49  -0.630  -4.421  -6.844
  380   1HB   ASP  49          HB2       ASP  49   1.319  -5.760  -7.532
  381   2HB   ASP  49          HB1       ASP  49   0.914  -6.948  -6.301
  382    H    THR  50           HN       THR  50  -2.501  -5.211  -6.811
  383    HA   THR  50           HA       THR  50  -4.131  -5.828  -4.773
  384    HB   THR  50           HB       THR  50  -4.360  -7.013  -7.534
  385    HG1  THR  50           HG1      THR  50  -4.437  -4.979  -8.109
  386   1HG2  THR  50          HG21      THR  50  -6.012  -7.898  -5.971
  387   2HG2  THR  50          HG22      THR  50  -6.778  -6.813  -7.131
  388   3HG2  THR  50          HG23      THR  50  -6.455  -6.261  -5.488
  389    H    LEU  51           HN       LEU  51  -2.043  -8.324  -6.325
  390    HA   LEU  51           HA       LEU  51  -3.989 -10.271  -6.472
  391   1HB   LEU  51          HB2       LEU  51  -1.831 -10.285  -7.633
  392   2HB   LEU  51          HB1       LEU  51  -1.035 -10.706  -6.129
  393    HG   LEU  51           HG       LEU  51  -2.413 -12.814  -6.101
  394   1HD1  LEU  51          HD11      LEU  51  -3.047 -11.928  -8.912
  395   2HD1  LEU  51          HD12      LEU  51  -4.194 -12.134  -7.588
  396   3HD1  LEU  51          HD13      LEU  51  -3.358 -13.536  -8.257
  397   1HD2  LEU  51          HD21      LEU  51  -0.067 -12.762  -6.793
  398   2HD2  LEU  51          HD22      LEU  51  -0.565 -12.416  -8.450
  399   3HD2  LEU  51          HD23      LEU  51  -0.987 -13.957  -7.703
  400    H    ARG  52           HN       ARG  52  -1.694  -9.962  -3.712
  401    HA   ARG  52           HA       ARG  52  -2.597 -12.292  -2.380
  402   1HB   ARG  52          HB2       ARG  52  -1.227  -9.791  -1.450
  403   2HB   ARG  52          HB1       ARG  52  -1.753 -11.005  -0.295
  404   1HG   ARG  52          HG2       ARG  52  -0.011 -11.708  -2.630
  405   2HG   ARG  52          HG1       ARG  52   0.658 -11.098  -1.114
  406   1HD   ARG  52          HD2       ARG  52  -1.134 -13.512  -1.356
  407   2HD   ARG  52          HD1       ARG  52   0.625 -13.573  -1.250
  408    HE   ARG  52           HE       ARG  52   0.438 -12.596   0.981
  409   1HH1  ARG  52          HH11      ARG  52  -2.440 -14.043  -0.420
  410   2HH1  ARG  52          HH12      ARG  52  -3.244 -14.221   1.111
  411   1HH2  ARG  52          HH21      ARG  52  -0.581 -12.879   2.984
  412   2HH2  ARG  52          HH22      ARG  52  -2.180 -13.574   3.060
  413    H    CYS  53           HN       CYS  53  -3.377  -8.948  -1.875
  414    HA   CYS  53           HA       CYS  53  -5.463  -9.240  -0.027
  415   1HB   CYS  53          HB2       CYS  53  -4.096  -7.188  -0.379
  416   2HB   CYS  53          HB1       CYS  53  -4.949  -6.930  -1.895
  417    H    VAL  54           HN       VAL  54  -7.769  -8.086  -0.758
  418    HA   VAL  54           HA       VAL  54  -9.791  -8.846  -1.482
  419    HB   VAL  54           HB       VAL  54  -8.419 -10.312  -3.755
  420   1HG1  VAL  54          HG11      VAL  54 -11.232  -9.271  -3.438
  421   2HG1  VAL  54          HG12      VAL  54 -10.730 -10.960  -3.389
  422   3HG1  VAL  54          HG13      VAL  54 -10.582 -10.040  -4.887
  423   1HG2  VAL  54          HG21      VAL  54  -9.441  -7.475  -3.754
  424   2HG2  VAL  54          HG22      VAL  54  -8.847  -8.361  -5.159
  425   3HG2  VAL  54          HG23      VAL  54  -7.749  -7.967  -3.836
  426    H    GLY  55           HN       GLY  55  -7.965 -10.119   0.283
  427   1HA   GLY  55          HA2       GLY  55  -8.892 -12.905   0.143
  428   2HA   GLY  55          HA1       GLY  55  -7.412 -12.390   0.939
  429    H    GLY  56           HN       GLY  56 -10.932 -11.546   1.105
  430   1HA   GLY  56          HA2       GLY  56 -12.351 -11.632   2.914
  431   2HA   GLY  56          HA1       GLY  56 -11.224 -12.770   3.618
  432    H    CYS  57           HN       CYS  57 -11.443  -9.157   3.129
  433    HA   CYS  57           HA       CYS  57  -9.955  -8.923   5.705
  434   1HB   CYS  57          HB2       CYS  57  -9.466  -6.944   3.594
  435   2HB   CYS  57          HB1       CYS  57  -8.367  -7.603   4.760
  436    H    ALA  58           HN       ALA  58 -12.123  -7.618   3.306
  437    HA   ALA  58           HA       ALA  58 -11.725  -4.934   3.532
  438   1HB   ALA  58          HB1       ALA  58 -12.893  -6.037   1.711
  439   2HB   ALA  58          HB2       ALA  58 -13.796  -4.655   2.337
  440   3HB   ALA  58          HB3       ALA  58 -14.286  -6.295   2.764
  441    H    LEU  59           HN       LEU  59 -13.880  -6.808   5.722
  442    HA   LEU  59           HA       LEU  59 -15.115  -4.377   6.640
  443   1HB   LEU  59          HB2       LEU  59 -15.212  -7.216   7.440
  444   2HB   LEU  59          HB1       LEU  59 -15.562  -6.049   8.701
  445    HG   LEU  59           HG       LEU  59 -17.357  -5.089   7.304
  446   1HD1  LEU  59          HD11      LEU  59 -16.718  -7.357   5.424
  447   2HD1  LEU  59          HD12      LEU  59 -16.474  -5.640   5.105
  448   3HD1  LEU  59          HD13      LEU  59 -18.106  -6.276   5.304
  449   1HD2  LEU  59          HD21      LEU  59 -17.852  -6.831   8.944
  450   2HD2  LEU  59          HD22      LEU  59 -17.589  -8.065   7.711
  451   3HD2  LEU  59          HD23      LEU  59 -18.925  -6.927   7.547
  452    H    ALA  60           HN       ALA  60 -12.012  -5.386   7.014
  453    HA   ALA  60           HA       ALA  60 -11.739  -3.390   9.171
  454   1HB   ALA  60          HB1       ALA  60  -9.451  -4.260   9.487
  455   2HB   ALA  60          HB2       ALA  60  -9.750  -5.477   8.246
  456   3HB   ALA  60          HB3       ALA  60 -10.662  -5.514   9.756
  457    HA   PRO  61           HA       PRO  61  -9.538  -1.246   5.780
  458   1HB   PRO  61          HB2       PRO  61  -7.767   0.090   7.669
  459   2HB   PRO  61          HB1       PRO  61  -8.998   0.805   6.627
  460   1HG   PRO  61          HG2       PRO  61  -9.221   0.700   9.343
  461   2HG   PRO  61          HG1       PRO  61 -10.615   0.715   8.250
  462   1HD   PRO  61          HD2       PRO  61  -9.364  -1.591   9.692
  463   2HD   PRO  61          HD1       PRO  61 -11.080  -1.253   9.377
  464    H    ILE  62           HN       ILE  62  -8.152  -2.595   4.764
  465    HA   ILE  62           HA       ILE  62  -5.895  -3.679   6.310
  466    HB   ILE  62           HB       ILE  62  -7.406  -5.430   5.544
  467   1HG1  ILE  62          HG12      ILE  62  -5.772  -6.797   4.223
  468   2HG1  ILE  62          HG11      ILE  62  -4.770  -5.358   4.062
  469   1HG2  ILE  62          HG21      ILE  62  -8.399  -4.350   3.636
  470   2HG2  ILE  62          HG22      ILE  62  -7.687  -5.885   3.138
  471   3HG2  ILE  62          HG23      ILE  62  -6.857  -4.370   2.779
  472   1HD1  ILE  62          HD11      ILE  62  -4.516  -5.271   6.492
  473   2HD1  ILE  62          HD12      ILE  62  -3.952  -6.804   5.827
  474   3HD1  ILE  62          HD13      ILE  62  -5.513  -6.718   6.643
  475    H    VAL  63           HN       VAL  63  -3.838  -2.930   5.702
  476    HA   VAL  63           HA       VAL  63  -3.475  -3.142   2.805
  477    HB   VAL  63           HB       VAL  63  -2.157  -0.968   4.444
  478   1HG1  VAL  63          HG11      VAL  63  -0.582  -1.939   2.887
  479   2HG1  VAL  63          HG12      VAL  63  -1.087  -0.356   2.297
  480   3HG1  VAL  63          HG13      VAL  63  -1.756  -1.820   1.577
  481   1HG2  VAL  63          HG21      VAL  63  -3.262   0.563   2.875
  482   2HG2  VAL  63          HG22      VAL  63  -4.442  -0.405   3.761
  483   3HG2  VAL  63          HG23      VAL  63  -4.048  -0.808   2.089
  484    H    MET  64           HN       MET  64  -1.945  -4.662   2.358
  485    HA   MET  64           HA       MET  64  -0.269  -5.380   4.687
  486   1HB   MET  64          HB2       MET  64  -1.832  -7.158   4.208
  487   2HB   MET  64          HB1       MET  64  -1.405  -7.132   2.503
  488   1HG   MET  64          HG2       MET  64   0.803  -7.926   3.003
  489   2HG   MET  64          HG1       MET  64   0.470  -7.865   4.735
  490   1HE   MET  64          HE1       MET  64  -0.455  -9.545   1.329
  491   2HE   MET  64          HE2       MET  64  -2.032  -9.035   1.928
  492   3HE   MET  64          HE3       MET  64  -1.642 -10.752   1.823
  493    H    VAL  65           HN       VAL  65   1.934  -5.377   4.395
  494    HA   VAL  65           HA       VAL  65   2.821  -5.225   1.577
  495    HB   VAL  65           HB       VAL  65   4.857  -4.256   3.312
  496   1HG1  VAL  65          HG11      VAL  65   4.601  -3.631   0.996
  497   2HG1  VAL  65          HG12      VAL  65   4.582  -2.196   2.023
  498   3HG1  VAL  65          HG13      VAL  65   3.072  -2.829   1.361
  499   1HG2  VAL  65          HG21      VAL  65   3.765  -2.304   4.285
  500   2HG2  VAL  65          HG22      VAL  65   3.143  -3.816   4.949
  501   3HG2  VAL  65          HG23      VAL  65   2.202  -2.925   3.754
  502    H    GLY  66           HN       GLY  66   3.733  -7.121   1.055
  503   1HA   GLY  66          HA2       GLY  66   5.020  -9.048   1.214
  504   2HA   GLY  66          HA1       GLY  66   6.067  -8.044   2.192
  505    H    GLU  67           HN       GLU  67   2.863  -9.256   2.801
  506    HA   GLU  67           HA       GLU  67   1.924 -10.312   4.567
  507   1HB   GLU  67          HB2       GLU  67   4.633 -11.585   4.923
  508   2HB   GLU  67          HB1       GLU  67   3.094 -12.206   5.496
  509   1HG   GLU  67          HG2       GLU  67   4.032 -11.985   2.647
  510   2HG   GLU  67          HG1       GLU  67   3.759 -13.456   3.579
  511    H    LYS  68           HN       LYS  68   4.067  -7.932   4.920
  512    HA   LYS  68           HA       LYS  68   4.649  -8.093   7.735
  513   1HB   LYS  68          HB2       LYS  68   4.774  -5.747   5.817
  514   2HB   LYS  68          HB1       LYS  68   5.337  -5.695   7.477
  515   1HG   LYS  68          HG2       LYS  68   6.493  -7.351   5.227
  516   2HG   LYS  68          HG1       LYS  68   7.209  -5.938   6.003
  517   1HD   LYS  68          HD2       LYS  68   7.284  -7.129   8.142
  518   2HD   LYS  68          HD1       LYS  68   6.590  -8.555   7.371
  519   1HE   LYS  68          HE2       LYS  68   8.523  -8.872   6.033
  520   2HE   LYS  68          HE1       LYS  68   9.166  -7.290   6.480
  521   1HZ   LYS  68          HZ1       LYS  68   9.532  -8.020   8.689
  522   2HZ   LYS  68          HZ2       LYS  68  10.203  -9.195   7.666
  523   3HZ   LYS  68          HZ3       LYS  68   8.711  -9.481   8.426
  524    H    VAL  69           HN       VAL  69   1.915  -7.482   6.002
  525    HA   VAL  69           HA       VAL  69  -0.039  -6.294   6.286
  526    HB   VAL  69           HB       VAL  69  -1.211  -6.943   8.428
  527   1HG1  VAL  69          HG11      VAL  69  -1.393  -8.202   6.346
  528   2HG1  VAL  69          HG12      VAL  69  -1.436  -9.269   7.750
  529   3HG1  VAL  69          HG13      VAL  69   0.034  -9.140   6.785
  530   1HG2  VAL  69          HG21      VAL  69   1.326  -8.514   8.881
  531   2HG2  VAL  69          HG22      VAL  69  -0.177  -8.706   9.782
  532   3HG2  VAL  69          HG23      VAL  69   0.728  -7.195   9.886
  533    H    TYR  70           HN       TYR  70  -0.036  -4.151   6.264
  534    HA   TYR  70           HA       TYR  70   0.908  -2.755   8.660
  535   1HB   TYR  70          HB2       TYR  70   1.175  -2.102   5.769
  536   2HB   TYR  70          HB1       TYR  70   1.112  -0.785   6.942
  537    HD1  TYR  70           HD1      TYR  70   2.591  -4.157   7.212
  538    HD2  TYR  70           HD2      TYR  70   3.306   0.017   7.090
  539    HE1  TYR  70           HE1      TYR  70   4.925  -4.553   7.711
  540    HE2  TYR  70           HE2      TYR  70   5.639  -0.360   7.597
  541    HH   TYR  70           HH       TYR  70   7.056  -2.059   8.679
  542    H    GLY  71           HN       GLY  71   0.115  -0.602   8.938
  543   1HA   GLY  71          HA2       GLY  71  -2.804  -0.506   8.610
  544   2HA   GLY  71          HA1       GLY  71  -1.925   0.181   9.979
  545    H    ASN  72           HN       ASN  72  -0.029   0.610   7.350
  546    HA   ASN  72           HA       ASN  72  -0.721   3.317   6.887
  547   1HB   ASN  72          HB2       ASN  72   1.566   2.596   6.422
  548   2HB   ASN  72          HB1       ASN  72   1.016   1.444   5.210
  549   1HD2  ASN  72          HD21      ASN  72   2.701   3.926   5.270
  550   2HD2  ASN  72          HD22      ASN  72   2.134   4.855   3.925
  551    H    VAL  73           HN       VAL  73  -1.969   4.181   5.144
  552    HA   VAL  73           HA       VAL  73  -4.178   2.249   4.918
  553    HB   VAL  73           HB       VAL  73  -5.110   4.886   5.524
  554   1HG1  VAL  73          HG11      VAL  73  -5.141   2.325   7.130
  555   2HG1  VAL  73          HG12      VAL  73  -6.317   2.764   5.891
  556   3HG1  VAL  73          HG13      VAL  73  -6.195   3.719   7.370
  557   1HG2  VAL  73          HG21      VAL  73  -4.097   5.199   7.720
  558   2HG2  VAL  73          HG22      VAL  73  -2.830   5.151   6.485
  559   3HG2  VAL  73          HG23      VAL  73  -3.121   3.737   7.504
  560    H    THR  74           HN       THR  74  -5.911   4.654   4.250
  561    HA   THR  74           HA       THR  74  -5.074   4.913   1.461
  562    HB   THR  74           HB       THR  74  -7.386   4.461   0.702
  563    HG1  THR  74           HG1      THR  74  -8.644   3.217   2.381
  564   1HG2  THR  74          HG21      THR  74  -6.131   2.261   2.333
  565   2HG2  THR  74          HG22      THR  74  -5.696   2.697   0.678
  566   3HG2  THR  74          HG23      THR  74  -7.297   2.038   1.026
  567    HA   PRO  75           HA       PRO  75  -8.058   8.491   2.044
  568   1HB   PRO  75          HB2       PRO  75  -9.436   8.943   4.296
  569   2HB   PRO  75          HB1       PRO  75  -9.914   7.694   3.140
  570   1HG   PRO  75          HG2       PRO  75  -8.614   7.423   5.790
  571   2HG   PRO  75          HG1       PRO  75  -9.703   6.309   4.949
  572   1HD   PRO  75          HD2       PRO  75  -6.872   6.170   5.089
  573   2HD   PRO  75          HD1       PRO  75  -7.949   5.163   4.103
  574    H    GLY  76           HN       GLY  76  -5.668   9.247   2.213
  575   1HA   GLY  76          HA2       GLY  76  -4.549  11.230   2.688
  576   2HA   GLY  76          HA1       GLY  76  -5.768  11.594   3.897
  577    H    GLN  77           HN       GLN  77  -5.174   8.760   4.968
  578    HA   GLN  77           HA       GLN  77  -3.532   9.798   7.107
  579   1HB   GLN  77          HB2       GLN  77  -4.319   6.906   6.798
  580   2HB   GLN  77          HB1       GLN  77  -4.061   7.811   8.279
  581   1HG   GLN  77          HG2       GLN  77  -6.129   9.055   7.859
  582   2HG   GLN  77          HG1       GLN  77  -6.392   8.085   6.405
  583   1HE2  GLN  77          HE21      GLN  77  -6.868   5.864   6.629
  584   2HE2  GLN  77          HE22      GLN  77  -7.461   5.221   8.125
  585    H    VAL  78           HN       VAL  78  -3.322   8.194   4.267
  586    HA   VAL  78           HA       VAL  78  -1.377   6.379   4.248
  587    HB   VAL  78           HB       VAL  78  -0.963   7.300   1.933
  588   1HG1  VAL  78          HG11      VAL  78  -3.217   6.753   1.089
  589   2HG1  VAL  78          HG12      VAL  78  -3.765   6.718   2.767
  590   3HG1  VAL  78          HG13      VAL  78  -2.558   5.557   2.210
  591   1HG2  VAL  78          HG21      VAL  78  -1.359   9.552   2.052
  592   2HG2  VAL  78          HG22      VAL  78  -2.851   9.330   2.957
  593   3HG2  VAL  78          HG23      VAL  78  -2.793   8.943   1.232
  594    H    LYS  79           HN       LYS  79  -0.874   9.899   3.813
  595    HA   LYS  79           HA       LYS  79   1.819   9.620   3.080
  596   1HB   LYS  79          HB2       LYS  79   0.488  12.066   4.272
  597   2HB   LYS  79          HB1       LYS  79   1.928  12.041   3.262
  598   1HG   LYS  79          HG2       LYS  79   0.627  11.297   1.364
  599   2HG   LYS  79          HG1       LYS  79  -0.818  11.189   2.369
  600   1HD   LYS  79          HD2       LYS  79   0.716  13.735   1.885
  601   2HD   LYS  79          HD1       LYS  79  -0.701  13.240   0.956
  602   1HE   LYS  79          HE2       LYS  79  -1.995  13.166   3.087
  603   2HE   LYS  79          HE1       LYS  79  -0.583  13.815   3.921
  604   1HZ   LYS  79          HZ1       LYS  79  -2.142  15.563   3.367
  605   2HZ   LYS  79          HZ2       LYS  79  -2.076  15.152   1.727
  606   3HZ   LYS  79          HZ3       LYS  79  -0.700  15.774   2.499
  607    H    LYS  80           HN       LYS  80   0.206  10.103   6.086
  608    HA   LYS  80           HA       LYS  80   2.595  10.754   7.572
  609   1HB   LYS  80          HB2       LYS  80   0.073  10.026   8.936
  610   2HB   LYS  80          HB1       LYS  80   1.112  11.416   9.173
  611   1HG   LYS  80          HG2       LYS  80  -0.184  12.689   7.955
  612   2HG   LYS  80          HG1       LYS  80  -0.148  11.580   6.604
  613   1HD   LYS  80          HD2       LYS  80  -2.370  11.519   7.043
  614   2HD   LYS  80          HD1       LYS  80  -1.845  10.262   8.165
  615   1HE   LYS  80          HE2       LYS  80  -1.844  11.822   9.998
  616   2HE   LYS  80          HE1       LYS  80  -2.199  13.161   8.908
  617   1HZ   LYS  80          HZ1       LYS  80  -3.988  10.894   9.598
  618   2HZ   LYS  80          HZ2       LYS  80  -4.323  12.015   8.374
  619   3HZ   LYS  80          HZ3       LYS  80  -4.203  12.531   9.983
  620    H    ILE  81           HN       ILE  81   0.230   8.228   7.367
  621    HA   ILE  81           HA       ILE  81   1.598   6.504   9.161
  622    HB   ILE  81           HB       ILE  81  -0.373   5.737   7.005
  623   1HG1  ILE  81          HG12      ILE  81  -1.291   7.439   8.528
  624   2HG1  ILE  81          HG11      ILE  81  -2.070   5.882   8.785
  625   1HG2  ILE  81          HG21      ILE  81  -0.784   3.789   8.474
  626   2HG2  ILE  81          HG22      ILE  81   0.476   4.356   9.570
  627   3HG2  ILE  81          HG23      ILE  81   0.896   3.842   7.934
  628   1HD1  ILE  81          HD11      ILE  81  -0.669   5.517  10.754
  629   2HD1  ILE  81          HD12      ILE  81  -1.627   6.989  10.891
  630   3HD1  ILE  81          HD13      ILE  81   0.089   7.088  10.500
  631    H    LEU  82           HN       LEU  82   2.261   7.459   5.956
  632    HA   LEU  82           HA       LEU  82   3.781   5.263   5.050
  633   1HB   LEU  82          HB2       LEU  82   3.343   7.166   3.604
  634   2HB   LEU  82          HB1       LEU  82   4.217   8.241   4.681
  635    HG   LEU  82           HG       LEU  82   6.297   6.947   4.179
  636   1HD1  LEU  82          HD11      LEU  82   5.270   4.873   3.435
  637   2HD1  LEU  82          HD12      LEU  82   6.314   5.539   2.179
  638   3HD1  LEU  82          HD13      LEU  82   4.563   5.704   2.051
  639   1HD2  LEU  82          HD21      LEU  82   4.912   8.206   1.807
  640   2HD2  LEU  82          HD22      LEU  82   6.652   8.002   2.014
  641   3HD2  LEU  82          HD23      LEU  82   5.757   9.085   3.082
  642    H    ALA  83           HN       ALA  83   4.407   7.636   7.580
  643    HA   ALA  83           HA       ALA  83   7.074   7.051   8.129
  644   1HB   ALA  83          HB1       ALA  83   6.567   7.487  10.478
  645   2HB   ALA  83          HB2       ALA  83   4.843   7.337  10.141
  646   3HB   ALA  83          HB3       ALA  83   5.770   8.658   9.430
  647    H    GLU  84           HN       GLU  84   4.252   5.026   8.457
  648    HA   GLU  84           HA       GLU  84   5.369   2.931   9.980
  649   1HB   GLU  84          HB2       GLU  84   2.931   3.483   8.650
  650   2HB   GLU  84          HB1       GLU  84   3.488   1.891   8.146
  651   1HG   GLU  84          HG2       GLU  84   2.030   1.739  10.065
  652   2HG   GLU  84          HG1       GLU  84   3.666   1.219  10.471
  653    H    TYR  85           HN       TYR  85   5.386   3.658   6.534
  654    HA   TYR  85           HA       TYR  85   6.326   1.078   5.818
  655   1HB   TYR  85          HB2       TYR  85   5.616   3.610   4.425
  656   2HB   TYR  85          HB1       TYR  85   6.540   2.385   3.575
  657    HD1  TYR  85           HD1      TYR  85   4.623   0.836   5.899
  658    HD2  TYR  85           HD2      TYR  85   4.423   2.688   2.221
  659    HE1  TYR  85           HE1      TYR  85   2.751  -0.598   5.383
  660    HE2  TYR  85           HE2      TYR  85   2.512   1.321   1.649
  661    HH   TYR  85           HH       TYR  85   1.422  -0.705   2.194
  Start of MODEL   12
    1   1H    MET   1          HT1       MET   1  16.002   0.638  -7.751
    2   2H    MET   1          HT2       MET   1  16.771   1.696  -8.830
    3   3H    MET   1          HT3       MET   1  16.989   0.023  -8.986
    4    HA   MET   1           HA       MET   1  14.439   1.473  -9.358
    5   1HB   MET   1          HB2       MET   1  16.478   1.556 -11.078
    6   2HB   MET   1          HB1       MET   1  15.847  -0.020 -11.533
    7   1HG   MET   1          HG2       MET   1  14.012   2.323 -11.367
    8   2HG   MET   1          HG1       MET   1  15.057   2.126 -12.770
    9   1HE   MET   1          HE1       MET   1  15.181  -0.954 -13.279
   10   2HE   MET   1          HE2       MET   1  14.854   0.246 -14.531
   11   3HE   MET   1          HE3       MET   1  13.810  -1.169 -14.369
   12    H    VAL   2           HN       VAL   2  12.692   0.138  -9.985
   13    HA   VAL   2           HA       VAL   2  11.370  -1.717  -9.950
   14    HB   VAL   2           HB       VAL   2  13.945  -3.310  -9.798
   15   1HG1  VAL   2          HG11      VAL   2  12.567  -5.250 -10.364
   16   2HG1  VAL   2          HG12      VAL   2  11.117  -4.252 -10.259
   17   3HG1  VAL   2          HG13      VAL   2  12.089  -4.549  -8.818
   18   1HG2  VAL   2          HG21      VAL   2  12.071  -2.792 -12.107
   19   2HG2  VAL   2          HG22      VAL   2  13.488  -3.839 -12.147
   20   3HG2  VAL   2          HG23      VAL   2  13.682  -2.103 -11.906
   21    HA   PRO   3           HA       PRO   3  11.089  -1.331  -5.468
   22   1HB   PRO   3          HB2       PRO   3   8.612  -2.865  -6.108
   23   2HB   PRO   3          HB1       PRO   3   8.816  -1.425  -5.103
   24   1HG   PRO   3          HG2       PRO   3   7.778  -1.228  -7.540
   25   2HG   PRO   3          HG1       PRO   3   8.902   0.002  -6.932
   26   1HD   PRO   3          HD2       PRO   3   9.375  -2.192  -8.899
   27   2HD   PRO   3          HD1       PRO   3  10.045  -0.549  -8.856
   28    H    LYS   4           HN       LYS   4  12.573  -2.654  -4.653
   29    HA   LYS   4           HA       LYS   4  13.366  -5.130  -5.150
   30   1HB   LYS   4          HB2       LYS   4  14.266  -3.543  -3.424
   31   2HB   LYS   4          HB1       LYS   4  13.051  -4.162  -2.327
   32   1HG   LYS   4          HG2       LYS   4  15.173  -5.226  -1.909
   33   2HG   LYS   4          HG1       LYS   4  14.010  -6.401  -2.528
   34   1HD   LYS   4          HD2       LYS   4  14.999  -6.201  -4.759
   35   2HD   LYS   4          HD1       LYS   4  16.158  -5.024  -4.138
   36   1HE   LYS   4          HE2       LYS   4  17.164  -7.235  -4.296
   37   2HE   LYS   4          HE1       LYS   4  17.059  -6.707  -2.618
   38   1HZ   LYS   4          HZ1       LYS   4  16.403  -9.013  -2.856
   39   2HZ   LYS   4          HZ2       LYS   4  15.189  -8.587  -3.961
   40   3HZ   LYS   4          HZ3       LYS   4  15.087  -8.079  -2.344
   41    H    GLY   5           HN       GLY   5  11.256  -4.638  -2.420
   42   1HA   GLY   5          HA2       GLY   5   9.089  -5.893  -2.466
   43   2HA   GLY   5          HA1       GLY   5  10.045  -7.254  -3.011
   44    H    LYS   6           HN       LYS   6  11.179  -5.070  -0.617
   45    HA   LYS   6           HA       LYS   6  11.623  -6.811   1.443
   46   1HB   LYS   6          HB2       LYS   6  12.254  -4.365   1.272
   47   2HB   LYS   6          HB1       LYS   6  10.592  -3.976   1.706
   48   1HG   LYS   6          HG2       LYS   6  11.774  -3.796   3.695
   49   2HG   LYS   6          HG1       LYS   6  10.994  -5.376   3.773
   50   1HD   LYS   6          HD2       LYS   6  13.268  -5.589   4.537
   51   2HD   LYS   6          HD1       LYS   6  13.089  -6.406   2.982
   52   1HE   LYS   6          HE2       LYS   6  14.073  -4.496   1.842
   53   2HE   LYS   6          HE1       LYS   6  14.183  -3.619   3.365
   54   1HZ   LYS   6          HZ1       LYS   6  15.726  -5.297   4.176
   55   2HZ   LYS   6          HZ2       LYS   6  16.307  -4.579   2.755
   56   3HZ   LYS   6          HZ3       LYS   6  15.625  -6.132   2.704
   57    H    TYR   7           HN       TYR   7   8.849  -4.633   1.241
   58    HA   TYR   7           HA       TYR   7   7.118  -6.699   2.324
   59   1HB   TYR   7          HB2       TYR   7   6.616  -3.724   2.211
   60   2HB   TYR   7          HB1       TYR   7   5.818  -4.923   3.229
   61    HD1  TYR   7           HD1      TYR   7   8.216  -6.420   4.215
   62    HD2  TYR   7           HD2      TYR   7   7.487  -2.265   3.740
   63    HE1  TYR   7           HE1      TYR   7   9.822  -5.937   5.991
   64    HE2  TYR   7           HE2      TYR   7   9.066  -1.762   5.488
   65    HH   TYR   7           HH       TYR   7  10.166  -2.739   7.341
   66    HA   PRO   8           HA       PRO   8   5.567  -6.394  -2.111
   67   1HB   PRO   8          HB2       PRO   8   4.640  -9.069  -1.164
   68   2HB   PRO   8          HB1       PRO   8   5.344  -8.613  -2.722
   69   1HG   PRO   8          HG2       PRO   8   6.795  -9.953  -0.969
   70   2HG   PRO   8          HG1       PRO   8   7.522  -8.606  -1.870
   71   1HD   PRO   8          HD2       PRO   8   6.509  -8.669   0.950
   72   2HD   PRO   8          HD1       PRO   8   7.991  -7.932   0.304
   73    H    ILE   9           HN       ILE   9   3.859  -4.973  -1.857
   74    HA   ILE   9           HA       ILE   9   2.056  -5.318   0.346
   75    HB   ILE   9           HB       ILE   9   1.644  -3.131   0.175
   76   1HG1  ILE   9          HG12      ILE   9   2.019  -3.082  -2.798
   77   2HG1  ILE   9          HG11      ILE   9   0.465  -3.359  -2.015
   78   1HG2  ILE   9          HG21      ILE   9   4.116  -3.280  -1.494
   79   2HG2  ILE   9          HG22      ILE   9   4.038  -3.286   0.269
   80   3HG2  ILE   9          HG23      ILE   9   3.546  -1.851  -0.634
   81   1HD1  ILE   9          HD11      ILE   9   0.576  -1.181  -0.975
   82   2HD1  ILE   9          HD12      ILE   9   0.750  -1.043  -2.727
   83   3HD1  ILE   9          HD13      ILE   9   2.167  -0.906  -1.684
   84    H    SER  10           HN       SER  10  -0.281  -4.705  -0.002
   85    HA   SER  10           HA       SER  10  -1.320  -5.533  -2.618
   86   1HB   SER  10          HB2       SER  10  -3.007  -6.911  -1.753
   87   2HB   SER  10          HB1       SER  10  -1.614  -7.344  -0.760
   88    HG   SER  10           HG       SER  10  -3.976  -6.377   0.013
   89    H    VAL  11           HN       VAL  11  -2.860  -4.225  -3.379
   90    HA   VAL  11           HA       VAL  11  -3.747  -2.060  -1.604
   91    HB   VAL  11           HB       VAL  11  -3.730  -0.547  -3.463
   92   1HG1  VAL  11          HG11      VAL  11  -1.459  -0.290  -3.562
   93   2HG1  VAL  11          HG12      VAL  11  -1.179  -2.001  -3.899
   94   3HG1  VAL  11          HG13      VAL  11  -1.569  -1.479  -2.247
   95   1HG2  VAL  11          HG21      VAL  11  -2.982  -1.216  -5.708
   96   2HG2  VAL  11          HG22      VAL  11  -4.469  -2.047  -5.251
   97   3HG2  VAL  11          HG23      VAL  11  -2.926  -2.899  -5.186
   98    H    CYS  12           HN       CYS  12  -5.870  -1.879  -1.253
   99    HA   CYS  12           HA       CYS  12  -7.657  -3.807  -2.296
  100   1HB   CYS  12          HB2       CYS  12  -8.049  -2.874  -0.112
  101   2HB   CYS  12          HB1       CYS  12  -8.090  -1.238  -0.756
  102    H    MET  13           HN       MET  13  -8.230  -3.827  -4.348
  103    HA   MET  13           HA       MET  13  -9.482  -1.400  -5.427
  104   1HB   MET  13          HB2       MET  13  -7.179  -2.149  -6.448
  105   2HB   MET  13          HB1       MET  13  -8.150  -3.371  -7.253
  106   1HG   MET  13          HG2       MET  13  -7.821  -1.445  -8.685
  107   2HG   MET  13          HG1       MET  13  -9.524  -1.626  -8.263
  108   1HE   MET  13          HE1       MET  13  -9.798   0.926  -9.201
  109   2HE   MET  13          HE2       MET  13  -8.059   1.047  -9.465
  110   3HE   MET  13          HE3       MET  13  -8.898   2.289  -8.537
  111    H    GLY  14           HN       GLY  14 -10.576  -3.713  -3.950
  112   1HA   GLY  14          HA2       GLY  14 -11.360  -5.771  -5.731
  113   2HA   GLY  14          HA1       GLY  14 -11.990  -5.521  -4.114
  114    H    THR  15           HN       THR  15 -13.806  -6.473  -5.628
  115    HA   THR  15           HA       THR  15 -15.017  -4.759  -7.514
  116    HB   THR  15           HB       THR  15 -15.361  -7.117  -7.728
  117    HG1  THR  15           HG1      THR  15 -17.135  -5.742  -8.342
  118   1HG2  THR  15          HG21      THR  15 -16.750  -7.027  -5.046
  119   2HG2  THR  15          HG22      THR  15 -15.189  -7.777  -5.385
  120   3HG2  THR  15          HG23      THR  15 -16.658  -8.432  -6.108
  121    H    ALA  16           HN       ALA  16 -15.832  -5.510  -4.146
  122    HA   ALA  16           HA       ALA  16 -18.093  -3.782  -4.049
  123   1HB   ALA  16          HB1       ALA  16 -16.434  -4.892  -1.784
  124   2HB   ALA  16          HB2       ALA  16 -17.831  -5.681  -2.517
  125   3HB   ALA  16          HB3       ALA  16 -18.034  -4.162  -1.643
  126    H    CYS  17           HN       CYS  17 -14.781  -3.564  -2.896
  127    HA   CYS  17           HA       CYS  17 -15.024  -1.117  -1.565
  128   1HB   CYS  17          HB2       CYS  17 -12.624  -2.468  -2.761
  129   2HB   CYS  17          HB1       CYS  17 -12.552  -1.130  -1.656
  130    H    PHE  18           HN       PHE  18 -14.239  -1.868  -4.927
  131    HA   PHE  18           HA       PHE  18 -13.054   0.568  -5.655
  132   1HB   PHE  18          HB2       PHE  18 -12.888  -1.372  -7.085
  133   2HB   PHE  18          HB1       PHE  18 -14.634  -1.417  -7.299
  134    HD1  PHE  18           HD1      PHE  18 -11.663   0.729  -7.940
  135    HD2  PHE  18           HD2      PHE  18 -15.605  -0.361  -9.121
  136    HE1  PHE  18           HE1      PHE  18 -11.449   2.137  -9.947
  137    HE2  PHE  18           HE2      PHE  18 -15.395   1.043 -11.129
  138    HZ   PHE  18           HZ       PHE  18 -13.316   2.296 -11.544
  139    H    VAL  19           HN       VAL  19 -16.424  -0.378  -5.418
  140    HA   VAL  19           HA       VAL  19 -17.455   1.954  -6.728
  141    HB   VAL  19           HB       VAL  19 -18.909   0.101  -4.828
  142   1HG1  VAL  19          HG11      VAL  19 -20.086   2.193  -5.225
  143   2HG1  VAL  19          HG12      VAL  19 -20.919   0.855  -6.016
  144   3HG1  VAL  19          HG13      VAL  19 -19.934   1.967  -6.966
  145   1HG2  VAL  19          HG21      VAL  19 -19.669  -1.087  -6.835
  146   2HG2  VAL  19          HG22      VAL  19 -17.917  -1.173  -6.644
  147   3HG2  VAL  19          HG23      VAL  19 -18.620  -0.069  -7.826
  148    H    LYS  20           HN       LYS  20 -16.345   1.175  -3.599
  149    HA   LYS  20           HA       LYS  20 -17.758   3.289  -2.223
  150   1HB   LYS  20          HB2       LYS  20 -17.220   1.033  -1.236
  151   2HB   LYS  20          HB1       LYS  20 -15.530   1.499  -1.237
  152   1HG   LYS  20          HG2       LYS  20 -16.011   3.308   0.320
  153   2HG   LYS  20          HG1       LYS  20 -17.724   2.876   0.300
  154   1HD   LYS  20          HD2       LYS  20 -17.199   0.681   1.208
  155   2HD   LYS  20          HD1       LYS  20 -15.479   1.063   1.179
  156   1HE   LYS  20          HE2       LYS  20 -15.851   2.865   2.786
  157   2HE   LYS  20          HE1       LYS  20 -17.574   2.492   2.808
  158   1HZ   LYS  20          HZ1       LYS  20 -17.098   0.339   3.731
  159   2HZ   LYS  20          HZ2       LYS  20 -16.348   1.520   4.691
  160   3HZ   LYS  20          HZ3       LYS  20 -15.429   0.597   3.603
  161    H    GLY  21           HN       GLY  21 -15.465   3.523  -4.407
  162   1HA   GLY  21          HA2       GLY  21 -14.280   5.479  -4.897
  163   2HA   GLY  21          HA1       GLY  21 -14.443   5.971  -3.216
  164    H    ALA  22           HN       ALA  22 -13.203   2.849  -4.229
  165    HA   ALA  22           HA       ALA  22 -10.944   3.138  -2.529
  166   1HB   ALA  22          HB1       ALA  22 -11.507   1.023  -4.607
  167   2HB   ALA  22          HB2       ALA  22 -11.991   0.964  -2.911
  168   3HB   ALA  22          HB3       ALA  22 -10.281   0.932  -3.343
  169    H    ASP  23           HN       ASP  23 -11.540   3.869  -5.824
  170    HA   ASP  23           HA       ASP  23  -9.003   3.741  -6.946
  171   1HB   ASP  23          HB2       ASP  23 -10.834   4.257  -8.381
  172   2HB   ASP  23          HB1       ASP  23 -11.295   5.654  -7.407
  173    H    LYS  24           HN       LYS  24 -10.531   6.468  -5.206
  174    HA   LYS  24           HA       LYS  24  -8.252   8.145  -5.406
  175   1HB   LYS  24          HB2       LYS  24 -10.721   8.183  -3.704
  176   2HB   LYS  24          HB1       LYS  24  -9.398   9.279  -3.339
  177   1HG   LYS  24          HG2       LYS  24 -10.986  10.441  -4.674
  178   2HG   LYS  24          HG1       LYS  24  -9.551  10.152  -5.655
  179   1HD   LYS  24          HD2       LYS  24 -10.653   8.300  -6.772
  180   2HD   LYS  24          HD1       LYS  24 -12.070   8.489  -5.734
  181   1HE   LYS  24          HE2       LYS  24 -12.404  10.751  -6.639
  182   2HE   LYS  24          HE1       LYS  24 -11.012  10.525  -7.695
  183   1HZ   LYS  24          HZ1       LYS  24 -13.241  10.133  -8.731
  184   2HZ   LYS  24          HZ2       LYS  24 -13.387   8.750  -7.763
  185   3HZ   LYS  24          HZ3       LYS  24 -12.139   8.859  -8.903
  186    H    VAL  25           HN       VAL  25  -9.265   5.699  -3.164
  187    HA   VAL  25           HA       VAL  25  -7.486   6.170  -1.039
  188    HB   VAL  25           HB       VAL  25  -8.429   3.506  -2.154
  189   1HG1  VAL  25          HG11      VAL  25  -6.527   3.217  -0.690
  190   2HG1  VAL  25          HG12      VAL  25  -7.994   2.631   0.096
  191   3HG1  VAL  25          HG13      VAL  25  -7.309   4.191   0.558
  192   1HG2  VAL  25          HG21      VAL  25  -9.636   5.237   0.000
  193   2HG2  VAL  25          HG22      VAL  25 -10.169   3.608  -0.420
  194   3HG2  VAL  25          HG23      VAL  25 -10.317   4.916  -1.594
  195    H    VAL  26           HN       VAL  26  -7.120   3.967  -3.812
  196    HA   VAL  26           HA       VAL  26  -4.478   3.361  -3.053
  197    HB   VAL  26           HB       VAL  26  -5.854   1.833  -4.440
  198   1HG1  VAL  26          HG11      VAL  26  -6.914   3.498  -5.867
  199   2HG1  VAL  26          HG12      VAL  26  -6.132   2.238  -6.826
  200   3HG1  VAL  26          HG13      VAL  26  -5.368   3.822  -6.653
  201   1HG2  VAL  26          HG21      VAL  26  -3.264   2.668  -5.743
  202   2HG2  VAL  26          HG22      VAL  26  -4.082   1.122  -5.974
  203   3HG2  VAL  26          HG23      VAL  26  -3.436   1.549  -4.390
  204    H    HIS  27           HN       HIS  27  -5.874   5.948  -4.945
  205    HA   HIS  27           HA       HIS  27  -3.631   6.569  -6.509
  206   1HB   HIS  27          HB2       HIS  27  -6.027   7.572  -6.642
  207   2HB   HIS  27          HB1       HIS  27  -5.407   8.745  -5.474
  208    HD1  HIS  27           HD1      HIS  27  -3.149  10.058  -6.305
  209    HD2  HIS  27           HD2      HIS  27  -5.421   8.143  -9.221
  210    HE1  HIS  27           HE1      HIS  27  -2.330  10.949  -8.496
  211    HE2  HIS  27           HE2      HIS  27  -3.537   9.593 -10.242
  212    H    ALA  28           HN       ALA  28  -4.595   7.707  -3.365
  213    HA   ALA  28           HA       ALA  28  -2.443   9.423  -2.864
  214   1HB   ALA  28          HB1       ALA  28  -2.947   9.116  -0.494
  215   2HB   ALA  28          HB2       ALA  28  -3.949   7.717  -0.879
  216   3HB   ALA  28          HB3       ALA  28  -4.429   9.323  -1.429
  217    H    PHE  29           HN       PHE  29  -2.878   5.984  -2.288
  218    HA   PHE  29           HA       PHE  29  -0.463   5.298  -1.096
  219   1HB   PHE  29          HB2       PHE  29  -2.663   3.958  -1.926
  220   2HB   PHE  29          HB1       PHE  29  -1.537   3.492  -3.196
  221    HD1  PHE  29           HD1      PHE  29   0.912   3.618  -1.281
  222    HD2  PHE  29           HD2      PHE  29  -2.893   1.730  -1.092
  223    HE1  PHE  29           HE1      PHE  29   1.846   1.894   0.182
  224    HE2  PHE  29           HE2      PHE  29  -1.963  -0.010   0.377
  225    HZ   PHE  29           HZ       PHE  29   0.413   0.071   1.017
  226    H    LYS  30           HN       LYS  30  -1.312   5.365  -4.548
  227    HA   LYS  30           HA       LYS  30   1.086   4.497  -5.598
  228   1HB   LYS  30          HB2       LYS  30  -0.969   4.801  -6.916
  229   2HB   LYS  30          HB1       LYS  30  -0.789   6.543  -6.777
  230   1HG   LYS  30          HG2       LYS  30   1.338   6.393  -8.015
  231   2HG   LYS  30          HG1       LYS  30   1.070   4.659  -8.210
  232   1HD   LYS  30          HD2       LYS  30  -1.017   5.124  -9.409
  233   2HD   LYS  30          HD1       LYS  30  -0.734   6.857  -9.225
  234   1HE   LYS  30          HE2       LYS  30  -0.049   6.161 -11.433
  235   2HE   LYS  30          HE1       LYS  30   1.371   6.613 -10.491
  236   1HZ   LYS  30          HZ1       LYS  30   0.427   3.833 -10.963
  237   2HZ   LYS  30          HZ2       LYS  30   1.812   4.273 -10.084
  238   3HZ   LYS  30          HZ3       LYS  30   1.733   4.579 -11.748
  239    H    GLU  31           HN       GLU  31   0.118   7.745  -4.798
  240    HA   GLU  31           HA       GLU  31   2.617   8.807  -5.817
  241   1HB   GLU  31          HB2       GLU  31   1.648  11.014  -5.343
  242   2HB   GLU  31          HB1       GLU  31   0.559  10.021  -6.295
  243   1HG   GLU  31          HG2       GLU  31  -0.602   9.431  -4.145
  244   2HG   GLU  31          HG1       GLU  31   0.367  10.690  -3.379
  245    H    GLN  32           HN       GLN  32   1.217   8.055  -2.767
  246    HA   GLN  32           HA       GLN  32   2.994   9.488  -1.155
  247   1HB   GLN  32          HB2       GLN  32   2.050   8.414   0.588
  248   2HB   GLN  32          HB1       GLN  32   0.787   8.200  -0.608
  249   1HG   GLN  32          HG2       GLN  32   0.956   6.006  -0.496
  250   2HG   GLN  32          HG1       GLN  32   2.694   6.092  -0.794
  251   1HE2  GLN  32          HE21      GLN  32   1.276   7.683   1.896
  252   2HE2  GLN  32          HE22      GLN  32   1.857   6.621   3.132
  253    H    LEU  33           HN       LEU  33   3.233   6.470  -2.903
  254    HA   LEU  33           HA       LEU  33   5.505   5.355  -1.763
  255   1HB   LEU  33          HB2       LEU  33   4.145   4.651  -3.882
  256   2HB   LEU  33          HB1       LEU  33   5.343   5.620  -4.730
  257    HG   LEU  33           HG       LEU  33   5.816   3.211  -3.030
  258   1HD1  LEU  33          HD11      LEU  33   5.023   2.716  -5.235
  259   2HD1  LEU  33          HD12      LEU  33   6.713   2.236  -5.033
  260   3HD1  LEU  33          HD13      LEU  33   6.308   3.716  -5.920
  261   1HD2  LEU  33          HD21      LEU  33   7.900   4.912  -4.365
  262   2HD2  LEU  33          HD22      LEU  33   8.181   3.348  -3.589
  263   3HD2  LEU  33          HD23      LEU  33   7.644   4.723  -2.627
  264    H    LYS  34           HN       LYS  34   5.284   7.572  -4.358
  265    HA   LYS  34           HA       LYS  34   6.358   9.404  -4.987
  266   1HB   LYS  34          HB2       LYS  34   7.159  10.937  -3.324
  267   2HB   LYS  34          HB1       LYS  34   5.752  10.096  -2.695
  268   1HG   LYS  34          HG2       LYS  34   7.136  10.098  -0.863
  269   2HG   LYS  34          HG1       LYS  34   7.530   8.518  -1.576
  270   1HD   LYS  34          HD2       LYS  34   9.455   9.635  -2.730
  271   2HD   LYS  34          HD1       LYS  34   9.097  11.099  -1.813
  272   1HE   LYS  34          HE2       LYS  34   9.427   9.854   0.277
  273   2HE   LYS  34          HE1       LYS  34   9.817   8.406  -0.656
  274   1HZ   LYS  34          HZ1       LYS  34  11.330  10.964  -0.724
  275   2HZ   LYS  34          HZ2       LYS  34  11.707   9.568  -1.607
  276   3HZ   LYS  34          HZ3       LYS  34  11.813   9.554   0.084
  277    H    ILE  35           HN       ILE  35   8.116   6.977  -3.579
  278    HA   ILE  35           HA       ILE  35   9.974   5.908  -4.084
  279    HB   ILE  35           HB       ILE  35  10.470   7.088  -6.700
  280   1HG1  ILE  35          HG12      ILE  35   7.914   5.584  -6.374
  281   2HG1  ILE  35          HG11      ILE  35   7.889   7.344  -6.273
  282   1HG2  ILE  35          HG21      ILE  35  11.327   4.949  -5.936
  283   2HG2  ILE  35          HG22      ILE  35  10.219   4.700  -7.287
  284   3HG2  ILE  35          HG23      ILE  35   9.678   4.398  -5.627
  285   1HD1  ILE  35          HD11      ILE  35   7.304   6.572  -8.499
  286   2HD1  ILE  35          HD12      ILE  35   8.830   5.694  -8.611
  287   3HD1  ILE  35          HD13      ILE  35   8.829   7.457  -8.528
  288    H    ASP  36           HN       ASP  36  12.200   6.435  -5.464
  289    HA   ASP  36           HA       ASP  36  13.454   8.824  -4.464
  290   1HB   ASP  36          HB2       ASP  36  13.305   7.205  -2.500
  291   2HB   ASP  36          HB1       ASP  36  14.354   6.132  -3.410
  292    H    ILE  37           HN       ILE  37  13.824   5.529  -5.454
  293    HA   ILE  37           HA       ILE  37  15.398   6.103  -7.786
  294    HB   ILE  37           HB       ILE  37  17.222   4.573  -7.009
  295   1HG1  ILE  37          HG12      ILE  37  15.747   5.066  -4.481
  296   2HG1  ILE  37          HG11      ILE  37  16.175   3.523  -5.211
  297   1HG2  ILE  37          HG21      ILE  37  17.657   6.961  -7.198
  298   2HG2  ILE  37          HG22      ILE  37  18.501   6.283  -5.808
  299   3HG2  ILE  37          HG23      ILE  37  17.021   7.211  -5.572
  300   1HD1  ILE  37          HD11      ILE  37  17.527   3.942  -3.238
  301   2HD1  ILE  37          HD12      ILE  37  18.105   5.455  -3.933
  302   3HD1  ILE  37          HD13      ILE  37  18.533   3.919  -4.687
  303    H    GLY  38           HN       GLY  38  13.054   4.431  -6.428
  304   1HA   GLY  38          HA2       GLY  38  13.133   2.071  -7.896
  305   2HA   GLY  38          HA1       GLY  38  13.957   1.770  -6.358
  306    H    ASP  39           HN       ASP  39  12.754   3.045  -4.581
  307    HA   ASP  39           HA       ASP  39   9.980   3.164  -4.501
  308   1HB   ASP  39          HB2       ASP  39  10.123   0.782  -4.821
  309   2HB   ASP  39          HB1       ASP  39  11.168   0.646  -3.418
  310    H    VAL  40           HN       VAL  40   9.697   4.534  -3.319
  311    HA   VAL  40           HA       VAL  40   9.570   5.961  -1.628
  312    HB   VAL  40           HB       VAL  40   8.453   4.216  -0.516
  313   1HG1  VAL  40          HG11      VAL  40  10.139   2.424  -0.673
  314   2HG1  VAL  40          HG12      VAL  40   9.352   2.568   0.902
  315   3HG1  VAL  40          HG13      VAL  40  10.986   3.189   0.673
  316   1HG2  VAL  40          HG21      VAL  40   8.920   6.199   0.754
  317   2HG2  VAL  40          HG22      VAL  40  10.423   5.469   1.318
  318   3HG2  VAL  40          HG23      VAL  40   8.876   4.776   1.795
  319    H    THR  41           HN       THR  41  12.025   3.856  -0.595
  320    HA   THR  41           HA       THR  41  14.052   5.915  -0.625
  321    HB   THR  41           HB       THR  41  13.407   4.665   2.043
  322    HG1  THR  41           HG1      THR  41  12.374   6.856   0.791
  323   1HG2  THR  41          HG21      THR  41  15.312   6.880   1.281
  324   2HG2  THR  41          HG22      THR  41  15.773   5.230   1.696
  325   3HG2  THR  41          HG23      THR  41  15.028   6.269   2.910
  326    HA   PRO  42           HA       PRO  42  16.172   1.957   0.317
  327   1HB   PRO  42          HB2       PRO  42  14.355  -0.227   0.864
  328   2HB   PRO  42          HB1       PRO  42  15.626   0.438   1.892
  329   1HG   PRO  42          HG2       PRO  42  12.969   0.733   2.415
  330   2HG   PRO  42          HG1       PRO  42  14.202   1.902   2.926
  331   1HD   PRO  42          HD2       PRO  42  12.351   2.012   0.576
  332   2HD   PRO  42          HD1       PRO  42  12.829   3.305   1.694
  333    H    ASP  43           HN       ASP  43  13.701   2.217  -1.937
  334    HA   ASP  43           HA       ASP  43  14.124   1.905  -4.189
  335   1HB   ASP  43          HB2       ASP  43  16.605   1.449  -3.426
  336   2HB   ASP  43          HB1       ASP  43  16.168  -0.240  -3.634
  337    H    GLY  44           HN       GLY  44  12.875   0.226  -1.893
  338   1HA   GLY  44          HA2       GLY  44  10.961  -1.011  -3.246
  339   2HA   GLY  44          HA1       GLY  44  12.246  -2.219  -3.331
  340    H    ARG  45           HN       ARG  45  10.807  -0.047  -0.963
  341    HA   ARG  45           HA       ARG  45  11.073  -2.087   1.089
  342   1HB   ARG  45          HB2       ARG  45  11.589   0.245   1.598
  343   2HB   ARG  45          HB1       ARG  45   9.970   0.719   1.190
  344   1HG   ARG  45          HG2       ARG  45   9.089  -0.154   3.110
  345   2HG   ARG  45          HG1       ARG  45  10.366  -1.362   3.272
  346   1HD   ARG  45          HD2       ARG  45  11.913   0.263   4.063
  347   2HD   ARG  45          HD1       ARG  45  10.832   1.591   3.638
  348    HE   ARG  45           HE       ARG  45   9.284   0.544   5.356
  349   1HH1  ARG  45          HH11      ARG  45  12.786   0.355   5.604
  350   2HH1  ARG  45          HH12      ARG  45  12.777   0.303   7.344
  351   1HH2  ARG  45          HH21      ARG  45   9.295   0.471   7.626
  352   2HH2  ARG  45          HH22      ARG  45  10.798   0.349   8.488
  353    H    PHE  46           HN       PHE  46   8.453   0.057  -0.042
  354    HA   PHE  46           HA       PHE  46   6.707  -2.213   0.310
  355   1HB   PHE  46          HB2       PHE  46   4.884  -0.765   0.271
  356   2HB   PHE  46          HB1       PHE  46   6.009  -0.269   1.489
  357    HD1  PHE  46           HD1      PHE  46   7.787   1.582  -0.262
  358    HD2  PHE  46           HD2      PHE  46   3.584   1.041  -0.020
  359    HE1  PHE  46           HE1      PHE  46   7.403   3.999  -0.798
  360    HE2  PHE  46           HE2      PHE  46   3.220   3.364  -0.567
  361    HZ   PHE  46           HZ       PHE  46   5.124   4.836  -0.943
  362    H    SER  47           HN       SER  47   6.550  -3.435  -1.267
  363    HA   SER  47           HA       SER  47   6.881  -2.451  -4.001
  364   1HB   SER  47          HB2       SER  47   8.255  -4.382  -3.199
  365   2HB   SER  47          HB1       SER  47   6.770  -5.307  -2.992
  366    HG   SER  47           HG       SER  47   8.218  -4.865  -5.234
  367    H    ILE  48           HN       ILE  48   4.965  -1.559  -4.462
  368    HA   ILE  48           HA       ILE  48   2.459  -2.391  -3.626
  369    HB   ILE  48           HB       ILE  48   1.573  -0.940  -5.454
  370   1HG1  ILE  48          HG12      ILE  48   3.725   0.430  -6.434
  371   2HG1  ILE  48          HG11      ILE  48   4.353  -1.214  -6.408
  372   1HG2  ILE  48          HG21      ILE  48   2.174   0.031  -3.314
  373   2HG2  ILE  48          HG22      ILE  48   2.564   1.148  -4.619
  374   3HG2  ILE  48          HG23      ILE  48   3.844   0.220  -3.844
  375   1HD1  ILE  48          HD11      ILE  48   3.383  -0.656  -8.563
  376   2HD1  ILE  48          HD12      ILE  48   1.833  -0.323  -7.789
  377   3HD1  ILE  48          HD13      ILE  48   2.494  -1.958  -7.776
  378    H    ASP  49           HN       ASP  49   1.262  -4.231  -4.122
  379    HA   ASP  49           HA       ASP  49   1.067  -4.710  -7.032
  380   1HB   ASP  49          HB2       ASP  49   1.698  -6.791  -4.965
  381   2HB   ASP  49          HB1       ASP  49   0.798  -7.229  -6.409
  382    H    THR  50           HN       THR  50  -0.883  -4.626  -7.676
  383    HA   THR  50           HA       THR  50  -3.315  -5.029  -6.558
  384    HB   THR  50           HB       THR  50  -3.036  -4.355  -8.860
  385    HG1  THR  50           HG1      THR  50  -4.559  -6.761  -8.558
  386   1HG2  THR  50          HG21      THR  50  -2.234  -7.212  -9.420
  387   2HG2  THR  50          HG22      THR  50  -1.176  -5.802  -9.500
  388   3HG2  THR  50          HG23      THR  50  -2.519  -5.962 -10.633
  389    H    LEU  51           HN       LEU  51  -1.017  -7.566  -7.349
  390    HA   LEU  51           HA       LEU  51  -2.734  -9.606  -8.043
  391   1HB   LEU  51          HB2       LEU  51  -0.024  -9.851  -6.754
  392   2HB   LEU  51          HB1       LEU  51  -0.847 -11.121  -7.637
  393    HG   LEU  51           HG       LEU  51   0.092  -8.500  -8.810
  394   1HD1  LEU  51          HD11      LEU  51   1.738  -9.873  -9.992
  395   2HD1  LEU  51          HD12      LEU  51   1.188 -11.296  -9.107
  396   3HD1  LEU  51          HD13      LEU  51   1.952  -9.961  -8.244
  397   1HD2  LEU  51          HD21      LEU  51  -1.163 -10.912 -10.119
  398   2HD2  LEU  51          HD22      LEU  51  -0.501  -9.512 -10.963
  399   3HD2  LEU  51          HD23      LEU  51  -1.908  -9.325  -9.916
  400    H    ARG  52           HN       ARG  52  -1.608  -8.828  -4.792
  401    HA   ARG  52           HA       ARG  52  -2.605 -11.110  -3.489
  402   1HB   ARG  52          HB2       ARG  52  -2.525  -8.341  -2.304
  403   2HB   ARG  52          HB1       ARG  52  -2.429  -9.878  -1.455
  404   1HG   ARG  52          HG2       ARG  52  -0.354  -8.759  -3.329
  405   2HG   ARG  52          HG1       ARG  52  -0.259  -8.798  -1.568
  406   1HD   ARG  52          HD2       ARG  52  -0.305 -11.239  -1.619
  407   2HD   ARG  52          HD1       ARG  52  -0.416 -11.204  -3.379
  408    HE   ARG  52           HE       ARG  52   1.815 -10.167  -3.376
  409   1HH1  ARG  52          HH11      ARG  52   0.761 -11.883  -0.514
  410   2HH1  ARG  52          HH12      ARG  52   2.371 -12.214   0.040
  411   1HH2  ARG  52          HH21      ARG  52   3.929 -10.608  -2.660
  412   2HH2  ARG  52          HH22      ARG  52   4.172 -11.466  -1.163
  413    H    CYS  53           HN       CYS  53  -4.026  -8.006  -4.165
  414    HA   CYS  53           HA       CYS  53  -6.448  -8.238  -2.815
  415   1HB   CYS  53          HB2       CYS  53  -5.508  -6.115  -3.550
  416   2HB   CYS  53          HB1       CYS  53  -5.752  -6.578  -5.233
  417    H    VAL  54           HN       VAL  54  -8.620  -8.187  -3.806
  418    HA   VAL  54           HA       VAL  54 -10.312  -9.430  -4.645
  419    HB   VAL  54           HB       VAL  54  -8.487 -10.223  -6.931
  420   1HG1  VAL  54          HG11      VAL  54 -10.575 -10.382  -8.206
  421   2HG1  VAL  54          HG12      VAL  54 -11.488  -9.957  -6.759
  422   3HG1  VAL  54          HG13      VAL  54 -10.580 -11.468  -6.815
  423   1HG2  VAL  54          HG21      VAL  54  -9.344  -8.281  -8.149
  424   2HG2  VAL  54          HG22      VAL  54  -8.444  -7.795  -6.710
  425   3HG2  VAL  54          HG23      VAL  54 -10.209  -7.756  -6.703
  426    H    GLY  55           HN       GLY  55  -8.178 -10.386  -2.924
  427   1HA   GLY  55          HA2       GLY  55  -8.396 -13.278  -3.398
  428   2HA   GLY  55          HA1       GLY  55  -7.015 -12.517  -2.625
  429    H    GLY  56           HN       GLY  56 -10.620 -12.544  -2.137
  430   1HA   GLY  56          HA2       GLY  56 -11.769 -13.196  -0.243
  431   2HA   GLY  56          HA1       GLY  56 -10.340 -14.108   0.198
  432    H    CYS  57           HN       CYS  57 -11.504 -10.643   0.261
  433    HA   CYS  57           HA       CYS  57  -9.591 -10.303   2.531
  434   1HB   CYS  57          HB2       CYS  57 -10.233  -8.055   0.709
  435   2HB   CYS  57          HB1       CYS  57  -8.805  -8.332   1.643
  436    H    ALA  58           HN       ALA  58 -12.548  -9.230   0.867
  437    HA   ALA  58           HA       ALA  58 -12.838  -6.739   1.982
  438   1HB   ALA  58          HB1       ALA  58 -15.151  -6.828   1.300
  439   2HB   ALA  58          HB2       ALA  58 -15.070  -8.583   1.191
  440   3HB   ALA  58          HB3       ALA  58 -14.120  -7.586   0.088
  441    H    LEU  59           HN       LEU  59 -13.824  -9.805   3.546
  442    HA   LEU  59           HA       LEU  59 -15.348  -8.389   5.536
  443   1HB   LEU  59          HB2       LEU  59 -15.642 -10.487   6.647
  444   2HB   LEU  59          HB1       LEU  59 -15.860 -10.725   4.926
  445    HG   LEU  59           HG       LEU  59 -13.272 -11.391   6.334
  446   1HD1  LEU  59          HD11      LEU  59 -15.613 -13.205   5.761
  447   2HD1  LEU  59          HD12      LEU  59 -15.042 -12.713   7.357
  448   3HD1  LEU  59          HD13      LEU  59 -14.025 -13.721   6.327
  449   1HD2  LEU  59          HD21      LEU  59 -13.120 -11.143   3.918
  450   2HD2  LEU  59          HD22      LEU  59 -14.459 -12.273   3.708
  451   3HD2  LEU  59          HD23      LEU  59 -12.931 -12.832   4.388
  452    H    ALA  60           HN       ALA  60 -12.104  -8.453   5.068
  453    HA   ALA  60           HA       ALA  60 -11.724  -7.677   7.885
  454   1HB   ALA  60          HB1       ALA  60  -9.327  -8.018   7.534
  455   2HB   ALA  60          HB2       ALA  60  -9.637  -8.525   5.874
  456   3HB   ALA  60          HB3       ALA  60 -10.232  -9.498   7.220
  457    HA   PRO  61           HA       PRO  61 -10.383  -3.786   5.826
  458   1HB   PRO  61          HB2       PRO  61  -8.672  -3.116   8.058
  459   2HB   PRO  61          HB1       PRO  61 -10.156  -2.312   7.549
  460   1HG   PRO  61          HG2       PRO  61  -9.880  -3.743   9.887
  461   2HG   PRO  61          HG1       PRO  61 -11.426  -3.438   9.075
  462   1HD   PRO  61          HD2       PRO  61  -9.735  -5.897   9.088
  463   2HD   PRO  61          HD1       PRO  61 -11.505  -5.741   9.053
  464    H    ILE  62           HN       ILE  62  -8.846  -4.214   4.279
  465    HA   ILE  62           HA       ILE  62  -6.346  -5.475   5.208
  466    HB   ILE  62           HB       ILE  62  -7.603  -5.530   2.464
  467   1HG1  ILE  62          HG12      ILE  62  -8.676  -7.004   4.107
  468   2HG1  ILE  62          HG11      ILE  62  -7.828  -7.934   2.876
  469   1HG2  ILE  62          HG21      ILE  62  -5.768  -7.042   1.835
  470   2HG2  ILE  62          HG22      ILE  62  -5.001  -6.743   3.394
  471   3HG2  ILE  62          HG23      ILE  62  -5.190  -5.426   2.237
  472   1HD1  ILE  62          HD11      ILE  62  -6.835  -7.365   5.659
  473   2HD1  ILE  62          HD12      ILE  62  -5.975  -8.291   4.429
  474   3HD1  ILE  62          HD13      ILE  62  -7.501  -8.892   5.079
  475    H    VAL  63           HN       VAL  63  -4.567  -4.082   5.297
  476    HA   VAL  63           HA       VAL  63  -4.047  -2.994   2.623
  477    HB   VAL  63           HB       VAL  63  -2.893  -1.654   5.063
  478   1HG1  VAL  63          HG11      VAL  63  -1.735  -1.323   2.956
  479   2HG1  VAL  63          HG12      VAL  63  -2.490   0.178   3.492
  480   3HG1  VAL  63          HG13      VAL  63  -3.231  -0.768   2.202
  481   1HG2  VAL  63          HG21      VAL  63  -4.560   0.122   4.840
  482   2HG2  VAL  63          HG22      VAL  63  -5.311  -1.422   5.248
  483   3HG2  VAL  63          HG23      VAL  63  -5.390  -0.812   3.595
  484    H    MET  64           HN       MET  64  -2.172  -4.036   1.825
  485    HA   MET  64           HA       MET  64  -0.666  -5.405   3.958
  486   1HB   MET  64          HB2       MET  64  -1.987  -6.784   2.281
  487   2HB   MET  64          HB1       MET  64  -0.831  -6.242   1.072
  488   1HG   MET  64          HG2       MET  64   0.958  -7.312   2.190
  489   2HG   MET  64          HG1       MET  64  -0.071  -7.643   3.584
  490   1HE   MET  64          HE1       MET  64   1.693  -9.902   2.194
  491   2HE   MET  64          HE2       MET  64   0.548 -11.239   2.105
  492   3HE   MET  64          HE3       MET  64   0.623 -10.237   3.553
  493    H    VAL  65           HN       VAL  65   1.381  -4.825   4.216
  494    HA   VAL  65           HA       VAL  65   2.906  -4.405   1.728
  495    HB   VAL  65           HB       VAL  65   4.691  -3.602   3.552
  496   1HG1  VAL  65          HG11      VAL  65   4.132  -1.293   3.068
  497   2HG1  VAL  65          HG12      VAL  65   2.532  -1.781   2.505
  498   3HG1  VAL  65          HG13      VAL  65   3.973  -2.287   1.621
  499   1HG2  VAL  65          HG21      VAL  65   2.038  -2.842   4.750
  500   2HG2  VAL  65          HG22      VAL  65   3.612  -2.236   5.278
  501   3HG2  VAL  65          HG23      VAL  65   3.223  -3.950   5.441
  502    H    GLY  66           HN       GLY  66   3.859  -6.325   1.304
  503   1HA   GLY  66          HA2       GLY  66   4.730  -8.412   1.603
  504   2HA   GLY  66          HA1       GLY  66   5.709  -7.596   2.827
  505    H    GLU  67           HN       GLU  67   5.770  -9.385   3.999
  506    HA   GLU  67           HA       GLU  67   3.408 -10.500   5.231
  507   1HB   GLU  67          HB2       GLU  67   6.233 -10.808   6.241
  508   2HB   GLU  67          HB1       GLU  67   4.888 -11.927   6.408
  509   1HG   GLU  67          HG2       GLU  67   6.285 -11.274   3.823
  510   2HG   GLU  67          HG1       GLU  67   6.593 -12.696   4.812
  511    H    LYS  68           HN       LYS  68   3.751  -7.646   5.405
  512    HA   LYS  68           HA       LYS  68   4.309  -7.240   8.251
  513   1HB   LYS  68          HB2       LYS  68   4.106  -5.088   6.136
  514   2HB   LYS  68          HB1       LYS  68   4.733  -4.919   7.767
  515   1HG   LYS  68          HG2       LYS  68   6.029  -6.440   5.484
  516   2HG   LYS  68          HG1       LYS  68   6.572  -4.910   6.166
  517   1HD   LYS  68          HD2       LYS  68   6.481  -7.589   7.576
  518   2HD   LYS  68          HD1       LYS  68   7.920  -6.712   7.057
  519   1HE   LYS  68          HE2       LYS  68   5.953  -5.629   9.067
  520   2HE   LYS  68          HE1       LYS  68   7.374  -6.569   9.514
  521   1HZ   LYS  68          HZ1       LYS  68   8.772  -4.900   8.481
  522   2HZ   LYS  68          HZ2       LYS  68   7.788  -4.195   9.670
  523   3HZ   LYS  68          HZ3       LYS  68   7.408  -3.997   8.034
  524    H    VAL  69           HN       VAL  69   2.074  -6.668   5.667
  525    HA   VAL  69           HA       VAL  69  -0.072  -5.859   5.547
  526    HB   VAL  69           HB       VAL  69  -0.309  -7.623   7.978
  527   1HG1  VAL  69          HG11      VAL  69  -2.693  -7.790   7.399
  528   2HG1  VAL  69          HG12      VAL  69  -2.463  -6.583   6.131
  529   3HG1  VAL  69          HG13      VAL  69  -2.240  -6.139   7.825
  530   1HG2  VAL  69          HG21      VAL  69  -1.086  -9.294   6.337
  531   2HG2  VAL  69          HG22      VAL  69   0.575  -8.782   6.039
  532   3HG2  VAL  69          HG23      VAL  69  -0.736  -8.150   5.037
  533    H    TYR  70           HN       TYR  70  -0.367  -3.735   5.832
  534    HA   TYR  70           HA       TYR  70  -0.491  -2.660   8.572
  535   1HB   TYR  70          HB2       TYR  70   0.671  -1.437   6.060
  536   2HB   TYR  70          HB1       TYR  70   0.279  -0.487   7.492
  537    HD1  TYR  70           HD1      TYR  70   1.300  -3.702   8.476
  538    HD2  TYR  70           HD2      TYR  70   2.831   0.024   7.147
  539    HE1  TYR  70           HE1      TYR  70   3.431  -4.243   9.455
  540    HE2  TYR  70           HE2      TYR  70   4.993  -0.505   8.138
  541    HH   TYR  70           HH       TYR  70   5.807  -3.641   9.253
  542    H    GLY  71           HN       GLY  71  -1.159  -0.026   7.609
  543   1HA   GLY  71          HA2       GLY  71  -3.827  -0.327   6.452
  544   2HA   GLY  71          HA1       GLY  71  -3.682   0.406   8.043
  545    H    ASN  72           HN       ASN  72  -1.248   0.871   5.600
  546    HA   ASN  72           HA       ASN  72  -1.678   3.740   5.605
  547   1HB   ASN  72          HB2       ASN  72   0.639   3.009   5.612
  548   2HB   ASN  72          HB1       ASN  72   0.376   1.941   4.243
  549   1HD2  ASN  72          HD21      ASN  72  -0.014   2.876   2.195
  550   2HD2  ASN  72          HD22      ASN  72   0.582   4.461   1.846
  551    H    VAL  73           HN       VAL  73  -3.206   4.666   4.208
  552    HA   VAL  73           HA       VAL  73  -3.552   3.343   1.644
  553    HB   VAL  73           HB       VAL  73  -6.047   3.489   1.859
  554   1HG1  VAL  73          HG11      VAL  73  -4.772   1.444   1.811
  555   2HG1  VAL  73          HG12      VAL  73  -6.083   1.307   2.987
  556   3HG1  VAL  73          HG13      VAL  73  -4.428   1.597   3.535
  557   1HG2  VAL  73          HG21      VAL  73  -6.487   4.722   3.802
  558   2HG2  VAL  73          HG22      VAL  73  -5.230   3.896   4.716
  559   3HG2  VAL  73          HG23      VAL  73  -6.726   3.054   4.318
  560    H    THR  74           HN       THR  74  -5.502   5.923   3.102
  561    HA   THR  74           HA       THR  74  -4.636   7.680   1.000
  562    HB   THR  74           HB       THR  74  -6.256   6.224  -0.144
  563    HG1  THR  74           HG1      THR  74  -6.466   8.003  -1.261
  564   1HG2  THR  74          HG21      THR  74  -7.766   5.848   1.792
  565   2HG2  THR  74          HG22      THR  74  -8.628   6.396   0.350
  566   3HG2  THR  74          HG23      THR  74  -8.307   7.523   1.670
  567    HA   PRO  75           HA       PRO  75  -7.833  10.149   3.612
  568   1HB   PRO  75          HB2       PRO  75  -8.211   8.824   6.170
  569   2HB   PRO  75          HB1       PRO  75  -9.419   9.245   4.956
  570   1HG   PRO  75          HG2       PRO  75  -8.723   6.684   5.521
  571   2HG   PRO  75          HG1       PRO  75  -9.279   7.204   3.919
  572   1HD   PRO  75          HD2       PRO  75  -6.481   6.739   4.895
  573   2HD   PRO  75          HD1       PRO  75  -7.230   6.257   3.357
  574    H    GLY  76           HN       GLY  76  -5.249  10.544   3.570
  575   1HA   GLY  76          HA2       GLY  76  -3.628  11.805   4.611
  576   2HA   GLY  76          HA1       GLY  76  -4.656  11.893   6.035
  577    H    GLN  77           HN       GLN  77  -4.515   8.730   5.299
  578    HA   GLN  77           HA       GLN  77  -3.024   8.246   7.717
  579   1HB   GLN  77          HB2       GLN  77  -3.965   6.111   5.777
  580   2HB   GLN  77          HB1       GLN  77  -3.660   5.954   7.505
  581   1HG   GLN  77          HG2       GLN  77  -5.604   7.645   7.743
  582   2HG   GLN  77          HG1       GLN  77  -5.984   7.156   6.091
  583   1HE2  GLN  77          HE21      GLN  77  -5.086   4.447   6.416
  584   2HE2  GLN  77          HE22      GLN  77  -6.247   3.646   7.421
  585    H    VAL  78           HN       VAL  78  -2.726   7.966   4.362
  586    HA   VAL  78           HA       VAL  78  -0.581   6.343   3.991
  587    HB   VAL  78           HB       VAL  78  -0.255   8.313   2.126
  588   1HG1  VAL  78          HG11      VAL  78  -1.588   6.841   0.665
  589   2HG1  VAL  78          HG12      VAL  78  -2.138   5.976   2.102
  590   3HG1  VAL  78          HG13      VAL  78  -0.430   5.949   1.652
  591   1HG2  VAL  78          HG21      VAL  78  -3.186   8.099   2.476
  592   2HG2  VAL  78          HG22      VAL  78  -2.244   9.254   1.520
  593   3HG2  VAL  78          HG23      VAL  78  -2.247   9.360   3.296
  594    H    LYS  79           HN       LYS  79  -0.580   9.874   4.596
  595    HA   LYS  79           HA       LYS  79   2.082  10.254   3.836
  596   1HB   LYS  79          HB2       LYS  79   0.422  11.842   5.811
  597   2HB   LYS  79          HB1       LYS  79   1.917  12.391   5.065
  598   1HG   LYS  79          HG2       LYS  79   0.900  12.427   2.899
  599   2HG   LYS  79          HG1       LYS  79  -0.563  11.667   3.523
  600   1HD   LYS  79          HD2       LYS  79   0.469  14.373   4.367
  601   2HD   LYS  79          HD1       LYS  79  -0.802  14.106   3.172
  602   1HE   LYS  79          HE2       LYS  79  -2.110  12.911   4.920
  603   2HE   LYS  79          HE1       LYS  79  -0.871  13.356   6.093
  604   1HZ   LYS  79          HZ1       LYS  79  -1.329  15.688   5.635
  605   2HZ   LYS  79          HZ2       LYS  79  -2.728  14.890   6.164
  606   3HZ   LYS  79          HZ3       LYS  79  -2.530  15.252   4.517
  607    H    LYS  80           HN       LYS  80   0.572   9.527   6.902
  608    HA   LYS  80           HA       LYS  80   3.101   9.788   8.279
  609   1HB   LYS  80          HB2       LYS  80   1.089   8.861  10.021
  610   2HB   LYS  80          HB1       LYS  80   1.804  10.458   9.930
  611   1HG   LYS  80          HG2       LYS  80  -0.364  11.015   9.637
  612   2HG   LYS  80          HG1       LYS  80   0.076  10.750   7.948
  613   1HD   LYS  80          HD2       LYS  80  -2.064   9.730   8.675
  614   2HD   LYS  80          HD1       LYS  80  -0.925   8.606   7.943
  615   1HE   LYS  80          HE2       LYS  80  -1.897   7.546   9.866
  616   2HE   LYS  80          HE1       LYS  80  -0.233   7.961  10.276
  617   1HZ   LYS  80          HZ1       LYS  80  -2.700   9.379  11.113
  618   2HZ   LYS  80          HZ2       LYS  80  -1.141   9.996  11.362
  619   3HZ   LYS  80          HZ3       LYS  80  -1.606   8.542  12.103
  620    H    ILE  81           HN       ILE  81   0.752   7.332   7.453
  621    HA   ILE  81           HA       ILE  81   2.227   5.240   8.738
  622    HB   ILE  81           HB       ILE  81   0.202   4.896   6.508
  623   1HG1  ILE  81          HG12      ILE  81  -0.763   6.173   8.398
  624   2HG1  ILE  81          HG11      ILE  81  -1.466   4.564   8.272
  625   1HG2  ILE  81          HG21      ILE  81  -0.088   2.656   7.532
  626   2HG2  ILE  81          HG22      ILE  81   1.186   3.030   8.694
  627   3HG2  ILE  81          HG23      ILE  81   1.568   2.907   6.975
  628   1HD1  ILE  81          HD11      ILE  81  -1.049   5.179  10.579
  629   2HD1  ILE  81          HD12      ILE  81   0.663   5.405  10.220
  630   3HD1  ILE  81          HD13      ILE  81  -0.058   3.800  10.103
  631    H    LEU  82           HN       LEU  82   2.598   6.998   5.822
  632    HA   LEU  82           HA       LEU  82   4.127   5.229   4.301
  633   1HB   LEU  82          HB2       LEU  82   3.463   7.364   3.396
  634   2HB   LEU  82          HB1       LEU  82   4.328   8.216   4.667
  635    HG   LEU  82           HG       LEU  82   6.466   7.361   3.786
  636   1HD1  LEU  82          HD11      LEU  82   6.526   6.369   1.545
  637   2HD1  LEU  82          HD12      LEU  82   4.763   6.296   1.538
  638   3HD1  LEU  82          HD13      LEU  82   5.682   5.342   2.703
  639   1HD2  LEU  82          HD21      LEU  82   4.784   8.844   1.766
  640   2HD2  LEU  82          HD22      LEU  82   6.547   8.820   1.833
  641   3HD2  LEU  82          HD23      LEU  82   5.625   9.567   3.138
  642    H    ALA  83           HN       ALA  83   5.064   7.363   6.991
  643    HA   ALA  83           HA       ALA  83   7.785   6.706   7.081
  644   1HB   ALA  83          HB1       ALA  83   6.802   8.468   8.471
  645   2HB   ALA  83          HB2       ALA  83   7.697   7.309   9.455
  646   3HB   ALA  83          HB3       ALA  83   5.934   7.251   9.406
  647    H    GLU  84           HN       GLU  84   4.940   5.017   8.118
  648    HA   GLU  84           HA       GLU  84   6.219   2.878   9.477
  649   1HB   GLU  84          HB2       GLU  84   3.548   3.689   8.802
  650   2HB   GLU  84          HB1       GLU  84   3.768   1.968   8.516
  651   1HG   GLU  84          HG2       GLU  84   2.926   2.433  10.764
  652   2HG   GLU  84          HG1       GLU  84   4.509   1.654  10.788
  653    H    TYR  85           HN       TYR  85   5.449   3.512   6.128
  654    HA   TYR  85           HA       TYR  85   5.420   0.785   5.411
  655   1HB   TYR  85          HB2       TYR  85   4.885   3.335   4.096
  656   2HB   TYR  85          HB1       TYR  85   5.491   2.053   3.057
  657    HD1  TYR  85           HD1      TYR  85   3.841   1.274   6.051
  658    HD2  TYR  85           HD2      TYR  85   3.367   1.811   1.959
  659    HE1  TYR  85           HE1      TYR  85   1.851  -0.016   6.190
  660    HE2  TYR  85           HE2      TYR  85   1.302   0.521   2.074
  661    HH   TYR  85           HH       TYR  85   0.154  -1.083   3.384
  Start of MODEL   13
    1   1H    MET   1          HT1       MET   1   9.179  -8.089  15.002
    2   2H    MET   1          HT2       MET   1   7.600  -8.477  15.472
    3   3H    MET   1          HT3       MET   1   8.006  -8.432  13.826
    4    HA   MET   1           HA       MET   1   9.088 -10.330  15.827
    5   1HB   MET   1          HB2       MET   1   6.755 -10.803  15.340
    6   2HB   MET   1          HB1       MET   1   7.063 -10.708  13.613
    7   1HG   MET   1          HG2       MET   1   8.518 -12.680  13.779
    8   2HG   MET   1          HG1       MET   1   8.153 -12.782  15.503
    9   1HE   MET   1          HE1       MET   1   7.425 -15.342  15.075
   10   2HE   MET   1          HE2       MET   1   7.741 -15.159  13.351
   11   3HE   MET   1          HE3       MET   1   6.199 -15.816  13.900
   12    H    VAL   2           HN       VAL   2   8.680  -9.816  12.306
   13    HA   VAL   2           HA       VAL   2  11.428 -10.841  11.986
   14    HB   VAL   2           HB       VAL   2   9.125 -11.148  10.047
   15   1HG1  VAL   2          HG11      VAL   2  11.280 -10.859   8.916
   16   2HG1  VAL   2          HG12      VAL   2  10.663 -12.497   8.721
   17   3HG1  VAL   2          HG13      VAL   2  11.958 -12.177   9.872
   18   1HG2  VAL   2          HG21      VAL   2   9.299 -13.536  10.537
   19   2HG2  VAL   2          HG22      VAL   2   8.930 -12.613  11.993
   20   3HG2  VAL   2          HG23      VAL   2  10.567 -13.206  11.717
   21    HA   PRO   3           HA       PRO   3  11.884  -6.701  10.291
   22   1HB   PRO   3          HB2       PRO   3  14.725  -7.188  10.259
   23   2HB   PRO   3          HB1       PRO   3  13.807  -6.131  11.331
   24   1HG   PRO   3          HG2       PRO   3  15.074  -8.434  12.138
   25   2HG   PRO   3          HG1       PRO   3  13.701  -7.696  12.982
   26   1HD   PRO   3          HD2       PRO   3  13.753 -10.031  11.120
   27   2HD   PRO   3          HD1       PRO   3  12.776  -9.771  12.580
   28    H    LYS   4           HN       LYS   4  11.651  -6.271   8.208
   29    HA   LYS   4           HA       LYS   4  13.259  -7.789   6.269
   30   1HB   LYS   4          HB2       LYS   4  10.377  -6.954   6.048
   31   2HB   LYS   4          HB1       LYS   4  11.335  -7.438   4.656
   32   1HG   LYS   4          HG2       LYS   4  10.806  -9.166   7.066
   33   2HG   LYS   4          HG1       LYS   4   9.932  -9.256   5.535
   34   1HD   LYS   4          HD2       LYS   4  11.957  -9.855   4.365
   35   2HD   LYS   4          HD1       LYS   4  12.910  -9.630   5.833
   36   1HE   LYS   4          HE2       LYS   4  12.555 -11.977   5.503
   37   2HE   LYS   4          HE1       LYS   4  11.610 -11.453   6.894
   38   1HZ   LYS   4          HZ1       LYS   4   9.640 -11.385   5.458
   39   2HZ   LYS   4          HZ2       LYS   4  10.332 -12.932   5.509
   40   3HZ   LYS   4          HZ3       LYS   4  10.566 -11.947   4.153
   41    H    GLY   5           HN       GLY   5  11.075  -5.106   5.888
   42   1HA   GLY   5          HA2       GLY   5  11.732  -2.810   5.673
   43   2HA   GLY   5          HA1       GLY   5  13.325  -3.361   5.187
   44    H    LYS   6           HN       LYS   6  11.146  -5.261   3.651
   45    HA   LYS   6           HA       LYS   6  10.854  -3.486   1.365
   46   1HB   LYS   6          HB2       LYS   6  11.809  -5.119  -0.174
   47   2HB   LYS   6          HB1       LYS   6  12.987  -4.655   1.049
   48   1HG   LYS   6          HG2       LYS   6  11.322  -7.135   1.319
   49   2HG   LYS   6          HG1       LYS   6  12.843  -7.122   0.426
   50   1HD   LYS   6          HD2       LYS   6  12.463  -6.406   3.350
   51   2HD   LYS   6          HD1       LYS   6  13.181  -7.897   2.712
   52   1HE   LYS   6          HE2       LYS   6  14.277  -5.130   2.223
   53   2HE   LYS   6          HE1       LYS   6  14.866  -6.235   3.463
   54   1HZ   LYS   6          HZ1       LYS   6  15.823  -7.605   1.916
   55   2HZ   LYS   6          HZ2       LYS   6  16.024  -6.105   1.154
   56   3HZ   LYS   6          HZ3       LYS   6  14.776  -7.144   0.666
   57    H    TYR   7           HN       TYR   7   8.842  -3.990   2.823
   58    HA   TYR   7           HA       TYR   7   7.360  -6.310   2.430
   59   1HB   TYR   7          HB2       TYR   7   6.040  -3.708   2.906
   60   2HB   TYR   7          HB1       TYR   7   5.840  -5.250   3.742
   61    HD1  TYR   7           HD1      TYR   7   8.018  -6.053   5.002
   62    HD2  TYR   7           HD2      TYR   7   7.049  -2.066   3.984
   63    HE1  TYR   7           HE1      TYR   7   9.485  -5.268   6.773
   64    HE2  TYR   7           HE2      TYR   7   8.459  -1.245   5.743
   65    HH   TYR   7           HH       TYR   7  10.778  -3.227   7.335
   66    HA   PRO   8           HA       PRO   8   5.737  -5.066  -1.722
   67   1HB   PRO   8          HB2       PRO   8   4.630  -7.818  -1.596
   68   2HB   PRO   8          HB1       PRO   8   5.637  -7.072  -2.843
   69   1HG   PRO   8          HG2       PRO   8   6.611  -8.956  -1.217
   70   2HG   PRO   8          HG1       PRO   8   7.608  -7.585  -1.740
   71   1HD   PRO   8          HD2       PRO   8   6.173  -7.995   0.863
   72   2HD   PRO   8          HD1       PRO   8   7.818  -7.388   0.568
   73    H    ILE   9           HN       ILE   9   3.782  -4.108  -1.921
   74    HA   ILE   9           HA       ILE   9   1.892  -4.272   0.216
   75    HB   ILE   9           HB       ILE   9   2.607  -2.401  -1.736
   76   1HG1  ILE   9          HG12      ILE   9   2.106  -1.919   0.611
   77   2HG1  ILE   9          HG11      ILE   9   1.194  -0.867  -0.463
   78   1HG2  ILE   9          HG21      ILE   9   0.469  -1.660  -2.664
   79   2HG2  ILE   9          HG22      ILE   9  -0.294  -3.113  -2.021
   80   3HG2  ILE   9          HG23      ILE   9   0.955  -3.246  -3.259
   81   1HD1  ILE   9          HD11      ILE   9  -0.212  -1.561   1.335
   82   2HD1  ILE   9          HD12      ILE   9   0.168  -3.256   1.039
   83   3HD1  ILE   9          HD13      ILE   9  -0.770  -2.342  -0.144
   84    H    SER  10           HN       SER  10  -0.344  -4.676   0.030
   85    HA   SER  10           HA       SER  10  -1.291  -6.223  -2.261
   86   1HB   SER  10          HB2       SER  10  -1.689  -7.123   0.603
   87   2HB   SER  10          HB1       SER  10  -2.128  -7.999  -0.867
   88    HG   SER  10           HG       SER  10   0.498  -7.328  -0.852
   89    H    VAL  11           HN       VAL  11  -2.800  -4.811  -2.911
   90    HA   VAL  11           HA       VAL  11  -4.728  -3.749  -0.942
   91    HB   VAL  11           HB       VAL  11  -4.549  -2.345  -3.511
   92   1HG1  VAL  11          HG11      VAL  11  -5.919  -1.527  -1.699
   93   2HG1  VAL  11          HG12      VAL  11  -4.623  -0.379  -2.032
   94   3HG1  VAL  11          HG13      VAL  11  -4.514  -1.449  -0.636
   95   1HG2  VAL  11          HG21      VAL  11  -2.205  -2.363  -1.623
   96   2HG2  VAL  11          HG22      VAL  11  -2.482  -1.112  -2.843
   97   3HG2  VAL  11          HG23      VAL  11  -2.219  -2.789  -3.343
   98    H    CYS  12           HN       CYS  12  -6.807  -4.466  -1.234
   99    HA   CYS  12           HA       CYS  12  -7.497  -6.117  -3.418
  100   1HB   CYS  12          HB2       CYS  12  -8.735  -6.356  -1.366
  101   2HB   CYS  12          HB1       CYS  12  -9.255  -4.675  -1.427
  102    H    MET  13           HN       MET  13  -7.835  -5.557  -5.412
  103    HA   MET  13           HA       MET  13  -9.279  -3.054  -5.966
  104   1HB   MET  13          HB2       MET  13  -7.209  -4.434  -7.697
  105   2HB   MET  13          HB1       MET  13  -8.134  -3.011  -8.163
  106   1HG   MET  13          HG2       MET  13  -7.116  -1.747  -6.341
  107   2HG   MET  13          HG1       MET  13  -6.200  -3.173  -5.864
  108   1HE   MET  13          HE1       MET  13  -3.974  -1.810  -5.920
  109   2HE   MET  13          HE2       MET  13  -4.825  -0.346  -6.413
  110   3HE   MET  13          HE3       MET  13  -3.404  -0.883  -7.308
  111    H    GLY  14           HN       GLY  14 -10.179  -5.777  -5.327
  112   1HA   GLY  14          HA2       GLY  14 -10.994  -7.143  -7.671
  113   2HA   GLY  14          HA1       GLY  14 -11.629  -7.396  -6.053
  114    H    THR  15           HN       THR  15 -13.536  -7.722  -7.662
  115    HA   THR  15           HA       THR  15 -14.571  -5.470  -9.025
  116    HB   THR  15           HB       THR  15 -16.090  -7.952  -8.215
  117    HG1  THR  15           HG1      THR  15 -13.911  -7.832  -9.639
  118   1HG2  THR  15          HG21      THR  15 -17.496  -6.156  -9.105
  119   2HG2  THR  15          HG22      THR  15 -17.381  -7.487 -10.258
  120   3HG2  THR  15          HG23      THR  15 -16.442  -6.018 -10.512
  121    H    ALA  16           HN       ALA  16 -15.486  -7.003  -5.945
  122    HA   ALA  16           HA       ALA  16 -17.644  -5.219  -5.448
  123   1HB   ALA  16          HB1       ALA  16 -16.150  -6.932  -3.475
  124   2HB   ALA  16          HB2       ALA  16 -17.497  -7.472  -4.475
  125   3HB   ALA  16          HB3       ALA  16 -17.748  -6.222  -3.260
  126    H    CYS  17           HN       CYS  17 -14.397  -5.435  -3.993
  127    HA   CYS  17           HA       CYS  17 -14.881  -3.313  -2.198
  128   1HB   CYS  17          HB2       CYS  17 -12.313  -4.593  -3.095
  129   2HB   CYS  17          HB1       CYS  17 -12.426  -3.455  -1.785
  130    H    PHE  18           HN       PHE  18 -13.435  -3.373  -5.414
  131    HA   PHE  18           HA       PHE  18 -12.090  -0.900  -5.284
  132   1HB   PHE  18          HB2       PHE  18 -11.618  -2.650  -6.968
  133   2HB   PHE  18          HB1       PHE  18 -13.148  -2.276  -7.757
  134    HD1  PHE  18           HD1      PHE  18  -9.906  -0.758  -6.759
  135    HD2  PHE  18           HD2      PHE  18 -13.252  -0.631  -9.386
  136    HE1  PHE  18           HE1      PHE  18  -8.789   0.979  -8.094
  137    HE2  PHE  18           HE2      PHE  18 -12.139   1.106 -10.726
  138    HZ   PHE  18           HZ       PHE  18  -9.897   1.915 -10.074
  139    H    VAL  19           HN       VAL  19 -15.445  -1.602  -5.897
  140    HA   VAL  19           HA       VAL  19 -15.961   0.672  -7.528
  141    HB   VAL  19           HB       VAL  19 -18.322   0.180  -7.292
  142   1HG1  VAL  19          HG11      VAL  19 -18.317  -2.104  -8.195
  143   2HG1  VAL  19          HG12      VAL  19 -16.636  -2.280  -7.694
  144   3HG1  VAL  19          HG13      VAL  19 -17.072  -1.087  -8.916
  145   1HG2  VAL  19          HG21      VAL  19 -19.100  -1.702  -5.923
  146   2HG2  VAL  19          HG22      VAL  19 -18.405  -0.411  -4.942
  147   3HG2  VAL  19          HG23      VAL  19 -17.477  -1.878  -5.256
  148    H    LYS  20           HN       LYS  20 -15.589   0.327  -4.184
  149    HA   LYS  20           HA       LYS  20 -17.507   2.310  -3.375
  150   1HB   LYS  20          HB2       LYS  20 -15.288   0.915  -1.877
  151   2HB   LYS  20          HB1       LYS  20 -16.414   2.038  -1.136
  152   1HG   LYS  20          HG2       LYS  20 -18.271   0.541  -1.738
  153   2HG   LYS  20          HG1       LYS  20 -17.103  -0.598  -2.416
  154   1HD   LYS  20          HD2       LYS  20 -16.049  -0.858  -0.252
  155   2HD   LYS  20          HD1       LYS  20 -17.110   0.365   0.442
  156   1HE   LYS  20          HE2       LYS  20 -19.047  -1.080  -0.032
  157   2HE   LYS  20          HE1       LYS  20 -17.952  -2.309  -0.665
  158   1HZ   LYS  20          HZ1       LYS  20 -16.936  -2.522   1.489
  159   2HZ   LYS  20          HZ2       LYS  20 -18.615  -2.712   1.658
  160   3HZ   LYS  20          HZ3       LYS  20 -17.876  -1.257   2.113
  161    H    GLY  21           HN       GLY  21 -15.054   2.919  -5.190
  162   1HA   GLY  21          HA2       GLY  21 -14.100   5.035  -5.566
  163   2HA   GLY  21          HA1       GLY  21 -14.493   5.478  -3.907
  164    H    ALA  22           HN       ALA  22 -12.843   2.553  -4.866
  165    HA   ALA  22           HA       ALA  22 -10.821   2.990  -2.909
  166   1HB   ALA  22          HB1       ALA  22  -9.914   0.855  -3.659
  167   2HB   ALA  22          HB2       ALA  22 -10.990   0.881  -5.057
  168   3HB   ALA  22          HB3       ALA  22 -11.661   0.752  -3.430
  169    H    ASP  23           HN       ASP  23 -11.145   3.728  -6.255
  170    HA   ASP  23           HA       ASP  23  -8.506   3.782  -7.113
  171   1HB   ASP  23          HB2       ASP  23 -10.239   4.238  -8.703
  172   2HB   ASP  23          HB1       ASP  23 -10.828   5.611  -7.766
  173    H    LYS  24           HN       LYS  24 -10.334   6.287  -5.359
  174    HA   LYS  24           HA       LYS  24  -8.265   8.212  -5.576
  175   1HB   LYS  24          HB2       LYS  24 -10.425   8.155  -3.462
  176   2HB   LYS  24          HB1       LYS  24  -9.556   9.561  -4.065
  177   1HG   LYS  24          HG2       LYS  24 -11.596   7.905  -5.527
  178   2HG   LYS  24          HG1       LYS  24 -11.737   9.587  -5.007
  179   1HD   LYS  24          HD2       LYS  24 -10.077  10.284  -6.576
  180   2HD   LYS  24          HD1       LYS  24  -9.675   8.612  -6.975
  181   1HE   LYS  24          HE2       LYS  24 -12.083   8.380  -7.745
  182   2HE   LYS  24          HE1       LYS  24 -12.177  10.138  -7.630
  183   1HZ   LYS  24          HZ1       LYS  24 -10.203   8.649  -9.274
  184   2HZ   LYS  24          HZ2       LYS  24 -10.401  10.337  -9.218
  185   3HZ   LYS  24          HZ3       LYS  24 -11.626   9.357  -9.871
  186    H    VAL  25           HN       VAL  25  -9.073   5.839  -3.083
  187    HA   VAL  25           HA       VAL  25  -7.250   6.923  -1.207
  188    HB   VAL  25           HB       VAL  25  -7.501   4.672  -0.134
  189   1HG1  VAL  25          HG11      VAL  25  -9.774   5.127   0.659
  190   2HG1  VAL  25          HG12      VAL  25 -10.011   6.222  -0.704
  191   3HG1  VAL  25          HG13      VAL  25  -8.820   6.608   0.539
  192   1HG2  VAL  25          HG21      VAL  25  -9.376   3.267  -0.833
  193   2HG2  VAL  25          HG22      VAL  25  -8.075   3.314  -2.023
  194   3HG2  VAL  25          HG23      VAL  25  -9.542   4.259  -2.282
  195    H    VAL  26           HN       VAL  26  -7.098   4.234  -3.511
  196    HA   VAL  26           HA       VAL  26  -4.435   3.560  -2.789
  197    HB   VAL  26           HB       VAL  26  -4.315   2.240  -4.825
  198   1HG1  VAL  26          HG11      VAL  26  -6.200   0.748  -4.462
  199   2HG1  VAL  26          HG12      VAL  26  -7.037   2.007  -3.553
  200   3HG1  VAL  26          HG13      VAL  26  -5.539   1.314  -2.929
  201   1HG2  VAL  26          HG21      VAL  26  -5.354   3.787  -6.379
  202   2HG2  VAL  26          HG22      VAL  26  -6.917   3.534  -5.604
  203   3HG2  VAL  26          HG23      VAL  26  -6.132   2.205  -6.460
  204    H    HIS  27           HN       HIS  27  -5.844   5.989  -4.917
  205    HA   HIS  27           HA       HIS  27  -3.577   6.488  -6.492
  206   1HB   HIS  27          HB2       HIS  27  -5.964   7.451  -6.767
  207   2HB   HIS  27          HB1       HIS  27  -5.408   8.706  -5.653
  208    HD1  HIS  27           HD1      HIS  27  -3.027   9.872  -6.481
  209    HD2  HIS  27           HD2      HIS  27  -5.387   8.003  -9.355
  210    HE1  HIS  27           HE1      HIS  27  -2.168  10.680  -8.689
  211    HE2  HIS  27           HE2      HIS  27  -3.518   9.449 -10.417
  212    H    ALA  28           HN       ALA  28  -4.571   7.765  -3.415
  213    HA   ALA  28           HA       ALA  28  -2.507   9.568  -2.948
  214   1HB   ALA  28          HB1       ALA  28  -4.418   9.306  -1.433
  215   2HB   ALA  28          HB2       ALA  28  -2.889   9.200  -0.563
  216   3HB   ALA  28          HB3       ALA  28  -3.799   7.733  -0.926
  217    H    PHE  29           HN       PHE  29  -2.672   6.111  -2.244
  218    HA   PHE  29           HA       PHE  29  -0.169   5.502  -1.274
  219   1HB   PHE  29          HB2       PHE  29  -2.078   3.938  -1.715
  220   2HB   PHE  29          HB1       PHE  29  -1.645   3.962  -3.415
  221    HD1  PHE  29           HD1      PHE  29   0.118   3.551  -0.186
  222    HD2  PHE  29           HD2      PHE  29  -0.488   2.143  -4.147
  223    HE1  PHE  29           HE1      PHE  29   1.746   1.788   0.201
  224    HE2  PHE  29           HE2      PHE  29   1.152   0.346  -3.764
  225    HZ   PHE  29           HZ       PHE  29   2.276   0.164  -1.579
  226    H    LYS  30           HN       LYS  30  -1.182   5.534  -4.644
  227    HA   LYS  30           HA       LYS  30   1.145   4.868  -5.900
  228   1HB   LYS  30          HB2       LYS  30  -1.005   6.767  -6.781
  229   2HB   LYS  30          HB1       LYS  30   0.321   6.295  -7.834
  230   1HG   LYS  30          HG2       LYS  30  -1.618   4.379  -6.561
  231   2HG   LYS  30          HG1       LYS  30  -1.744   4.998  -8.208
  232   1HD   LYS  30          HD2       LYS  30   0.423   4.008  -8.751
  233   2HD   LYS  30          HD1       LYS  30   0.568   3.407  -7.101
  234   1HE   LYS  30          HE2       LYS  30  -1.386   2.001  -7.419
  235   2HE   LYS  30          HE1       LYS  30  -1.606   2.642  -9.046
  236   1HZ   LYS  30          HZ1       LYS  30  -0.496   0.481  -9.048
  237   2HZ   LYS  30          HZ2       LYS  30   0.775   1.122  -8.120
  238   3HZ   LYS  30          HZ3       LYS  30   0.499   1.692  -9.694
  239    H    GLU  31           HN       GLU  31   0.182   8.128  -5.072
  240    HA   GLU  31           HA       GLU  31   2.703   9.144  -6.112
  241   1HB   GLU  31          HB2       GLU  31   1.743  11.384  -5.572
  242   2HB   GLU  31          HB1       GLU  31   0.762  10.434  -6.675
  243   1HG   GLU  31          HG2       GLU  31  -0.597   9.746  -4.647
  244   2HG   GLU  31          HG1       GLU  31   0.259  11.016  -3.773
  245    H    GLN  32           HN       GLN  32   1.290   8.510  -3.051
  246    HA   GLN  32           HA       GLN  32   3.149   9.921  -1.489
  247   1HB   GLN  32          HB2       GLN  32   2.104   8.976   0.283
  248   2HB   GLN  32          HB1       GLN  32   0.861   8.702  -0.917
  249   1HG   GLN  32          HG2       GLN  32   0.981   6.548  -0.532
  250   2HG   GLN  32          HG1       GLN  32   2.652   6.579  -1.102
  251   1HE2  GLN  32          HE21      GLN  32   1.424   8.212   1.714
  252   2HE2  GLN  32          HE22      GLN  32   2.265   7.252   2.872
  253    H    LEU  33           HN       LEU  33   3.186   6.909  -3.213
  254    HA   LEU  33           HA       LEU  33   5.300   5.509  -2.130
  255   1HB   LEU  33          HB2       LEU  33   3.903   5.122  -4.319
  256   2HB   LEU  33          HB1       LEU  33   5.188   6.037  -5.081
  257    HG   LEU  33           HG       LEU  33   5.407   3.402  -3.681
  258   1HD1  LEU  33          HD11      LEU  33   6.262   2.671  -5.870
  259   2HD1  LEU  33          HD12      LEU  33   5.872   4.272  -6.504
  260   3HD1  LEU  33          HD13      LEU  33   4.584   3.219  -5.911
  261   1HD2  LEU  33          HD21      LEU  33   7.388   4.711  -3.127
  262   2HD2  LEU  33          HD22      LEU  33   7.654   5.021  -4.843
  263   3HD2  LEU  33          HD23      LEU  33   7.780   3.376  -4.213
  264    H    LYS  34           HN       LYS  34   5.367   7.858  -4.649
  265    HA   LYS  34           HA       LYS  34   6.678   9.573  -5.231
  266   1HB   LYS  34          HB2       LYS  34   7.416  10.998  -3.532
  267   2HB   LYS  34          HB1       LYS  34   6.077  10.092  -2.849
  268   1HG   LYS  34          HG2       LYS  34   7.518  10.046  -1.101
  269   2HG   LYS  34          HG1       LYS  34   7.977   8.556  -1.920
  270   1HD   LYS  34          HD2       LYS  34   9.857   9.706  -2.970
  271   2HD   LYS  34          HD1       LYS  34   9.386  11.212  -2.174
  272   1HE   LYS  34          HE2       LYS  34   9.609   9.953   0.017
  273   2HE   LYS  34          HE1       LYS  34  10.392   8.668  -0.908
  274   1HZ   LYS  34          HZ1       LYS  34  12.159  10.098  -1.484
  275   2HZ   LYS  34          HZ2       LYS  34  11.906  10.329   0.178
  276   3HZ   LYS  34          HZ3       LYS  34  11.341  11.479  -0.931
  277    H    ILE  35           HN       ILE  35   8.172   6.973  -3.762
  278    HA   ILE  35           HA       ILE  35   9.875   5.664  -4.279
  279    HB   ILE  35           HB       ILE  35  10.336   6.558  -6.994
  280   1HG1  ILE  35          HG12      ILE  35   7.591   5.548  -6.387
  281   2HG1  ILE  35          HG11      ILE  35   7.890   7.280  -6.523
  282   1HG2  ILE  35          HG21      ILE  35   9.255   4.080  -5.678
  283   2HG2  ILE  35          HG22      ILE  35  10.930   4.371  -6.160
  284   3HG2  ILE  35          HG23      ILE  35   9.677   4.201  -7.390
  285   1HD1  ILE  35          HD11      ILE  35   8.351   5.204  -8.656
  286   2HD1  ILE  35          HD12      ILE  35   8.691   6.929  -8.810
  287   3HD1  ILE  35          HD13      ILE  35   7.031   6.372  -8.598
  288    H    ASP  36           HN       ASP  36  11.972   5.737  -5.892
  289    HA   ASP  36           HA       ASP  36  13.715   7.927  -5.251
  290   1HB   ASP  36          HB2       ASP  36  13.495   6.516  -3.128
  291   2HB   ASP  36          HB1       ASP  36  14.278   5.220  -4.019
  292    H    ILE  37           HN       ILE  37  13.486   4.508  -5.886
  293    HA   ILE  37           HA       ILE  37  14.765   4.614  -8.442
  294    HB   ILE  37           HB       ILE  37  16.451   2.897  -7.727
  295   1HG1  ILE  37          HG12      ILE  37  15.415   3.870  -5.126
  296   2HG1  ILE  37          HG11      ILE  37  15.572   2.211  -5.694
  297   1HG2  ILE  37          HG21      ILE  37  16.837   5.670  -6.631
  298   2HG2  ILE  37          HG22      ILE  37  17.179   5.153  -8.281
  299   3HG2  ILE  37          HG23      ILE  37  18.120   4.501  -6.939
  300   1HD1  ILE  37          HD11      ILE  37  18.003   2.365  -5.495
  301   2HD1  ILE  37          HD12      ILE  37  17.200   2.685  -3.958
  302   3HD1  ILE  37          HD13      ILE  37  17.849   4.021  -4.908
  303    H    GLY  38           HN       GLY  38  12.426   3.478  -6.664
  304   1HA   GLY  38          HA2       GLY  38  12.074   0.950  -7.842
  305   2HA   GLY  38          HA1       GLY  38  12.881   0.758  -6.275
  306    H    ASP  39           HN       ASP  39  12.000   2.164  -4.613
  307    HA   ASP  39           HA       ASP  39   9.222   2.722  -4.472
  308   1HB   ASP  39          HB2       ASP  39  10.266   0.288  -3.056
  309   2HB   ASP  39          HB1       ASP  39   8.773   1.112  -2.666
  310    H    VAL  40           HN       VAL  40   9.210   4.344  -3.443
  311    HA   VAL  40           HA       VAL  40   9.300   5.888  -1.855
  312    HB   VAL  40           HB       VAL  40   8.289   4.304  -0.443
  313   1HG1  VAL  40          HG11      VAL  40   9.295   2.698   0.948
  314   2HG1  VAL  40          HG12      VAL  40  10.908   3.215   0.473
  315   3HG1  VAL  40          HG13      VAL  40   9.860   2.416  -0.700
  316   1HG2  VAL  40          HG21      VAL  40   9.096   4.975   1.747
  317   2HG2  VAL  40          HG22      VAL  40   8.957   6.325   0.617
  318   3HG2  VAL  40          HG23      VAL  40  10.538   5.628   0.975
  319    H    THR  41           HN       THR  41  11.744   3.740  -0.998
  320    HA   THR  41           HA       THR  41  13.947   5.482  -1.524
  321    HB   THR  41           HB       THR  41  13.397   5.055   1.415
  322    HG1  THR  41           HG1      THR  41  12.663   7.071  -0.289
  323   1HG2  THR  41          HG21      THR  41  15.779   5.047   0.851
  324   2HG2  THR  41          HG22      THR  41  15.348   6.492   1.765
  325   3HG2  THR  41          HG23      THR  41  15.596   6.591   0.021
  326    HA   PRO  42           HA       PRO  42  15.599   1.547   0.322
  327   1HB   PRO  42          HB2       PRO  42  13.271  -0.050   1.183
  328   2HB   PRO  42          HB1       PRO  42  14.813   0.221   2.004
  329   1HG   PRO  42          HG2       PRO  42  12.574   1.417   2.843
  330   2HG   PRO  42          HG1       PRO  42  14.141   2.253   2.880
  331   1HD   PRO  42          HD2       PRO  42  11.919   2.494   0.879
  332   2HD   PRO  42          HD1       PRO  42  12.891   3.772   1.635
  333    H    ASP  43           HN       ASP  43  12.954   1.732  -1.903
  334    HA   ASP  43           HA       ASP  43  13.515   1.273  -4.117
  335   1HB   ASP  43          HB2       ASP  43  15.859   0.943  -3.720
  336   2HB   ASP  43          HB1       ASP  43  15.570  -0.566  -2.869
  337    H    GLY  44           HN       GLY  44  12.391  -0.567  -1.645
  338   1HA   GLY  44          HA2       GLY  44  10.320  -1.527  -3.227
  339   2HA   GLY  44          HA1       GLY  44  11.451  -2.865  -2.987
  340    H    ARG  45           HN       ARG  45  10.575  -0.251  -0.816
  341    HA   ARG  45           HA       ARG  45   9.950  -2.098   1.316
  342   1HB   ARG  45          HB2       ARG  45  11.139   0.109   1.509
  343   2HB   ARG  45          HB1       ARG  45   9.603   0.908   1.188
  344   1HG   ARG  45          HG2       ARG  45   8.790   0.403   3.267
  345   2HG   ARG  45          HG1       ARG  45   9.661  -1.127   3.363
  346   1HD   ARG  45          HD2       ARG  45  11.719   0.629   3.404
  347   2HD   ARG  45          HD1       ARG  45  10.468   1.573   4.210
  348    HE   ARG  45           HE       ARG  45  10.762  -1.109   5.220
  349   1HH1  ARG  45          HH11      ARG  45  11.762   2.222   5.533
  350   2HH1  ARG  45          HH12      ARG  45  12.380   2.018   7.139
  351   1HH2  ARG  45          HH21      ARG  45  11.612  -1.393   7.340
  352   2HH2  ARG  45          HH22      ARG  45  12.294  -0.021   8.161
  353    H    PHE  46           HN       PHE  46   8.494  -0.918  -1.271
  354    HA   PHE  46           HA       PHE  46   5.858  -0.475  -0.142
  355   1HB   PHE  46          HB2       PHE  46   7.497   0.671  -2.230
  356   2HB   PHE  46          HB1       PHE  46   5.879   0.264  -2.818
  357    HD1  PHE  46           HD1      PHE  46   7.896   2.660  -1.440
  358    HD2  PHE  46           HD2      PHE  46   3.937   1.145  -1.170
  359    HE1  PHE  46           HE1      PHE  46   7.082   4.899  -0.675
  360    HE2  PHE  46           HE2      PHE  46   3.141   3.312  -0.339
  361    HZ   PHE  46           HZ       PHE  46   4.711   5.184  -0.088
  362    H    SER  47           HN       SER  47   7.337  -2.032  -2.907
  363    HA   SER  47           HA       SER  47   6.286  -2.781  -4.821
  364   1HB   SER  47          HB2       SER  47   5.976  -4.891  -2.710
  365   2HB   SER  47          HB1       SER  47   5.731  -5.188  -4.432
  366    HG   SER  47           HG       SER  47   7.923  -4.301  -4.695
  367    H    ILE  48           HN       ILE  48   4.248  -4.643  -5.219
  368    HA   ILE  48           HA       ILE  48   1.817  -3.384  -4.440
  369    HB   ILE  48           HB       ILE  48   2.736  -1.565  -5.742
  370   1HG1  ILE  48          HG12      ILE  48   0.892  -1.349  -7.440
  371   2HG1  ILE  48          HG11      ILE  48   0.422  -2.999  -7.029
  372   1HG2  ILE  48          HG21      ILE  48   2.878  -3.510  -8.033
  373   2HG2  ILE  48          HG22      ILE  48   4.234  -2.736  -7.212
  374   3HG2  ILE  48          HG23      ILE  48   3.110  -1.766  -8.164
  375   1HD1  ILE  48          HD11      ILE  48   0.005  -2.370  -4.765
  376   2HD1  ILE  48          HD12      ILE  48  -0.872  -1.270  -5.835
  377   3HD1  ILE  48          HD13      ILE  48   0.629  -0.750  -5.062
  378    H    ASP  49           HN       ASP  49   0.869  -5.447  -4.274
  379    HA   ASP  49           HA       ASP  49  -0.214  -6.112  -6.939
  380   1HB   ASP  49          HB2       ASP  49   0.369  -8.263  -4.888
  381   2HB   ASP  49          HB1       ASP  49  -0.252  -8.487  -6.513
  382    H    THR  50           HN       THR  50  -2.346  -5.826  -6.820
  383    HA   THR  50           HA       THR  50  -4.087  -5.916  -4.742
  384    HB   THR  50           HB       THR  50  -4.872  -5.312  -6.904
  385    HG1  THR  50           HG1      THR  50  -6.098  -7.208  -5.390
  386   1HG2  THR  50          HG21      THR  50  -4.450  -8.183  -7.738
  387   2HG2  THR  50          HG22      THR  50  -3.496  -6.800  -8.276
  388   3HG2  THR  50          HG23      THR  50  -5.201  -6.924  -8.713
  389    H    LEU  51           HN       LEU  51  -2.606  -8.674  -6.291
  390    HA   LEU  51           HA       LEU  51  -4.677 -10.485  -6.066
  391   1HB   LEU  51          HB2       LEU  51  -1.728 -11.035  -6.267
  392   2HB   LEU  51          HB1       LEU  51  -3.006 -12.178  -6.635
  393    HG   LEU  51           HG       LEU  51  -2.609  -9.567  -8.095
  394   1HD1  LEU  51          HD11      LEU  51  -1.732 -10.935  -9.924
  395   2HD1  LEU  51          HD12      LEU  51  -1.802 -12.360  -8.886
  396   3HD1  LEU  51          HD13      LEU  51  -0.714 -11.030  -8.486
  397   1HD2  LEU  51          HD21      LEU  51  -4.333 -11.970  -8.683
  398   2HD2  LEU  51          HD22      LEU  51  -4.138 -10.563  -9.730
  399   3HD2  LEU  51          HD23      LEU  51  -4.898 -10.387  -8.148
  400    H    ARG  52           HN       ARG  52  -2.022 -10.041  -3.724
  401    HA   ARG  52           HA       ARG  52  -2.579 -12.361  -2.214
  402   1HB   ARG  52          HB2       ARG  52  -1.479  -9.738  -1.191
  403   2HB   ARG  52          HB1       ARG  52  -1.300 -11.318  -0.434
  404   1HG   ARG  52          HG2       ARG  52  -0.016 -12.083  -2.384
  405   2HG   ARG  52          HG1       ARG  52  -0.158 -10.475  -3.092
  406   1HD   ARG  52          HD2       ARG  52   1.020  -9.545  -1.135
  407   2HD   ARG  52          HD1       ARG  52   1.207 -11.179  -0.498
  408    HE   ARG  52           HE       ARG  52   2.386 -10.311  -3.062
  409   1HH1  ARG  52          HH11      ARG  52   2.567 -11.995  -0.011
  410   2HH1  ARG  52          HH12      ARG  52   4.181 -12.583  -0.270
  411   1HH2  ARG  52          HH21      ARG  52   4.499 -11.091  -3.441
  412   2HH2  ARG  52          HH22      ARG  52   5.262 -12.112  -2.250
  413    H    CYS  53           HN       CYS  53  -3.398  -9.039  -1.563
  414    HA   CYS  53           HA       CYS  53  -5.506  -9.450   0.251
  415   1HB   CYS  53          HB2       CYS  53  -4.218  -7.329   0.007
  416   2HB   CYS  53          HB1       CYS  53  -5.046  -7.051  -1.522
  417    H    VAL  54           HN       VAL  54  -7.842  -8.323  -0.563
  418    HA   VAL  54           HA       VAL  54  -9.804  -9.112  -1.417
  419    HB   VAL  54           HB       VAL  54  -8.299 -10.583  -3.599
  420   1HG1  VAL  54          HG11      VAL  54 -10.390 -10.349  -4.845
  421   2HG1  VAL  54          HG12      VAL  54 -11.116  -9.510  -3.475
  422   3HG1  VAL  54          HG13      VAL  54 -10.643 -11.201  -3.322
  423   1HG2  VAL  54          HG21      VAL  54  -9.288  -7.734  -3.668
  424   2HG2  VAL  54          HG22      VAL  54  -8.666  -8.639  -5.049
  425   3HG2  VAL  54          HG23      VAL  54  -7.604  -8.254  -3.694
  426    H    GLY  55           HN       GLY  55  -8.076 -10.347   0.465
  427   1HA   GLY  55          HA2       GLY  55  -9.005 -13.132   0.295
  428   2HA   GLY  55          HA1       GLY  55  -7.589 -12.617   1.194
  429    H    GLY  56           HN       GLY  56 -11.086 -11.673   1.085
  430   1HA   GLY  56          HA2       GLY  56 -12.647 -11.749   2.776
  431   2HA   GLY  56          HA1       GLY  56 -11.605 -12.917   3.555
  432    H    CYS  57           HN       CYS  57 -11.603  -9.318   3.038
  433    HA   CYS  57           HA       CYS  57 -10.595  -9.078   5.829
  434   1HB   CYS  57          HB2       CYS  57  -9.637  -7.205   3.755
  435   2HB   CYS  57          HB1       CYS  57  -8.838  -7.759   5.192
  436    H    ALA  58           HN       ALA  58 -12.330  -7.828   3.107
  437    HA   ALA  58           HA       ALA  58 -11.981  -5.153   3.214
  438   1HB   ALA  58          HB1       ALA  58 -13.945  -4.938   1.849
  439   2HB   ALA  58          HB2       ALA  58 -14.500  -6.535   2.354
  440   3HB   ALA  58          HB3       ALA  58 -13.030  -6.375   1.392
  441    H    LEU  59           HN       LEU  59 -14.295  -6.830   5.406
  442    HA   LEU  59           HA       LEU  59 -15.592  -4.338   6.040
  443   1HB   LEU  59          HB2       LEU  59 -15.496  -6.953   7.535
  444   2HB   LEU  59          HB1       LEU  59 -16.468  -5.581   8.028
  445    HG   LEU  59           HG       LEU  59 -16.773  -7.128   5.456
  446   1HD1  LEU  59          HD11      LEU  59 -18.488  -7.016   7.931
  447   2HD1  LEU  59          HD12      LEU  59 -17.508  -8.383   7.397
  448   3HD1  LEU  59          HD13      LEU  59 -18.892  -7.861   6.437
  449   1HD2  LEU  59          HD21      LEU  59 -18.405  -4.845   6.566
  450   2HD2  LEU  59          HD22      LEU  59 -18.785  -5.778   5.119
  451   3HD2  LEU  59          HD23      LEU  59 -17.338  -4.770   5.162
  452    H    ALA  60           HN       ALA  60 -12.511  -5.313   6.641
  453    HA   ALA  60           HA       ALA  60 -12.269  -3.220   8.706
  454   1HB   ALA  60          HB1       ALA  60 -11.338  -5.376   9.447
  455   2HB   ALA  60          HB2       ALA  60 -10.065  -4.177   9.225
  456   3HB   ALA  60          HB3       ALA  60 -10.320  -5.429   8.009
  457    HA   PRO  61           HA       PRO  61  -9.880  -1.283   5.345
  458   1HB   PRO  61          HB2       PRO  61  -8.062   0.210   6.716
  459   2HB   PRO  61          HB1       PRO  61  -9.737   0.723   6.495
  460   1HG   PRO  61          HG2       PRO  61  -8.431  -0.496   8.886
  461   2HG   PRO  61          HG1       PRO  61  -9.669   0.769   8.803
  462   1HD   PRO  61          HD2       PRO  61 -10.192  -1.870   9.387
  463   2HD   PRO  61          HD1       PRO  61 -11.378  -0.749   8.690
  464    H    ILE  62           HN       ILE  62  -8.546  -2.664   4.308
  465    HA   ILE  62           HA       ILE  62  -6.379  -3.900   5.857
  466    HB   ILE  62           HB       ILE  62  -7.896  -5.556   5.004
  467   1HG1  ILE  62          HG12      ILE  62  -6.354  -6.901   3.575
  468   2HG1  ILE  62          HG11      ILE  62  -5.320  -5.485   3.418
  469   1HG2  ILE  62          HG21      ILE  62  -7.396  -4.384   2.276
  470   2HG2  ILE  62          HG22      ILE  62  -8.899  -4.299   3.196
  471   3HG2  ILE  62          HG23      ILE  62  -8.311  -5.855   2.610
  472   1HD1  ILE  62          HD11      ILE  62  -5.986  -6.896   5.989
  473   2HD1  ILE  62          HD12      ILE  62  -4.927  -5.496   5.817
  474   3HD1  ILE  62          HD13      ILE  62  -4.477  -7.038   5.089
  475    H    VAL  63           HN       VAL  63  -4.301  -3.213   5.403
  476    HA   VAL  63           HA       VAL  63  -3.728  -3.321   2.549
  477    HB   VAL  63           HB       VAL  63  -3.024  -1.239   2.328
  478   1HG1  VAL  63          HG11      VAL  63  -4.782  -0.625   3.865
  479   2HG1  VAL  63          HG12      VAL  63  -3.397   0.451   4.058
  480   3HG1  VAL  63          HG13      VAL  63  -3.689  -0.831   5.234
  481   1HG2  VAL  63          HG21      VAL  63  -0.832  -1.956   3.043
  482   2HG2  VAL  63          HG22      VAL  63  -1.259  -1.662   4.728
  483   3HG2  VAL  63          HG23      VAL  63  -1.148  -0.312   3.598
  484    H    MET  64           HN       MET  64  -2.149  -4.874   2.212
  485    HA   MET  64           HA       MET  64  -0.596  -5.495   4.627
  486   1HB   MET  64          HB2       MET  64  -2.081  -7.315   3.988
  487   2HB   MET  64          HB1       MET  64  -1.391  -7.329   2.370
  488   1HG   MET  64          HG2       MET  64   0.742  -7.993   3.249
  489   2HG   MET  64          HG1       MET  64   0.125  -7.905   4.897
  490   1HE   MET  64          HE1       MET  64  -0.237  -9.760   1.428
  491   2HE   MET  64          HE2       MET  64  -1.892  -9.282   1.806
  492   3HE   MET  64          HE3       MET  64  -1.438 -10.987   1.828
  493    H    VAL  65           HN       VAL  65   1.557  -5.384   4.567
  494    HA   VAL  65           HA       VAL  65   2.857  -5.280   1.918
  495    HB   VAL  65           HB       VAL  65   4.683  -4.060   3.405
  496   1HG1  VAL  65          HG11      VAL  65   3.753  -3.131   1.385
  497   2HG1  VAL  65          HG12      VAL  65   3.827  -1.905   2.656
  498   3HG1  VAL  65          HG13      VAL  65   2.286  -2.669   2.252
  499   1HG2  VAL  65          HG21      VAL  65   3.663  -2.538   5.008
  500   2HG2  VAL  65          HG22      VAL  65   3.416  -4.227   5.461
  501   3HG2  VAL  65          HG23      VAL  65   2.098  -3.308   4.733
  502    H    GLY  66           HN       GLY  66   4.114  -7.058   1.633
  503   1HA   GLY  66          HA2       GLY  66   5.538  -8.823   2.141
  504   2HA   GLY  66          HA1       GLY  66   6.160  -7.752   3.393
  505    H    GLU  67           HN       GLU  67   2.914  -8.854   3.235
  506    HA   GLU  67           HA       GLU  67   1.561  -9.869   4.739
  507   1HB   GLU  67          HB2       GLU  67   4.045 -11.527   5.142
  508   2HB   GLU  67          HB1       GLU  67   2.475 -11.930   5.828
  509   1HG   GLU  67          HG2       GLU  67   1.521 -12.108   3.608
  510   2HG   GLU  67          HG1       GLU  67   3.057 -11.623   2.891
  511    H    LYS  68           HN       LYS  68   3.742  -7.761   5.615
  512    HA   LYS  68           HA       LYS  68   3.846  -8.043   8.452
  513   1HB   LYS  68          HB2       LYS  68   4.114  -5.501   6.831
  514   2HB   LYS  68          HB1       LYS  68   4.641  -5.735   8.484
  515   1HG   LYS  68          HG2       LYS  68   5.850  -6.966   5.999
  516   2HG   LYS  68          HG1       LYS  68   6.543  -5.721   7.032
  517   1HD   LYS  68          HD2       LYS  68   5.932  -8.547   7.896
  518   2HD   LYS  68          HD1       LYS  68   7.531  -7.916   7.490
  519   1HE   LYS  68          HE2       LYS  68   7.336  -6.283   9.312
  520   2HE   LYS  68          HE1       LYS  68   5.755  -6.943   9.728
  521   1HZ   LYS  68          HZ1       LYS  68   7.375  -7.871  11.181
  522   2HZ   LYS  68          HZ2       LYS  68   8.372  -8.328   9.893
  523   3HZ   LYS  68          HZ3       LYS  68   6.881  -9.103  10.123
  524    H    VAL  69           HN       VAL  69   1.611  -6.838   6.185
  525    HA   VAL  69           HA       VAL  69  -0.471  -5.912   6.285
  526    HB   VAL  69           HB       VAL  69  -0.467  -7.071   9.070
  527   1HG1  VAL  69          HG11      VAL  69  -2.186  -5.342   8.826
  528   2HG1  VAL  69          HG12      VAL  69  -2.906  -6.949   8.935
  529   3HG1  VAL  69          HG13      VAL  69  -2.785  -6.141   7.371
  530   1HG2  VAL  69          HG21      VAL  69  -1.510  -8.141   6.443
  531   2HG2  VAL  69          HG22      VAL  69  -1.718  -8.911   8.018
  532   3HG2  VAL  69          HG23      VAL  69  -0.104  -8.735   7.329
  533    H    TYR  70           HN       TYR  70  -0.299  -3.755   6.093
  534    HA   TYR  70           HA       TYR  70   0.024  -2.147   8.536
  535   1HB   TYR  70          HB2       TYR  70   1.324  -1.771   5.833
  536   2HB   TYR  70          HB1       TYR  70   1.043  -0.396   6.899
  537    HD1  TYR  70           HD1      TYR  70   1.934  -3.831   8.025
  538    HD2  TYR  70           HD2      TYR  70   3.238   0.164   7.422
  539    HE1  TYR  70           HE1      TYR  70   3.989  -4.312   9.238
  540    HE2  TYR  70           HE2      TYR  70   5.276  -0.296   8.639
  541    HH   TYR  70           HH       TYR  70   6.199  -3.531   9.540
  542    H    GLY  71           HN       GLY  71  -0.278   0.328   7.284
  543   1HA   GLY  71          HA2       GLY  71  -2.991   0.291   6.166
  544   2HA   GLY  71          HA1       GLY  71  -2.646   1.271   7.584
  545    H    ASN  72           HN       ASN  72  -0.120   0.960   5.248
  546    HA   ASN  72           HA       ASN  72  -0.350   3.807   4.721
  547   1HB   ASN  72          HB2       ASN  72   1.918   2.985   5.210
  548   2HB   ASN  72          HB1       ASN  72   1.808   1.805   3.910
  549   1HD2  ASN  72          HD21      ASN  72   2.033   2.485   1.782
  550   2HD2  ASN  72          HD22      ASN  72   2.647   4.067   1.398
  551    H    VAL  73           HN       VAL  73  -2.248   3.879   3.435
  552    HA   VAL  73           HA       VAL  73  -1.814   3.274   0.643
  553    HB   VAL  73           HB       VAL  73  -4.066   1.991   2.145
  554   1HG1  VAL  73          HG11      VAL  73  -4.964   2.959   0.098
  555   2HG1  VAL  73          HG12      VAL  73  -4.892   1.202  -0.046
  556   3HG1  VAL  73          HG13      VAL  73  -3.680   2.204  -0.847
  557   1HG2  VAL  73          HG21      VAL  73  -2.027   0.683   2.147
  558   2HG2  VAL  73          HG22      VAL  73  -1.888   0.851   0.393
  559   3HG2  VAL  73          HG23      VAL  73  -3.218  -0.076   1.088
  560    H    THR  74           HN       THR  74  -4.317   4.333   2.915
  561    HA   THR  74           HA       THR  74  -5.550   5.762   0.671
  562    HB   THR  74           HB       THR  74  -7.645   5.559   1.719
  563    HG1  THR  74           HG1      THR  74  -7.710   4.635   3.956
  564   1HG2  THR  74          HG21      THR  74  -6.107   3.035   2.339
  565   2HG2  THR  74          HG22      THR  74  -6.898   3.435   0.812
  566   3HG2  THR  74          HG23      THR  74  -7.865   3.166   2.263
  567    HA   PRO  75           HA       PRO  75  -4.814   9.911   2.022
  568   1HB   PRO  75          HB2       PRO  75  -7.568  10.652   2.154
  569   2HB   PRO  75          HB1       PRO  75  -6.429  10.969   0.843
  570   1HG   PRO  75          HG2       PRO  75  -8.443   8.817   1.120
  571   2HG   PRO  75          HG1       PRO  75  -7.794   9.572  -0.346
  572   1HD   PRO  75          HD2       PRO  75  -7.083   7.095   0.365
  573   2HD   PRO  75          HD1       PRO  75  -5.906   8.215  -0.354
  574    H    GLY  76           HN       GLY  76  -4.195  10.239   4.012
  575   1HA   GLY  76          HA2       GLY  76  -4.899  10.800   6.314
  576   2HA   GLY  76          HA1       GLY  76  -6.015   9.441   6.197
  577    H    GLN  77           HN       GLN  77  -5.113   7.285   5.980
  578    HA   GLN  77           HA       GLN  77  -3.118   6.882   7.954
  579   1HB   GLN  77          HB2       GLN  77  -3.200   4.452   6.776
  580   2HB   GLN  77          HB1       GLN  77  -4.431   4.998   7.914
  581   1HG   GLN  77          HG2       GLN  77  -5.803   5.692   5.976
  582   2HG   GLN  77          HG1       GLN  77  -4.566   5.023   4.910
  583   1HE2  GLN  77          HE21      GLN  77  -4.266   2.782   4.856
  584   2HE2  GLN  77          HE22      GLN  77  -5.482   1.697   5.427
  585    H    VAL  78           HN       VAL  78  -3.118   6.925   4.508
  586    HA   VAL  78           HA       VAL  78  -0.863   5.545   3.885
  587    HB   VAL  78           HB       VAL  78  -2.682   6.457   2.456
  588   1HG1  VAL  78          HG11      VAL  78  -1.093   8.929   2.162
  589   2HG1  VAL  78          HG12      VAL  78  -2.414   8.781   3.328
  590   3HG1  VAL  78          HG13      VAL  78  -2.735   8.572   1.587
  591   1HG2  VAL  78          HG21      VAL  78  -1.307   6.678   0.481
  592   2HG2  VAL  78          HG22      VAL  78  -0.785   5.357   1.526
  593   3HG2  VAL  78          HG23      VAL  78   0.111   6.876   1.512
  594    H    LYS  79           HN       LYS  79  -1.157   9.034   4.558
  595    HA   LYS  79           HA       LYS  79   1.414   9.601   3.543
  596   1HB   LYS  79          HB2       LYS  79   1.121  11.830   4.657
  597   2HB   LYS  79          HB1       LYS  79  -0.197  11.360   3.595
  598   1HG   LYS  79          HG2       LYS  79  -1.354  10.521   5.724
  599   2HG   LYS  79          HG1       LYS  79  -0.150  11.484   6.583
  600   1HD   LYS  79          HD2       LYS  79  -0.864  13.475   5.337
  601   2HD   LYS  79          HD1       LYS  79  -2.076  12.503   4.496
  602   1HE   LYS  79          HE2       LYS  79  -3.265  13.549   6.213
  603   2HE   LYS  79          HE1       LYS  79  -2.962  11.921   6.821
  604   1HZ   LYS  79          HZ1       LYS  79  -2.472  13.372   8.575
  605   2HZ   LYS  79          HZ2       LYS  79  -1.607  14.438   7.583
  606   3HZ   LYS  79          HZ3       LYS  79  -0.958  12.920   7.958
  607    H    LYS  80           HN       LYS  80   0.234   8.895   6.737
  608    HA   LYS  80           HA       LYS  80   2.817   9.594   7.895
  609   1HB   LYS  80          HB2       LYS  80   1.136   8.677   9.907
  610   2HB   LYS  80          HB1       LYS  80   1.470  10.349   9.495
  611   1HG   LYS  80          HG2       LYS  80  -0.826  10.291   9.472
  612   2HG   LYS  80          HG1       LYS  80  -0.449  10.053   7.767
  613   1HD   LYS  80          HD2       LYS  80  -1.980   8.406   8.069
  614   2HD   LYS  80          HD1       LYS  80  -0.502   7.526   8.463
  615   1HE   LYS  80          HE2       LYS  80  -2.507   8.700  10.388
  616   2HE   LYS  80          HE1       LYS  80  -2.121   6.999  10.146
  617   1HZ   LYS  80          HZ1       LYS  80  -1.067   7.709  12.128
  618   2HZ   LYS  80          HZ2       LYS  80  -0.400   9.077  11.383
  619   3HZ   LYS  80          HZ3       LYS  80   0.160   7.529  10.974
  620    H    ILE  81           HN       ILE  81   0.754   6.860   7.276
  621    HA   ILE  81           HA       ILE  81   2.424   4.992   8.638
  622    HB   ILE  81           HB       ILE  81   0.450   4.494   6.397
  623   1HG1  ILE  81          HG12      ILE  81  -0.592   5.493   8.384
  624   2HG1  ILE  81          HG11      ILE  81  -1.074   3.809   8.213
  625   1HG2  ILE  81          HG21      ILE  81   0.446   2.163   7.224
  626   2HG2  ILE  81          HG22      ILE  81   1.701   2.577   8.393
  627   3HG2  ILE  81          HG23      ILE  81   2.050   2.639   6.665
  628   1HD1  ILE  81          HD11      ILE  81   1.040   4.840  10.086
  629   2HD1  ILE  81          HD12      ILE  81   0.498   3.167   9.943
  630   3HD1  ILE  81          HD13      ILE  81  -0.610   4.409  10.530
  631    H    LEU  82           HN       LEU  82   2.778   6.741   5.698
  632    HA   LEU  82           HA       LEU  82   4.607   5.058   4.399
  633   1HB   LEU  82          HB2       LEU  82   3.864   7.079   3.319
  634   2HB   LEU  82          HB1       LEU  82   4.544   8.078   4.587
  635    HG   LEU  82           HG       LEU  82   6.799   7.356   3.920
  636   1HD1  LEU  82          HD11      LEU  82   5.380   5.980   1.637
  637   2HD1  LEU  82          HD12      LEU  82   6.199   5.176   2.977
  638   3HD1  LEU  82          HD13      LEU  82   7.125   6.145   1.828
  639   1HD2  LEU  82          HD21      LEU  82   5.840   9.414   3.002
  640   2HD2  LEU  82          HD22      LEU  82   5.143   8.496   1.663
  641   3HD2  LEU  82          HD23      LEU  82   6.894   8.625   1.826
  642    H    ALA  83           HN       ALA  83   5.054   7.273   7.128
  643    HA   ALA  83           HA       ALA  83   7.809   6.845   7.501
  644   1HB   ALA  83          HB1       ALA  83   6.548   8.522   8.777
  645   2HB   ALA  83          HB2       ALA  83   7.430   7.433   9.848
  646   3HB   ALA  83          HB3       ALA  83   5.691   7.235   9.624
  647    H    GLU  84           HN       GLU  84   5.001   4.940   8.148
  648    HA   GLU  84           HA       GLU  84   6.299   2.883   9.612
  649   1HB   GLU  84          HB2       GLU  84   3.640   3.415   8.595
  650   2HB   GLU  84          HB1       GLU  84   4.091   1.724   8.455
  651   1HG   GLU  84          HG2       GLU  84   2.935   2.114  10.536
  652   2HG   GLU  84          HG1       GLU  84   4.619   1.690  10.853
  653    H    TYR  85           HN       TYR  85   5.695   3.430   6.123
  654    HA   TYR  85           HA       TYR  85   6.815   0.906   5.516
  655   1HB   TYR  85          HB2       TYR  85   5.796   3.172   3.894
  656   2HB   TYR  85          HB1       TYR  85   6.709   1.879   3.162
  657    HD1  TYR  85           HD1      TYR  85   5.021   0.867   5.961
  658    HD2  TYR  85           HD2      TYR  85   4.517   1.728   1.958
  659    HE1  TYR  85           HE1      TYR  85   3.053  -0.486   5.997
  660    HE2  TYR  85           HE2      TYR  85   2.493   0.371   1.964
  661    HH   TYR  85           HH       TYR  85   1.457  -1.417   3.132
  Start of MODEL   14
    1   1H    MET   1          HT1       MET   1  19.700 -14.036   8.672
    2   2H    MET   1          HT2       MET   1  21.318 -14.488   8.437
    3   3H    MET   1          HT3       MET   1  20.325 -14.157   7.107
    4    HA   MET   1           HA       MET   1  21.082 -12.178   9.169
    5   1HB   MET   1          HB2       MET   1  23.034 -12.843   7.843
    6   2HB   MET   1          HB1       MET   1  22.133 -12.565   6.359
    7   1HG   MET   1          HG2       MET   1  21.892 -10.174   7.059
    8   2HG   MET   1          HG1       MET   1  23.009 -10.519   8.376
    9   1HE   MET   1          HE1       MET   1  26.273 -11.492   6.425
   10   2HE   MET   1          HE2       MET   1  25.007 -12.601   6.954
   11   3HE   MET   1          HE3       MET   1  25.530 -11.291   8.011
   12    H    VAL   2           HN       VAL   2  19.805 -12.738   5.889
   13    HA   VAL   2           HA       VAL   2  18.635 -10.063   5.907
   14    HB   VAL   2           HB       VAL   2  18.685 -12.085   3.662
   15   1HG1  VAL   2          HG11      VAL   2  16.945 -10.392   3.434
   16   2HG1  VAL   2          HG12      VAL   2  18.214 -10.159   2.231
   17   3HG1  VAL   2          HG13      VAL   2  18.147  -9.118   3.654
   18   1HG2  VAL   2          HG21      VAL   2  20.553  -9.778   4.201
   19   2HG2  VAL   2          HG22      VAL   2  20.557 -10.788   2.755
   20   3HG2  VAL   2          HG23      VAL   2  20.955 -11.490   4.323
   21    HA   PRO   3           HA       PRO   3  14.637 -11.920   6.844
   22   1HB   PRO   3          HB2       PRO   3  13.353  -9.589   7.246
   23   2HB   PRO   3          HB1       PRO   3  14.459 -10.254   8.454
   24   1HG   PRO   3          HG2       PRO   3  14.927  -8.091   6.440
   25   2HG   PRO   3          HG1       PRO   3  15.419  -8.164   8.143
   26   1HD   PRO   3          HD2       PRO   3  17.094  -8.737   6.055
   27   2HD   PRO   3          HD1       PRO   3  17.275  -9.422   7.681
   28    H    LYS   4           HN       LYS   4  12.345 -10.396   6.019
   29    HA   LYS   4           HA       LYS   4  12.397 -10.928   3.205
   30   1HB   LYS   4          HB2       LYS   4  10.270  -9.752   4.979
   31   2HB   LYS   4          HB1       LYS   4  10.050 -10.023   3.254
   32   1HG   LYS   4          HG2       LYS   4  10.605 -12.124   5.343
   33   2HG   LYS   4          HG1       LYS   4   9.077 -11.845   4.501
   34   1HD   LYS   4          HD2       LYS   4  10.077 -12.463   2.391
   35   2HD   LYS   4          HD1       LYS   4  11.664 -12.603   3.146
   36   1HE   LYS   4          HE2       LYS   4  10.726 -14.800   2.831
   37   2HE   LYS   4          HE1       LYS   4  10.803 -14.434   4.553
   38   1HZ   LYS   4          HZ1       LYS   4   8.371 -14.183   2.865
   39   2HZ   LYS   4          HZ2       LYS   4   8.458 -13.937   4.544
   40   3HZ   LYS   4          HZ3       LYS   4   8.706 -15.483   3.901
   41    H    GLY   5           HN       GLY   5  10.884  -8.024   4.332
   42   1HA   GLY   5          HA2       GLY   5  11.483  -5.788   4.008
   43   2HA   GLY   5          HA1       GLY   5  12.984  -6.333   3.257
   44    H    LYS   6           HN       LYS   6  11.934  -4.354   1.947
   45    HA   LYS   6           HA       LYS   6  10.573  -3.539   0.301
   46   1HB   LYS   6          HB2       LYS   6  11.070  -4.556  -1.926
   47   2HB   LYS   6          HB1       LYS   6  12.487  -4.123  -0.980
   48   1HG   LYS   6          HG2       LYS   6  11.444  -6.913  -0.905
   49   2HG   LYS   6          HG1       LYS   6  12.419  -6.361  -2.269
   50   1HD   LYS   6          HD2       LYS   6  14.255  -5.832  -0.829
   51   2HD   LYS   6          HD1       LYS   6  13.266  -6.112   0.613
   52   1HE   LYS   6          HE2       LYS   6  13.038  -8.468  -0.040
   53   2HE   LYS   6          HE1       LYS   6  14.086  -8.171  -1.427
   54   1HZ   LYS   6          HZ1       LYS   6  14.947  -7.630   1.352
   55   2HZ   LYS   6          HZ2       LYS   6  15.917  -7.769  -0.033
   56   3HZ   LYS   6          HZ3       LYS   6  15.164  -9.141   0.619
   57    H    TYR   7           HN       TYR   7   9.064  -4.834   1.940
   58    HA   TYR   7           HA       TYR   7   7.427  -6.802   1.582
   59   1HB   TYR   7          HB2       TYR   7   6.063  -4.190   1.921
   60   2HB   TYR   7          HB1       TYR   7   5.919  -5.674   2.864
   61    HD1  TYR   7           HD1      TYR   7   8.426  -6.323   3.808
   62    HD2  TYR   7           HD2      TYR   7   6.849  -2.457   3.122
   63    HE1  TYR   7           HE1      TYR   7  10.002  -5.423   5.400
   64    HE2  TYR   7           HE2      TYR   7   8.412  -1.510   4.735
   65    HH   TYR   7           HH       TYR   7   9.753  -2.194   6.627
   66    HA   PRO   8           HA       PRO   8   5.352  -6.198  -2.472
   67   1HB   PRO   8          HB2       PRO   8   4.197  -8.793  -1.655
   68   2HB   PRO   8          HB1       PRO   8   5.004  -8.355  -3.165
   69   1HG   PRO   8          HG2       PRO   8   6.186  -9.948  -1.366
   70   2HG   PRO   8          HG1       PRO   8   7.116  -8.763  -2.306
   71   1HD   PRO   8          HD2       PRO   8   6.157  -8.602   0.531
   72   2HD   PRO   8          HD1       PRO   8   7.718  -8.109  -0.160
   73    H    ILE   9           HN       ILE   9   3.776  -4.690  -2.069
   74    HA   ILE   9           HA       ILE   9   1.912  -5.041   0.072
   75    HB   ILE   9           HB       ILE   9   1.699  -2.847  -0.067
   76   1HG1  ILE   9          HG12      ILE   9   0.883  -3.097  -2.962
   77   2HG1  ILE   9          HG11      ILE   9  -0.212  -3.232  -1.590
   78   1HG2  ILE   9          HG21      ILE   9   3.048  -1.516  -1.593
   79   2HG2  ILE   9          HG22      ILE   9   3.376  -2.961  -2.549
   80   3HG2  ILE   9          HG23      ILE   9   3.964  -2.849  -0.889
   81   1HD1  ILE   9          HD11      ILE   9   1.369  -0.793  -2.366
   82   2HD1  ILE   9          HD12      ILE   9   0.292  -0.923  -0.974
   83   3HD1  ILE   9          HD13      ILE   9  -0.360  -1.045  -2.607
   84    H    SER  10           HN       SER  10  -0.411  -4.998  -0.240
   85    HA   SER  10           HA       SER  10  -1.343  -6.106  -2.771
   86   1HB   SER  10          HB2       SER  10  -1.857  -7.391  -0.081
   87   2HB   SER  10          HB1       SER  10  -2.484  -7.941  -1.639
   88    HG   SER  10           HG       SER  10   0.150  -7.684  -1.854
   89    H    VAL  11           HN       VAL  11  -2.879  -4.745  -3.372
   90    HA   VAL  11           HA       VAL  11  -4.746  -3.721  -1.325
   91    HB   VAL  11           HB       VAL  11  -4.530  -2.296  -3.917
   92   1HG1  VAL  11          HG11      VAL  11  -4.806  -1.374  -1.063
   93   2HG1  VAL  11          HG12      VAL  11  -6.114  -1.569  -2.229
   94   3HG1  VAL  11          HG13      VAL  11  -4.877  -0.338  -2.488
   95   1HG2  VAL  11          HG21      VAL  11  -2.203  -2.604  -3.517
   96   2HG2  VAL  11          HG22      VAL  11  -2.384  -2.162  -1.813
   97   3HG2  VAL  11          HG23      VAL  11  -2.617  -0.942  -3.074
   98    H    CYS  12           HN       CYS  12  -6.746  -4.635  -1.536
   99    HA   CYS  12           HA       CYS  12  -7.652  -5.822  -3.956
  100   1HB   CYS  12          HB2       CYS  12  -8.621  -6.584  -1.883
  101   2HB   CYS  12          HB1       CYS  12  -9.191  -4.960  -1.502
  102    H    MET  13           HN       MET  13  -8.351  -4.828  -5.724
  103    HA   MET  13           HA       MET  13  -9.767  -2.281  -5.381
  104   1HB   MET  13          HB2       MET  13  -8.979  -1.697  -7.706
  105   2HB   MET  13          HB1       MET  13  -7.741  -1.707  -6.460
  106   1HG   MET  13          HG2       MET  13  -6.743  -2.710  -8.304
  107   2HG   MET  13          HG1       MET  13  -7.183  -4.054  -7.257
  108   1HE   MET  13          HE1       MET  13  -6.762  -5.670  -9.362
  109   2HE   MET  13          HE2       MET  13  -6.389  -4.269 -10.367
  110   3HE   MET  13          HE3       MET  13  -7.566  -5.462 -10.918
  111    H    GLY  14           HN       GLY  14 -10.728  -5.118  -5.489
  112   1HA   GLY  14          HA2       GLY  14 -11.915  -5.598  -8.026
  113   2HA   GLY  14          HA1       GLY  14 -12.377  -6.365  -6.513
  114    H    THR  15           HN       THR  15 -14.483  -6.016  -7.943
  115    HA   THR  15           HA       THR  15 -15.464  -3.382  -8.252
  116    HB   THR  15           HB       THR  15 -16.997  -5.984  -8.312
  117    HG1  THR  15           HG1      THR  15 -15.073  -5.226  -9.883
  118   1HG2  THR  15          HG21      THR  15 -18.605  -4.752  -9.690
  119   2HG2  THR  15          HG22      THR  15 -17.672  -3.273  -9.463
  120   3HG2  THR  15          HG23      THR  15 -18.465  -4.036  -8.085
  121    H    ALA  16           HN       ALA  16 -16.191  -5.905  -5.854
  122    HA   ALA  16           HA       ALA  16 -18.237  -4.413  -4.536
  123   1HB   ALA  16          HB1       ALA  16 -18.108  -6.126  -2.806
  124   2HB   ALA  16          HB2       ALA  16 -16.610  -6.737  -3.509
  125   3HB   ALA  16          HB3       ALA  16 -18.120  -6.857  -4.412
  126    H    CYS  17           HN       CYS  17 -14.909  -5.182  -3.673
  127    HA   CYS  17           HA       CYS  17 -14.806  -3.651  -1.330
  128   1HB   CYS  17          HB2       CYS  17 -12.635  -4.623  -3.157
  129   2HB   CYS  17          HB1       CYS  17 -12.352  -3.912  -1.592
  130    H    PHE  18           HN       PHE  18 -14.328  -2.811  -4.668
  131    HA   PHE  18           HA       PHE  18 -12.940  -0.404  -4.512
  132   1HB   PHE  18          HB2       PHE  18 -13.594  -1.622  -6.606
  133   2HB   PHE  18          HB1       PHE  18 -15.239  -1.049  -6.380
  134    HD1  PHE  18           HD1      PHE  18 -11.790  -0.051  -7.173
  135    HD2  PHE  18           HD2      PHE  18 -15.861   1.171  -6.954
  136    HE1  PHE  18           HE1      PHE  18 -11.238   1.995  -8.417
  137    HE2  PHE  18           HE2      PHE  18 -15.313   3.219  -8.202
  138    HZ   PHE  18           HZ       PHE  18 -13.012   3.598  -8.998
  139    H    VAL  19           HN       VAL  19 -16.188  -1.190  -3.651
  140    HA   VAL  19           HA       VAL  19 -17.311   1.412  -3.706
  141    HB   VAL  19           HB       VAL  19 -18.175  -1.029  -2.137
  142   1HG1  VAL  19          HG11      VAL  19 -19.148   0.996  -1.206
  143   2HG1  VAL  19          HG12      VAL  19 -20.376   0.040  -2.037
  144   3HG1  VAL  19          HG13      VAL  19 -19.708   1.478  -2.808
  145   1HG2  VAL  19          HG21      VAL  19 -19.793  -1.343  -3.961
  146   2HG2  VAL  19          HG22      VAL  19 -18.125  -1.455  -4.525
  147   3HG2  VAL  19          HG23      VAL  19 -19.063   0.010  -4.825
  148    H    LYS  20           HN       LYS  20 -15.190  -0.194  -1.511
  149    HA   LYS  20           HA       LYS  20 -15.912   1.372   0.816
  150   1HB   LYS  20          HB2       LYS  20 -13.453  -0.324   0.314
  151   2HB   LYS  20          HB1       LYS  20 -13.962   0.317   1.868
  152   1HG   LYS  20          HG2       LYS  20 -15.964  -1.082   1.789
  153   2HG   LYS  20          HG1       LYS  20 -15.450  -1.724   0.227
  154   1HD   LYS  20          HD2       LYS  20 -13.884  -1.959   2.800
  155   2HD   LYS  20          HD1       LYS  20 -14.894  -3.231   2.113
  156   1HE   LYS  20          HE2       LYS  20 -13.482  -3.370   0.166
  157   2HE   LYS  20          HE1       LYS  20 -12.544  -1.977   0.696
  158   1HZ   LYS  20          HZ1       LYS  20 -12.718  -4.456   2.306
  159   2HZ   LYS  20          HZ2       LYS  20 -11.586  -3.204   2.433
  160   3HZ   LYS  20          HZ3       LYS  20 -11.544  -4.255   1.101
  161    H    GLY  21           HN       GLY  21 -14.631   2.372  -1.938
  162   1HA   GLY  21          HA2       GLY  21 -13.727   4.475  -2.350
  163   2HA   GLY  21          HA1       GLY  21 -13.343   4.616  -0.636
  164    H    ALA  22           HN       ALA  22 -12.387   1.890  -2.615
  165    HA   ALA  22           HA       ALA  22  -9.737   2.087  -1.574
  166   1HB   ALA  22          HB1       ALA  22 -10.821   0.231  -3.690
  167   2HB   ALA  22          HB2       ALA  22 -10.849  -0.068  -1.953
  168   3HB   ALA  22          HB3       ALA  22  -9.308   0.034  -2.806
  169    H    ASP  23           HN       ASP  23 -11.272   3.147  -4.472
  170    HA   ASP  23           HA       ASP  23  -9.059   3.276  -6.201
  171   1HB   ASP  23          HB2       ASP  23 -11.264   3.606  -7.094
  172   2HB   ASP  23          HB1       ASP  23 -11.562   4.964  -6.009
  173    H    LYS  24           HN       LYS  24 -10.344   5.616  -3.859
  174    HA   LYS  24           HA       LYS  24  -8.445   7.623  -4.533
  175   1HB   LYS  24          HB2       LYS  24 -10.325   7.233  -2.215
  176   2HB   LYS  24          HB1       LYS  24  -9.133   8.525  -2.187
  177   1HG   LYS  24          HG2       LYS  24 -11.333   9.284  -2.971
  178   2HG   LYS  24          HG1       LYS  24 -10.077   9.495  -4.192
  179   1HD   LYS  24          HD2       LYS  24 -10.843   7.257  -5.131
  180   2HD   LYS  24          HD1       LYS  24 -12.250   7.419  -4.082
  181   1HE   LYS  24          HE2       LYS  24 -12.974   9.373  -5.196
  182   2HE   LYS  24          HE1       LYS  24 -11.442   9.539  -6.053
  183   1HZ   LYS  24          HZ1       LYS  24 -11.927   7.517  -7.271
  184   2HZ   LYS  24          HZ2       LYS  24 -13.188   8.638  -7.481
  185   3HZ   LYS  24          HZ3       LYS  24 -13.387   7.323  -6.426
  186    H    VAL  25           HN       VAL  25  -8.527   4.942  -2.318
  187    HA   VAL  25           HA       VAL  25  -6.283   5.504  -0.725
  188    HB   VAL  25           HB       VAL  25  -7.221   2.818  -1.790
  189   1HG1  VAL  25          HG11      VAL  25  -6.014   1.850   0.115
  190   2HG1  VAL  25          HG12      VAL  25  -5.390   3.449   0.521
  191   3HG1  VAL  25          HG13      VAL  25  -4.931   2.684  -1.000
  192   1HG2  VAL  25          HG21      VAL  25  -8.317   2.571   0.396
  193   2HG2  VAL  25          HG22      VAL  25  -8.966   3.924  -0.531
  194   3HG2  VAL  25          HG23      VAL  25  -7.848   4.223   0.801
  195    H    VAL  26           HN       VAL  26  -6.525   3.666  -3.769
  196    HA   VAL  26           HA       VAL  26  -3.765   3.187  -3.828
  197    HB   VAL  26           HB       VAL  26  -4.060   2.474  -6.175
  198   1HG1  VAL  26          HG11      VAL  26  -4.442   0.887  -4.395
  199   2HG1  VAL  26          HG12      VAL  26  -5.598   0.610  -5.698
  200   3HG1  VAL  26          HG13      VAL  26  -6.109   1.435  -4.226
  201   1HG2  VAL  26          HG21      VAL  26  -5.727   4.051  -6.905
  202   2HG2  VAL  26          HG22      VAL  26  -6.897   3.376  -5.769
  203   3HG2  VAL  26          HG23      VAL  26  -6.319   2.403  -7.124
  204    H    HIS  27           HN       HIS  27  -5.697   5.888  -5.097
  205    HA   HIS  27           HA       HIS  27  -3.607   6.849  -6.757
  206   1HB   HIS  27          HB2       HIS  27  -6.039   7.651  -6.843
  207   2HB   HIS  27          HB1       HIS  27  -5.613   8.683  -5.473
  208    HD1  HIS  27           HD1      HIS  27  -3.468  10.313  -5.952
  209    HD2  HIS  27           HD2      HIS  27  -5.415   8.732  -9.272
  210    HE1  HIS  27           HE1      HIS  27  -2.586  11.589  -7.919
  211    HE2  HIS  27           HE2      HIS  27  -3.642  10.501  -9.935
  212    H    ALA  28           HN       ALA  28  -4.525   7.591  -3.468
  213    HA   ALA  28           HA       ALA  28  -2.494   9.444  -2.940
  214   1HB   ALA  28          HB1       ALA  28  -4.376   9.067  -1.402
  215   2HB   ALA  28          HB2       ALA  28  -2.826   8.881  -0.580
  216   3HB   ALA  28          HB3       ALA  28  -3.756   7.455  -1.041
  217    H    PHE  29           HN       PHE  29  -2.700   5.961  -2.801
  218    HA   PHE  29           HA       PHE  29  -0.285   5.268  -1.625
  219   1HB   PHE  29          HB2       PHE  29  -2.403   3.989  -2.961
  220   2HB   PHE  29          HB1       PHE  29  -0.932   3.508  -3.814
  221    HD1  PHE  29           HD1      PHE  29   1.060   3.288  -1.858
  222    HD2  PHE  29           HD2      PHE  29  -3.068   2.339  -1.553
  223    HE1  PHE  29           HE1      PHE  29   1.568   1.688  -0.083
  224    HE2  PHE  29           HE2      PHE  29  -2.570   0.723   0.230
  225    HZ   PHE  29           HZ       PHE  29  -0.247   0.399   0.964
  226    H    LYS  30           HN       LYS  30  -1.070   5.714  -5.051
  227    HA   LYS  30           HA       LYS  30   1.338   4.971  -6.170
  228   1HB   LYS  30          HB2       LYS  30  -0.728   5.386  -7.436
  229   2HB   LYS  30          HB1       LYS  30  -0.571   7.107  -7.112
  230   1HG   LYS  30          HG2       LYS  30   1.593   7.060  -8.339
  231   2HG   LYS  30          HG1       LYS  30   1.234   5.391  -8.790
  232   1HD   LYS  30          HD2       LYS  30  -0.752   6.074  -9.954
  233   2HD   LYS  30          HD1       LYS  30  -0.567   7.733  -9.379
  234   1HE   LYS  30          HE2       LYS  30   1.209   6.245 -11.302
  235   2HE   LYS  30          HE1       LYS  30   0.208   7.659 -11.637
  236   1HZ   LYS  30          HZ1       LYS  30   2.706   7.498 -10.066
  237   2HZ   LYS  30          HZ2       LYS  30   1.633   8.798  -9.871
  238   3HZ   LYS  30          HZ3       LYS  30   2.345   8.505 -11.386
  239    H    GLU  31           HN       GLU  31   0.270   8.102  -5.119
  240    HA   GLU  31           HA       GLU  31   2.781   9.347  -5.844
  241   1HB   GLU  31          HB2       GLU  31   0.461  10.556  -4.333
  242   2HB   GLU  31          HB1       GLU  31   1.741  11.425  -5.163
  243   1HG   GLU  31          HG2       GLU  31  -0.311   9.684  -6.502
  244   2HG   GLU  31          HG1       GLU  31  -0.365  11.443  -6.404
  245    H    GLN  32           HN       GLN  32   1.250   8.175  -3.000
  246    HA   GLN  32           HA       GLN  32   2.942   9.323  -1.089
  247   1HB   GLN  32          HB2       GLN  32   0.981   7.128  -1.159
  248   2HB   GLN  32          HB1       GLN  32   2.132   7.119   0.138
  249   1HG   GLN  32          HG2       GLN  32   0.492   9.524  -0.558
  250   2HG   GLN  32          HG1       GLN  32  -0.059   8.286   0.575
  251   1HE2  GLN  32          HE21      GLN  32   2.490   7.688   1.614
  252   2HE2  GLN  32          HE22      GLN  32   2.969   9.011   2.580
  253    H    LEU  33           HN       LEU  33   3.340   6.619  -3.255
  254    HA   LEU  33           HA       LEU  33   5.524   5.374  -2.010
  255   1HB   LEU  33          HB2       LEU  33   4.328   4.871  -4.301
  256   2HB   LEU  33          HB1       LEU  33   5.606   5.896  -4.940
  257    HG   LEU  33           HG       LEU  33   5.921   3.357  -3.405
  258   1HD1  LEU  33          HD11      LEU  33   5.313   3.034  -5.696
  259   2HD1  LEU  33          HD12      LEU  33   6.987   2.545  -5.408
  260   3HD1  LEU  33          HD13      LEU  33   6.637   4.093  -6.201
  261   1HD2  LEU  33          HD21      LEU  33   8.335   3.545  -3.765
  262   2HD2  LEU  33          HD22      LEU  33   7.704   4.819  -2.725
  263   3HD2  LEU  33          HD23      LEU  33   8.094   5.170  -4.412
  264    H    LYS  34           HN       LYS  34   5.379   7.833  -4.373
  265    HA   LYS  34           HA       LYS  34   6.454   9.705  -4.802
  266   1HB   LYS  34          HB2       LYS  34   7.339  11.072  -2.957
  267   2HB   LYS  34          HB1       LYS  34   5.744  10.421  -2.632
  268   1HG   LYS  34          HG2       LYS  34   6.718  10.081  -0.606
  269   2HG   LYS  34          HG1       LYS  34   7.137   8.536  -1.379
  270   1HD   LYS  34          HD2       LYS  34   9.348   9.345  -1.876
  271   2HD   LYS  34          HD1       LYS  34   8.947  10.967  -1.301
  272   1HE   LYS  34          HE2       LYS  34   8.636  10.120   0.953
  273   2HE   LYS  34          HE1       LYS  34   8.927   8.472   0.399
  274   1HZ   LYS  34          HZ1       LYS  34  11.183   9.056  -0.142
  275   2HZ   LYS  34          HZ2       LYS  34  10.875   9.468   1.473
  276   3HZ   LYS  34          HZ3       LYS  34  10.921  10.672   0.286
  277    H    ILE  35           HN       ILE  35   8.237   7.242  -3.457
  278    HA   ILE  35           HA       ILE  35  10.189   6.306  -3.927
  279    HB   ILE  35           HB       ILE  35  10.670   7.551  -6.511
  280   1HG1  ILE  35          HG12      ILE  35   8.177   5.930  -6.311
  281   2HG1  ILE  35          HG11      ILE  35   8.066   7.682  -6.126
  282   1HG2  ILE  35          HG21      ILE  35  10.555   5.179  -7.165
  283   2HG2  ILE  35          HG22      ILE  35   9.952   4.793  -5.546
  284   3HG2  ILE  35          HG23      ILE  35  11.591   5.424  -5.756
  285   1HD1  ILE  35          HD11      ILE  35   7.577   7.022  -8.401
  286   2HD1  ILE  35          HD12      ILE  35   9.122   6.177  -8.513
  287   3HD1  ILE  35          HD13      ILE  35   9.087   7.933  -8.350
  288    H    ASP  36           HN       ASP  36  12.401   6.923  -5.192
  289    HA   ASP  36           HA       ASP  36  13.488   9.423  -4.269
  290   1HB   ASP  36          HB2       ASP  36  13.371   7.830  -2.253
  291   2HB   ASP  36          HB1       ASP  36  14.568   6.858  -3.090
  292    H    ILE  37           HN       ILE  37  14.027   6.117  -5.161
  293    HA   ILE  37           HA       ILE  37  15.670   6.704  -7.450
  294    HB   ILE  37           HB       ILE  37  17.520   5.270  -6.511
  295   1HG1  ILE  37          HG12      ILE  37  15.882   5.857  -4.110
  296   2HG1  ILE  37          HG11      ILE  37  16.498   4.307  -4.671
  297   1HG2  ILE  37          HG21      ILE  37  17.161   8.013  -5.326
  298   2HG2  ILE  37          HG22      ILE  37  17.895   7.638  -6.887
  299   3HG2  ILE  37          HG23      ILE  37  18.682   7.124  -5.395
  300   1HD1  ILE  37          HD11      ILE  37  18.125   6.517  -3.419
  301   2HD1  ILE  37          HD12      ILE  37  18.773   4.997  -4.033
  302   3HD1  ILE  37          HD13      ILE  37  17.662   4.993  -2.663
  303    H    GLY  38           HN       GLY  38  13.370   4.921  -6.151
  304   1HA   GLY  38          HA2       GLY  38  13.724   2.507  -7.486
  305   2HA   GLY  38          HA1       GLY  38  14.452   2.344  -5.880
  306    H    ASP  39           HN       ASP  39  13.042   3.620  -4.271
  307    HA   ASP  39           HA       ASP  39  10.259   3.467  -4.392
  308   1HB   ASP  39          HB2       ASP  39  10.835   1.055  -4.495
  309   2HB   ASP  39          HB1       ASP  39  11.536   1.229  -2.892
  310    H    VAL  40           HN       VAL  40   9.746   4.872  -3.291
  311    HA   VAL  40           HA       VAL  40   9.344   6.344  -1.679
  312    HB   VAL  40           HB       VAL  40   8.482   4.418  -0.537
  313   1HG1  VAL  40          HG11      VAL  40   9.605   3.112   1.044
  314   2HG1  VAL  40          HG12      VAL  40  11.068   4.084   0.899
  315   3HG1  VAL  40          HG13      VAL  40  10.547   3.065  -0.448
  316   1HG2  VAL  40          HG21      VAL  40   8.579   5.212   1.720
  317   2HG2  VAL  40          HG22      VAL  40   8.432   6.550   0.576
  318   3HG2  VAL  40          HG23      VAL  40   9.993   6.180   1.315
  319    H    THR  41           HN       THR  41  12.031   4.640  -0.483
  320    HA   THR  41           HA       THR  41  13.769   6.939  -0.487
  321    HB   THR  41           HB       THR  41  13.081   5.728   2.198
  322    HG1  THR  41           HG1      THR  41  12.173   7.812   2.621
  323   1HG2  THR  41          HG21      THR  41  15.410   6.459   2.015
  324   2HG2  THR  41          HG22      THR  41  14.499   7.503   3.106
  325   3HG2  THR  41          HG23      THR  41  14.873   8.048   1.471
  326    HA   PRO  42           HA       PRO  42  16.311   3.334   0.725
  327   1HB   PRO  42          HB2       PRO  42  14.834   0.996   1.532
  328   2HB   PRO  42          HB1       PRO  42  15.946   1.980   2.487
  329   1HG   PRO  42          HG2       PRO  42  13.241   1.885   2.899
  330   2HG   PRO  42          HG1       PRO  42  14.271   3.257   3.350
  331   1HD   PRO  42          HD2       PRO  42  12.521   2.909   0.950
  332   2HD   PRO  42          HD1       PRO  42  12.783   4.348   1.955
  333    H    ASP  43           HN       ASP  43  13.785   2.990  -1.519
  334    HA   ASP  43           HA       ASP  43  14.285   2.514  -3.729
  335   1HB   ASP  43          HB2       ASP  43  16.680   2.701  -3.454
  336   2HB   ASP  43          HB1       ASP  43  16.752   1.183  -2.574
  337    H    GLY  44           HN       GLY  44  13.350   0.860  -1.228
  338   1HA   GLY  44          HA2       GLY  44  11.744  -0.835  -2.668
  339   2HA   GLY  44          HA1       GLY  44  13.133  -1.805  -2.168
  340    H    ARG  45           HN       ARG  45  10.624   0.364  -0.993
  341    HA   ARG  45           HA       ARG  45  10.604  -1.035   1.583
  342   1HB   ARG  45          HB2       ARG  45  10.480   1.559   1.134
  343   2HB   ARG  45          HB1       ARG  45   8.789   1.205   0.818
  344   1HG   ARG  45          HG2       ARG  45   8.917   1.884   3.057
  345   2HG   ARG  45          HG1       ARG  45   8.690   0.134   3.083
  346   1HD   ARG  45          HD2       ARG  45  10.814  -0.267   3.829
  347   2HD   ARG  45          HD1       ARG  45  11.462   1.198   3.090
  348    HE   ARG  45           HE       ARG  45   9.640   1.857   5.162
  349   1HH1  ARG  45          HH11      ARG  45  12.862   0.616   4.613
  350   2HH1  ARG  45          HH12      ARG  45  13.510   1.225   6.105
  351   1HH2  ARG  45          HH21      ARG  45  10.480   2.706   7.120
  352   2HH2  ARG  45          HH22      ARG  45  12.150   2.456   7.525
  353    H    PHE  46           HN       PHE  46   8.315   0.189  -0.869
  354    HA   PHE  46           HA       PHE  46   6.727  -2.171  -0.336
  355   1HB   PHE  46          HB2       PHE  46   4.762  -0.774  -0.756
  356   2HB   PHE  46          HB1       PHE  46   5.581  -0.491   0.747
  357    HD1  PHE  46           HD1      PHE  46   7.715   1.520  -0.636
  358    HD2  PHE  46           HD2      PHE  46   3.480   1.135  -0.676
  359    HE1  PHE  46           HE1      PHE  46   7.452   4.000  -0.874
  360    HE2  PHE  46           HE2      PHE  46   3.238   3.535  -0.926
  361    HZ   PHE  46           HZ       PHE  46   5.218   4.955  -1.014
  362    H    SER  47           HN       SER  47   6.530  -3.415  -1.918
  363    HA   SER  47           HA       SER  47   6.639  -2.403  -4.677
  364   1HB   SER  47          HB2       SER  47   8.252  -4.211  -3.981
  365   2HB   SER  47          HB1       SER  47   6.869  -5.269  -3.707
  366    HG   SER  47           HG       SER  47   8.141  -4.733  -5.995
  367    H    ILE  48           HN       ILE  48   4.564  -1.771  -5.065
  368    HA   ILE  48           HA       ILE  48   2.350  -2.929  -3.750
  369    HB   ILE  48           HB       ILE  48   1.000  -1.313  -4.772
  370   1HG1  ILE  48          HG12      ILE  48   1.495  -1.759  -7.131
  371   2HG1  ILE  48          HG11      ILE  48   1.610  -0.037  -6.794
  372   1HG2  ILE  48          HG21      ILE  48   3.780  -0.161  -4.611
  373   2HG2  ILE  48          HG22      ILE  48   2.628  -0.328  -3.286
  374   3HG2  ILE  48          HG23      ILE  48   2.287   0.778  -4.618
  375   1HD1  ILE  48          HD11      ILE  48   3.918  -1.941  -7.038
  376   2HD1  ILE  48          HD12      ILE  48   4.035  -0.207  -6.728
  377   3HD1  ILE  48          HD13      ILE  48   3.391  -0.786  -8.266
  378    H    ASP  49           HN       ASP  49   1.018  -4.562  -4.277
  379    HA   ASP  49           HA       ASP  49   0.188  -4.720  -7.061
  380   1HB   ASP  49          HB2       ASP  49   2.181  -6.331  -6.734
  381   2HB   ASP  49          HB1       ASP  49   1.025  -7.318  -5.850
  382    H    THR  50           HN       THR  50  -1.804  -5.211  -7.254
  383    HA   THR  50           HA       THR  50  -3.762  -5.584  -5.412
  384    HB   THR  50           HB       THR  50  -3.760  -6.788  -8.173
  385    HG1  THR  50           HG1      THR  50  -3.887  -4.798  -8.916
  386   1HG2  THR  50          HG21      THR  50  -5.680  -7.437  -6.806
  387   2HG2  THR  50          HG22      THR  50  -6.176  -6.315  -8.072
  388   3HG2  THR  50          HG23      THR  50  -5.988  -5.744  -6.414
  389    H    LEU  51           HN       LEU  51  -1.828  -8.255  -6.862
  390    HA   LEU  51           HA       LEU  51  -3.979  -9.991  -7.036
  391   1HB   LEU  51          HB2       LEU  51  -1.048 -10.608  -6.914
  392   2HB   LEU  51          HB1       LEU  51  -2.275 -11.797  -7.308
  393    HG   LEU  51           HG       LEU  51  -1.666  -9.294  -8.881
  394   1HD1  LEU  51          HD11      LEU  51  -0.878 -10.854 -10.588
  395   2HD1  LEU  51          HD12      LEU  51  -1.180 -12.205  -9.496
  396   3HD1  LEU  51          HD13      LEU  51   0.051 -11.007  -9.096
  397   1HD2  LEU  51          HD21      LEU  51  -3.645 -11.510  -9.413
  398   2HD2  LEU  51          HD22      LEU  51  -3.250 -10.197 -10.521
  399   3HD2  LEU  51          HD23      LEU  51  -4.035  -9.845  -8.981
  400    H    ARG  52           HN       ARG  52  -1.681  -9.902  -4.286
  401    HA   ARG  52           HA       ARG  52  -2.598 -12.338  -3.170
  402   1HB   ARG  52          HB2       ARG  52  -1.315  -9.987  -1.780
  403   2HB   ARG  52          HB1       ARG  52  -1.541 -11.578  -1.071
  404   1HG   ARG  52          HG2       ARG  52   0.152 -10.949  -3.486
  405   2HG   ARG  52          HG1       ARG  52   0.746 -11.266  -1.858
  406   1HD   ARG  52          HD2       ARG  52   1.017 -13.266  -3.135
  407   2HD   ARG  52          HD1       ARG  52  -0.302 -13.532  -1.998
  408    HE   ARG  52           HE       ARG  52  -1.596 -12.725  -4.213
  409   1HH1  ARG  52          HH11      ARG  52   0.820 -15.212  -3.671
  410   2HH1  ARG  52          HH12      ARG  52   0.244 -16.212  -4.967
  411   1HH2  ARG  52          HH21      ARG  52  -2.353 -14.062  -5.904
  412   2HH2  ARG  52          HH22      ARG  52  -1.552 -15.572  -6.232
  413    H    CYS  53           HN       CYS  53  -3.305  -9.040  -2.298
  414    HA   CYS  53           HA       CYS  53  -5.459  -9.531  -0.559
  415   1HB   CYS  53          HB2       CYS  53  -4.069  -7.452  -0.639
  416   2HB   CYS  53          HB1       CYS  53  -4.896  -7.016  -2.131
  417    H    VAL  54           HN       VAL  54  -7.780  -8.368  -1.278
  418    HA   VAL  54           HA       VAL  54  -9.726  -9.180  -2.145
  419    HB   VAL  54           HB       VAL  54  -8.204 -10.323  -4.509
  420   1HG1  VAL  54          HG11      VAL  54 -10.348 -10.051  -5.676
  421   2HG1  VAL  54          HG12      VAL  54 -11.075  -9.456  -4.182
  422   3HG1  VAL  54          HG13      VAL  54 -10.484 -11.116  -4.277
  423   1HG2  VAL  54          HG21      VAL  54  -7.641  -7.962  -4.366
  424   2HG2  VAL  54          HG22      VAL  54  -9.351  -7.545  -4.255
  425   3HG2  VAL  54          HG23      VAL  54  -8.712  -8.262  -5.735
  426    H    GLY  55           HN       GLY  55  -7.806 -10.500  -0.493
  427   1HA   GLY  55          HA2       GLY  55  -8.514 -13.322  -0.911
  428   2HA   GLY  55          HA1       GLY  55  -7.031 -12.790  -0.138
  429    H    GLY  56           HN       GLY  56 -10.597 -12.284   0.305
  430   1HA   GLY  56          HA2       GLY  56 -11.868 -12.676   2.190
  431   2HA   GLY  56          HA1       GLY  56 -10.567 -13.700   2.747
  432    H    CYS  57           HN       CYS  57 -11.092 -10.134   2.397
  433    HA   CYS  57           HA       CYS  57 -10.016  -9.821   5.151
  434   1HB   CYS  57          HB2       CYS  57  -9.321  -7.825   3.076
  435   2HB   CYS  57          HB1       CYS  57  -8.475  -8.234   4.534
  436    H    ALA  58           HN       ALA  58 -12.024  -8.786   2.533
  437    HA   ALA  58           HA       ALA  58 -11.930  -6.074   2.624
  438   1HB   ALA  58          HB1       ALA  58 -12.941  -7.417   0.859
  439   2HB   ALA  58          HB2       ALA  58 -13.966  -6.070   1.355
  440   3HB   ALA  58          HB3       ALA  58 -14.339  -7.708   1.894
  441    H    LEU  59           HN       LEU  59 -13.980  -8.008   4.859
  442    HA   LEU  59           HA       LEU  59 -15.507  -5.654   5.519
  443   1HB   LEU  59          HB2       LEU  59 -15.290  -8.358   6.810
  444   2HB   LEU  59          HB1       LEU  59 -16.216  -7.060   7.537
  445    HG   LEU  59           HG       LEU  59 -17.540  -6.953   5.376
  446   1HD1  LEU  59          HD11      LEU  59 -17.540  -8.964   3.982
  447   2HD1  LEU  59          HD12      LEU  59 -16.172  -9.596   4.898
  448   3HD1  LEU  59          HD13      LEU  59 -15.985  -8.133   3.930
  449   1HD2  LEU  59          HD21      LEU  59 -17.647  -9.484   7.003
  450   2HD2  LEU  59          HD22      LEU  59 -18.944  -8.862   5.981
  451   3HD2  LEU  59          HD23      LEU  59 -18.425  -7.953   7.401
  452    H    ALA  60           HN       ALA  60 -12.380  -6.325   6.088
  453    HA   ALA  60           HA       ALA  60 -12.343  -4.370   8.299
  454   1HB   ALA  60          HB1       ALA  60 -11.155  -6.438   8.858
  455   2HB   ALA  60          HB2       ALA  60 -10.023  -5.095   8.694
  456   3HB   ALA  60          HB3       ALA  60 -10.178  -6.281   7.399
  457    HA   PRO  61           HA       PRO  61 -10.192  -1.880   5.125
  458   1HB   PRO  61          HB2       PRO  61  -8.568  -0.323   6.653
  459   2HB   PRO  61          HB1       PRO  61 -10.291   0.016   6.446
  460   1HG   PRO  61          HG2       PRO  61  -8.871  -1.251   8.746
  461   2HG   PRO  61          HG1       PRO  61 -10.249  -0.139   8.753
  462   1HD   PRO  61          HD2       PRO  61 -10.448  -2.865   9.091
  463   2HD   PRO  61          HD1       PRO  61 -11.763  -1.836   8.494
  464    H    ILE  62           HN       ILE  62  -8.682  -2.978   3.992
  465    HA   ILE  62           HA       ILE  62  -6.386  -4.056   5.474
  466    HB   ILE  62           HB       ILE  62  -7.728  -5.818   4.511
  467   1HG1  ILE  62          HG12      ILE  62  -5.998  -6.925   3.088
  468   2HG1  ILE  62          HG11      ILE  62  -5.113  -5.403   3.050
  469   1HG2  ILE  62          HG21      ILE  62  -8.805  -4.616   2.721
  470   2HG2  ILE  62          HG22      ILE  62  -8.003  -6.052   2.082
  471   3HG2  ILE  62          HG23      ILE  62  -7.272  -4.462   1.865
  472   1HD1  ILE  62          HD11      ILE  62  -4.194  -6.959   4.685
  473   2HD1  ILE  62          HD12      ILE  62  -5.746  -6.996   5.525
  474   3HD1  ILE  62          HD13      ILE  62  -4.816  -5.499   5.455
  475    H    VAL  63           HN       VAL  63  -4.392  -3.016   5.060
  476    HA   VAL  63           HA       VAL  63  -3.855  -3.373   2.230
  477    HB   VAL  63           HB       VAL  63  -3.985  -0.946   2.404
  478   1HG1  VAL  63          HG11      VAL  63  -3.374  -0.646   4.740
  479   2HG1  VAL  63          HG12      VAL  63  -2.365   0.337   3.678
  480   3HG1  VAL  63          HG13      VAL  63  -1.724  -1.151   4.377
  481   1HG2  VAL  63          HG21      VAL  63  -1.202  -2.021   2.001
  482   2HG2  VAL  63          HG22      VAL  63  -1.775  -0.447   1.447
  483   3HG2  VAL  63          HG23      VAL  63  -2.484  -1.923   0.792
  484    H    MET  64           HN       MET  64  -2.157  -4.752   1.944
  485    HA   MET  64           HA       MET  64  -0.636  -5.299   4.413
  486   1HB   MET  64          HB2       MET  64  -2.134  -7.163   3.869
  487   2HB   MET  64          HB1       MET  64  -1.479  -7.228   2.236
  488   1HG   MET  64          HG2       MET  64   0.748  -7.705   3.243
  489   2HG   MET  64          HG1       MET  64  -0.054  -7.853   4.806
  490   1HE   MET  64          HE1       MET  64   0.349  -9.371   1.205
  491   2HE   MET  64          HE2       MET  64  -1.370  -8.978   1.261
  492   3HE   MET  64          HE3       MET  64  -0.851 -10.664   1.229
  493    H    VAL  65           HN       VAL  65   1.510  -5.115   4.251
  494    HA   VAL  65           HA       VAL  65   2.624  -5.279   1.540
  495    HB   VAL  65           HB       VAL  65   4.202  -3.784   3.513
  496   1HG1  VAL  65          HG11      VAL  65   4.794  -3.909   1.173
  497   2HG1  VAL  65          HG12      VAL  65   4.394  -2.244   1.607
  498   3HG1  VAL  65          HG13      VAL  65   3.224  -3.234   0.729
  499   1HG2  VAL  65          HG21      VAL  65   1.608  -2.649   2.511
  500   2HG2  VAL  65          HG22      VAL  65   2.854  -1.776   3.409
  501   3HG2  VAL  65          HG23      VAL  65   1.963  -3.089   4.181
  502    H    GLY  66           HN       GLY  66   3.735  -7.103   1.385
  503   1HA   GLY  66          HA2       GLY  66   5.214  -8.809   1.898
  504   2HA   GLY  66          HA1       GLY  66   6.070  -7.542   2.745
  505    H    GLU  67           HN       GLU  67   3.061  -9.176   3.389
  506    HA   GLU  67           HA       GLU  67   2.262 -10.268   5.214
  507   1HB   GLU  67          HB2       GLU  67   5.191 -10.773   5.705
  508   2HB   GLU  67          HB1       GLU  67   3.876 -11.606   6.519
  509   1HG   GLU  67          HG2       GLU  67   4.277 -11.646   3.543
  510   2HG   GLU  67          HG1       GLU  67   4.943 -12.857   4.637
  511    H    LYS  68           HN       LYS  68   3.922  -7.447   5.446
  512    HA   LYS  68           HA       LYS  68   4.247  -7.292   8.295
  513   1HB   LYS  68          HB2       LYS  68   4.188  -5.055   6.268
  514   2HB   LYS  68          HB1       LYS  68   4.720  -4.909   7.933
  515   1HG   LYS  68          HG2       LYS  68   6.065  -6.532   5.770
  516   2HG   LYS  68          HG1       LYS  68   6.621  -4.994   6.424
  517   1HD   LYS  68          HD2       LYS  68   6.355  -7.587   7.956
  518   2HD   LYS  68          HD1       LYS  68   7.862  -6.854   7.403
  519   1HE   LYS  68          HE2       LYS  68   5.936  -5.672   9.402
  520   2HE   LYS  68          HE1       LYS  68   7.480  -6.432   9.780
  521   1HZ   LYS  68          HZ1       LYS  68   8.564  -4.688   8.432
  522   2HZ   LYS  68          HZ2       LYS  68   7.750  -4.072   9.783
  523   3HZ   LYS  68          HZ3       LYS  68   7.058  -3.927   8.245
  524    H    VAL  69           HN       VAL  69   1.880  -6.344   5.982
  525    HA   VAL  69           HA       VAL  69  -0.266  -5.584   6.107
  526    HB   VAL  69           HB       VAL  69  -0.152  -6.771   8.883
  527   1HG1  VAL  69          HG11      VAL  69  -1.959  -5.136   8.722
  528   2HG1  VAL  69          HG12      VAL  69  -2.610  -6.774   8.778
  529   3HG1  VAL  69          HG13      VAL  69  -2.538  -5.904   7.245
  530   1HG2  VAL  69          HG21      VAL  69  -1.336  -8.654   7.835
  531   2HG2  VAL  69          HG22      VAL  69   0.250  -8.390   7.108
  532   3HG2  VAL  69          HG23      VAL  69  -1.206  -7.851   6.268
  533    H    TYR  70           HN       TYR  70  -0.647  -3.486   6.048
  534    HA   TYR  70           HA       TYR  70  -0.243  -1.891   8.474
  535   1HB   TYR  70          HB2       TYR  70   0.519  -1.119   5.669
  536   2HB   TYR  70          HB1       TYR  70   0.495  -0.006   7.038
  537    HD1  TYR  70           HD1      TYR  70   1.662  -1.294   9.185
  538    HD2  TYR  70           HD2      TYR  70   2.679  -1.716   5.100
  539    HE1  TYR  70           HE1      TYR  70   3.879  -1.877   9.834
  540    HE2  TYR  70           HE2      TYR  70   4.959  -2.357   5.736
  541    HH   TYR  70           HH       TYR  70   5.802  -3.326   8.782
  542    H    GLY  71           HN       GLY  71  -1.093   0.466   7.777
  543   1HA   GLY  71          HA2       GLY  71  -3.777   0.171   6.598
  544   2HA   GLY  71          HA1       GLY  71  -3.553   1.006   8.132
  545    H    ASN  72           HN       ASN  72  -1.153   1.227   5.657
  546    HA   ASN  72           HA       ASN  72  -1.487   4.074   5.450
  547   1HB   ASN  72          HB2       ASN  72   0.803   3.242   5.369
  548   2HB   ASN  72          HB1       ASN  72   0.424   2.121   4.063
  549   1HD2  ASN  72          HD21      ASN  72  -0.234   3.052   2.020
  550   2HD2  ASN  72          HD22      ASN  72   0.368   4.607   1.572
  551    H    VAL  73           HN       VAL  73  -2.993   5.027   4.109
  552    HA   VAL  73           HA       VAL  73  -3.977   3.412   1.880
  553    HB   VAL  73           HB       VAL  73  -6.340   4.004   2.654
  554   1HG1  VAL  73          HG11      VAL  73  -5.580   1.770   2.545
  555   2HG1  VAL  73          HG12      VAL  73  -6.197   1.971   4.190
  556   3HG1  VAL  73          HG13      VAL  73  -4.456   2.020   3.879
  557   1HG2  VAL  73          HG21      VAL  73  -5.539   5.522   4.501
  558   2HG2  VAL  73          HG22      VAL  73  -4.901   4.091   5.305
  559   3HG2  VAL  73          HG23      VAL  73  -6.634   4.244   5.025
  560    H    THR  74           HN       THR  74  -5.894   6.102   2.938
  561    HA   THR  74           HA       THR  74  -4.775   7.746   0.821
  562    HB   THR  74           HB       THR  74  -6.440   6.502  -0.367
  563    HG1  THR  74           HG1      THR  74  -6.656   8.366  -1.331
  564   1HG2  THR  74          HG21      THR  74  -8.843   6.706   0.170
  565   2HG2  THR  74          HG22      THR  74  -8.421   7.548   1.663
  566   3HG2  THR  74          HG23      THR  74  -7.942   5.866   1.431
  567    HA   PRO  75           HA       PRO  75  -7.836  10.561   3.247
  568   1HB   PRO  75          HB2       PRO  75  -8.179   9.474   5.922
  569   2HB   PRO  75          HB1       PRO  75  -9.406   9.861   4.715
  570   1HG   PRO  75          HG2       PRO  75  -8.821   7.320   5.455
  571   2HG   PRO  75          HG1       PRO  75  -9.397   7.746   3.835
  572   1HD   PRO  75          HD2       PRO  75  -6.604   7.191   4.766
  573   2HD   PRO  75          HD1       PRO  75  -7.424   6.658   3.283
  574    H    GLY  76           HN       GLY  76  -5.223  10.892   3.139
  575   1HA   GLY  76          HA2       GLY  76  -3.577  12.229   4.011
  576   2HA   GLY  76          HA1       GLY  76  -4.631  12.565   5.375
  577    H    GLN  77           HN       GLN  77  -4.474   9.304   5.176
  578    HA   GLN  77           HA       GLN  77  -3.056   9.281   7.695
  579   1HB   GLN  77          HB2       GLN  77  -3.990   6.828   6.190
  580   2HB   GLN  77          HB1       GLN  77  -3.739   7.010   7.921
  581   1HG   GLN  77          HG2       GLN  77  -5.678   8.746   7.721
  582   2HG   GLN  77          HG1       GLN  77  -6.019   7.871   6.224
  583   1HE2  GLN  77          HE21      GLN  77  -6.574   5.691   6.322
  584   2HE2  GLN  77          HE22      GLN  77  -7.224   4.991   7.769
  585    H    VAL  78           HN       VAL  78  -2.661   8.559   4.448
  586    HA   VAL  78           HA       VAL  78  -0.718   6.660   4.361
  587    HB   VAL  78           HB       VAL  78  -0.141   8.143   2.220
  588   1HG1  VAL  78          HG11      VAL  78  -0.842   5.850   2.165
  589   2HG1  VAL  78          HG12      VAL  78  -1.828   6.784   1.038
  590   3HG1  VAL  78          HG13      VAL  78  -2.485   6.322   2.612
  591   1HG2  VAL  78          HG21      VAL  78  -3.024   8.704   2.633
  592   2HG2  VAL  78          HG22      VAL  78  -1.935   9.339   1.388
  593   3HG2  VAL  78          HG23      VAL  78  -1.760   9.857   3.083
  594    H    LYS  79           HN       LYS  79  -0.326  10.217   4.681
  595    HA   LYS  79           HA       LYS  79   2.367  10.267   3.888
  596   1HB   LYS  79          HB2       LYS  79   0.997  12.056   5.920
  597   2HB   LYS  79          HB1       LYS  79   2.493  12.419   5.071
  598   1HG   LYS  79          HG2       LYS  79   1.307  12.501   2.959
  599   2HG   LYS  79          HG1       LYS  79  -0.198  12.057   3.766
  600   1HD   LYS  79          HD2       LYS  79   1.405  14.547   4.358
  601   2HD   LYS  79          HD1       LYS  79  -0.009  14.486   3.303
  602   1HE   LYS  79          HE2       LYS  79  -1.380  13.722   5.174
  603   2HE   LYS  79          HE1       LYS  79   0.034  13.750   6.228
  604   1HZ   LYS  79          HZ1       LYS  79  -1.183  16.104   4.880
  605   2HZ   LYS  79          HZ2       LYS  79   0.205  16.142   5.856
  606   3HZ   LYS  79          HZ3       LYS  79  -1.297  15.724   6.529
  607    H    LYS  80           HN       LYS  80   0.765   9.787   6.887
  608    HA   LYS  80           HA       LYS  80   3.132   9.734   8.508
  609   1HB   LYS  80          HB2       LYS  80   0.466   8.829   9.453
  610   2HB   LYS  80          HB1       LYS  80   1.621   9.910  10.215
  611   1HG   LYS  80          HG2       LYS  80   0.467  11.636   9.524
  612   2HG   LYS  80          HG1       LYS  80   0.738  11.177   7.852
  613   1HD   LYS  80          HD2       LYS  80  -1.618  11.449   8.299
  614   2HD   LYS  80          HD1       LYS  80  -1.253   9.766   7.915
  615   1HE   LYS  80          HE2       LYS  80  -2.831   9.964   9.794
  616   2HE   LYS  80          HE1       LYS  80  -1.319   9.214  10.301
  617   1HZ   LYS  80          HZ1       LYS  80  -0.700  11.051  11.505
  618   2HZ   LYS  80          HZ2       LYS  80  -2.379  11.077  11.733
  619   3HZ   LYS  80          HZ3       LYS  80  -1.663  12.122  10.608
  620    H    ILE  81           HN       ILE  81   0.636   7.543   7.437
  621    HA   ILE  81           HA       ILE  81   1.799   5.285   8.748
  622    HB   ILE  81           HB       ILE  81  -0.159   5.151   6.449
  623   1HG1  ILE  81          HG12      ILE  81  -1.049   6.608   8.228
  624   2HG1  ILE  81          HG11      ILE  81  -1.921   5.081   8.167
  625   1HG2  ILE  81          HG21      ILE  81  -0.759   3.002   7.471
  626   2HG2  ILE  81          HG22      ILE  81   0.442   3.259   8.737
  627   3HG2  ILE  81          HG23      ILE  81   0.957   3.040   7.063
  628   1HD1  ILE  81          HD11      ILE  81  -0.653   4.278  10.088
  629   2HD1  ILE  81          HD12      ILE  81  -1.500   5.781  10.454
  630   3HD1  ILE  81          HD13      ILE  81   0.234   5.801  10.139
  631    H    LEU  82           HN       LEU  82   2.461   6.911   5.765
  632    HA   LEU  82           HA       LEU  82   3.962   4.900   4.520
  633   1HB   LEU  82          HB2       LEU  82   3.466   7.054   3.444
  634   2HB   LEU  82          HB1       LEU  82   4.468   7.884   4.628
  635    HG   LEU  82           HG       LEU  82   6.419   6.564   3.824
  636   1HD1  LEU  82          HD11      LEU  82   6.273   5.467   1.654
  637   2HD1  LEU  82          HD12      LEU  82   4.540   5.792   1.596
  638   3HD1  LEU  82          HD13      LEU  82   5.195   4.710   2.827
  639   1HD2  LEU  82          HD21      LEU  82   6.781   7.915   1.833
  640   2HD2  LEU  82          HD22      LEU  82   5.999   8.875   3.089
  641   3HD2  LEU  82          HD23      LEU  82   5.054   8.262   1.730
  642    H    ALA  83           HN       ALA  83   4.730   7.050   7.243
  643    HA   ALA  83           HA       ALA  83   7.396   6.182   7.588
  644   1HB   ALA  83          HB1       ALA  83   5.429   6.977   9.734
  645   2HB   ALA  83          HB2       ALA  83   6.448   8.088   8.817
  646   3HB   ALA  83          HB3       ALA  83   7.183   6.904   9.899
  647    H    GLU  84           HN       GLU  84   4.321   4.730   8.241
  648    HA   GLU  84           HA       GLU  84   5.279   2.532   9.798
  649   1HB   GLU  84          HB2       GLU  84   2.749   3.417   8.816
  650   2HB   GLU  84          HB1       GLU  84   2.971   1.722   8.384
  651   1HG   GLU  84          HG2       GLU  84   3.662   1.410  10.843
  652   2HG   GLU  84          HG1       GLU  84   2.928   2.991  11.105
  653    H    TYR  85           HN       TYR  85   5.048   3.289   6.429
  654    HA   TYR  85           HA       TYR  85   5.426   0.658   5.533
  655   1HB   TYR  85          HB2       TYR  85   5.292   3.355   4.334
  656   2HB   TYR  85          HB1       TYR  85   6.029   2.070   3.396
  657    HD1  TYR  85           HD1      TYR  85   3.870   0.566   5.486
  658    HD2  TYR  85           HD2      TYR  85   3.981   2.906   2.069
  659    HE1  TYR  85           HE1      TYR  85   1.850  -0.493   4.808
  660    HE2  TYR  85           HE2      TYR  85   1.896   1.901   1.360
  661    HH   TYR  85           HH       TYR  85   0.548  -0.099   1.694
  Start of MODEL   15
    1   1H    MET   1          HT1       MET   1  11.331  -9.967  13.682
    2   2H    MET   1          HT2       MET   1  10.861 -11.579  13.464
    3   3H    MET   1          HT3       MET   1   9.721 -10.422  13.950
    4    HA   MET   1           HA       MET   1   9.465 -10.985  11.623
    5   1HB   MET   1          HB2       MET   1   8.814  -8.762  12.321
    6   2HB   MET   1          HB1       MET   1  10.475  -8.198  12.223
    7   1HG   MET   1          HG2       MET   1   9.150  -7.422  10.341
    8   2HG   MET   1          HG1       MET   1  10.458  -8.479   9.819
    9   1HE   MET   1          HE1       MET   1   7.011  -9.476  11.471
   10   2HE   MET   1          HE2       MET   1   6.023  -9.745  10.035
   11   3HE   MET   1          HE3       MET   1   6.603  -8.124  10.415
   12    H    VAL   2           HN       VAL   2  10.356 -11.426   9.662
   13    HA   VAL   2           HA       VAL   2  13.274 -11.166   9.440
   14    HB   VAL   2           HB       VAL   2  11.389 -12.790   7.713
   15   1HG1  VAL   2          HG11      VAL   2  14.402 -12.796   7.880
   16   2HG1  VAL   2          HG12      VAL   2  13.442 -12.126   6.562
   17   3HG1  VAL   2          HG13      VAL   2  13.417 -13.862   6.876
   18   1HG2  VAL   2          HG21      VAL   2  13.205 -13.674   9.954
   19   2HG2  VAL   2          HG22      VAL   2  12.289 -14.743   8.893
   20   3HG2  VAL   2          HG23      VAL   2  11.442 -13.652   9.989
   21    HA   PRO   3           HA       PRO   3  12.072  -7.805   6.650
   22   1HB   PRO   3          HB2       PRO   3  14.613  -6.593   7.144
   23   2HB   PRO   3          HB1       PRO   3  13.043  -6.106   7.783
   24   1HG   PRO   3          HG2       PRO   3  15.130  -7.140   9.284
   25   2HG   PRO   3          HG1       PRO   3  13.432  -7.099   9.785
   26   1HD   PRO   3          HD2       PRO   3  15.024  -9.361   8.662
   27   2HD   PRO   3          HD1       PRO   3  13.742  -9.380   9.893
   28    H    LYS   4           HN       LYS   4  12.250  -9.201   4.821
   29    HA   LYS   4           HA       LYS   4  14.836  -9.833   3.769
   30   1HB   LYS   4          HB2       LYS   4  12.154 -10.162   2.449
   31   2HB   LYS   4          HB1       LYS   4  13.662 -10.932   1.965
   32   1HG   LYS   4          HG2       LYS   4  13.716 -12.115   4.130
   33   2HG   LYS   4          HG1       LYS   4  12.157 -11.395   4.535
   34   1HD   LYS   4          HD2       LYS   4  11.728 -13.585   3.718
   35   2HD   LYS   4          HD1       LYS   4  11.240 -12.457   2.454
   36   1HE   LYS   4          HE2       LYS   4  12.429 -14.300   1.460
   37   2HE   LYS   4          HE1       LYS   4  13.404 -12.837   1.326
   38   1HZ   LYS   4          HZ1       LYS   4  14.706 -14.778   1.999
   39   2HZ   LYS   4          HZ2       LYS   4  13.762 -14.939   3.401
   40   3HZ   LYS   4          HZ3       LYS   4  14.736 -13.567   3.185
   41    H    GLY   5           HN       GLY   5  12.139  -8.129   2.280
   42   1HA   GLY   5          HA2       GLY   5  13.020  -5.650   1.904
   43   2HA   GLY   5          HA1       GLY   5  14.029  -6.515   0.749
   44    H    LYS   6           HN       LYS   6  12.056  -4.452   0.271
   45    HA   LYS   6           HA       LYS   6  10.177  -3.943  -0.911
   46   1HB   LYS   6          HB2       LYS   6  10.217  -4.933  -3.244
   47   2HB   LYS   6          HB1       LYS   6  11.647  -4.050  -2.726
   48   1HG   LYS   6          HG2       LYS   6  11.623  -6.975  -2.309
   49   2HG   LYS   6          HG1       LYS   6  11.764  -6.387  -3.971
   50   1HD   LYS   6          HD2       LYS   6  13.556  -5.630  -1.657
   51   2HD   LYS   6          HD1       LYS   6  13.970  -6.740  -2.969
   52   1HE   LYS   6          HE2       LYS   6  13.728  -4.933  -4.586
   53   2HE   LYS   6          HE1       LYS   6  13.281  -3.821  -3.294
   54   1HZ   LYS   6          HZ1       LYS   6  15.464  -4.084  -2.333
   55   2HZ   LYS   6          HZ2       LYS   6  15.611  -3.611  -3.954
   56   3HZ   LYS   6          HZ3       LYS   6  15.890  -5.225  -3.516
   57    H    TYR   7           HN       TYR   7   9.220  -5.322   0.921
   58    HA   TYR   7           HA       TYR   7   7.952  -7.686   0.724
   59   1HB   TYR   7          HB2       TYR   7   6.601  -5.216   1.778
   60   2HB   TYR   7          HB1       TYR   7   6.476  -6.874   2.376
   61    HD1  TYR   7           HD1      TYR   7   8.714  -7.936   3.113
   62    HD2  TYR   7           HD2      TYR   7   8.017  -3.774   2.799
   63    HE1  TYR   7           HE1      TYR   7  10.593  -7.528   4.576
   64    HE2  TYR   7           HE2      TYR   7   9.899  -3.318   4.265
   65    HH   TYR   7           HH       TYR   7  12.237  -5.550   5.014
   66    HA   PRO   8           HA       PRO   8   5.095  -7.278  -2.769
   67   1HB   PRO   8          HB2       PRO   8   3.976  -9.638  -1.300
   68   2HB   PRO   8          HB1       PRO   8   4.331  -9.461  -3.027
   69   1HG   PRO   8          HG2       PRO   8   5.946 -10.887  -1.505
   70   2HG   PRO   8          HG1       PRO   8   6.628  -9.767  -2.703
   71   1HD   PRO   8          HD2       PRO   8   6.348  -9.427   0.264
   72   2HD   PRO   8          HD1       PRO   8   7.714  -9.006  -0.794
   73    H    ILE   9           HN       ILE   9   3.984  -5.423  -2.133
   74    HA   ILE   9           HA       ILE   9   2.268  -5.484   0.170
   75    HB   ILE   9           HB       ILE   9   2.884  -3.367   0.234
   76   1HG1  ILE   9          HG12      ILE   9   1.233  -2.990  -2.279
   77   2HG1  ILE   9          HG11      ILE   9   0.607  -2.996  -0.633
   78   1HG2  ILE   9          HG21      ILE   9   3.733  -3.612  -2.646
   79   2HG2  ILE   9          HG22      ILE   9   4.748  -3.782  -1.213
   80   3HG2  ILE   9          HG23      ILE   9   4.050  -2.213  -1.619
   81   1HD1  ILE   9          HD11      ILE   9   2.557  -1.011  -1.774
   82   2HD1  ILE   9          HD12      ILE   9   1.928  -1.012  -0.126
   83   3HD1  ILE   9          HD13      ILE   9   0.837  -0.739  -1.486
   84    H    SER  10           HN       SER  10   0.142  -5.509   0.263
   85    HA   SER  10           HA       SER  10  -1.273  -6.245  -2.210
   86   1HB   SER  10          HB2       SER  10  -2.164  -6.619   0.654
   87   2HB   SER  10          HB1       SER  10  -2.860  -7.364  -0.791
   88    HG   SER  10           HG       SER  10  -0.231  -7.865  -0.694
   89    H    VAL  11           HN       VAL  11  -2.703  -4.893  -3.075
   90    HA   VAL  11           HA       VAL  11  -3.555  -2.597  -1.441
   91    HB   VAL  11           HB       VAL  11  -3.515  -1.190  -3.406
   92   1HG1  VAL  11          HG11      VAL  11  -1.231  -0.925  -3.538
   93   2HG1  VAL  11          HG12      VAL  11  -0.931  -2.664  -3.566
   94   3HG1  VAL  11          HG13      VAL  11  -1.396  -1.873  -2.048
   95   1HG2  VAL  11          HG21      VAL  11  -4.150  -2.808  -5.118
   96   2HG2  VAL  11          HG22      VAL  11  -2.609  -3.639  -4.925
   97   3HG2  VAL  11          HG23      VAL  11  -2.651  -1.996  -5.562
   98    H    CYS  12           HN       CYS  12  -5.694  -2.371  -1.108
   99    HA   CYS  12           HA       CYS  12  -7.648  -3.990  -2.369
  100   1HB   CYS  12          HB2       CYS  12  -8.129  -3.141  -0.188
  101   2HB   CYS  12          HB1       CYS  12  -7.865  -1.479  -0.707
  102    H    MET  13           HN       MET  13  -8.198  -3.814  -4.447
  103    HA   MET  13           HA       MET  13  -9.212  -1.183  -5.271
  104   1HB   MET  13          HB2       MET  13  -7.116  -2.035  -6.529
  105   2HB   MET  13          HB1       MET  13  -8.206  -3.196  -7.273
  106   1HG   MET  13          HG2       MET  13  -9.548  -1.400  -8.186
  107   2HG   MET  13          HG1       MET  13  -8.536  -0.206  -7.374
  108   1HE   MET  13          HE1       MET  13  -7.524   0.407 -11.070
  109   2HE   MET  13          HE2       MET  13  -8.025   1.144  -9.547
  110   3HE   MET  13          HE3       MET  13  -9.130   0.078 -10.417
  111    H    GLY  14           HN       GLY  14 -10.490  -3.428  -3.852
  112   1HA   GLY  14          HA2       GLY  14 -11.694  -5.215  -5.701
  113   2HA   GLY  14          HA1       GLY  14 -12.123  -5.045  -4.012
  114    H    THR  15           HN       THR  15 -14.157  -5.644  -5.440
  115    HA   THR  15           HA       THR  15 -15.401  -3.594  -6.938
  116    HB   THR  15           HB       THR  15 -16.027  -5.836  -7.427
  117    HG1  THR  15           HG1      THR  15 -18.169  -5.535  -7.545
  118   1HG2  THR  15          HG21      THR  15 -17.174  -7.303  -5.820
  119   2HG2  THR  15          HG22      THR  15 -16.953  -6.085  -4.563
  120   3HG2  THR  15          HG23      THR  15 -15.548  -6.879  -5.277
  121    H    ALA  16           HN       ALA  16 -15.841  -4.688  -3.601
  122    HA   ALA  16           HA       ALA  16 -18.070  -3.004  -3.076
  123   1HB   ALA  16          HB1       ALA  16 -17.725  -3.612  -0.733
  124   2HB   ALA  16          HB2       ALA  16 -16.165  -4.329  -1.144
  125   3HB   ALA  16          HB3       ALA  16 -17.654  -5.034  -1.776
  126    H    CYS  17           HN       CYS  17 -14.673  -2.876  -2.204
  127    HA   CYS  17           HA       CYS  17 -14.755  -0.462  -0.795
  128   1HB   CYS  17          HB2       CYS  17 -12.512  -1.881  -2.198
  129   2HB   CYS  17          HB1       CYS  17 -12.293  -0.536  -1.113
  130    H    PHE  18           HN       PHE  18 -14.277  -1.134  -4.234
  131    HA   PHE  18           HA       PHE  18 -13.171   1.323  -5.007
  132   1HB   PHE  18          HB2       PHE  18 -13.357  -0.769  -6.412
  133   2HB   PHE  18          HB1       PHE  18 -15.043  -0.348  -6.684
  134    HD1  PHE  18           HD1      PHE  18 -11.563   0.609  -7.362
  135    HD2  PHE  18           HD2      PHE  18 -15.663   1.412  -8.165
  136    HE1  PHE  18           HE1      PHE  18 -10.908   2.032  -9.258
  137    HE2  PHE  18           HE2      PHE  18 -15.016   2.835 -10.063
  138    HZ   PHE  18           HZ       PHE  18 -12.611   3.133 -10.610
  139    H    VAL  19           HN       VAL  19 -16.477   0.380  -4.385
  140    HA   VAL  19           HA       VAL  19 -17.691   2.702  -5.525
  141    HB   VAL  19           HB       VAL  19 -18.834   0.836  -3.432
  142   1HG1  VAL  19          HG11      VAL  19 -20.068   2.929  -3.648
  143   2HG1  VAL  19          HG12      VAL  19 -21.005   1.577  -4.279
  144   3HG1  VAL  19          HG13      VAL  19 -20.198   2.684  -5.388
  145   1HG2  VAL  19          HG21      VAL  19 -19.002   0.679  -6.439
  146   2HG2  VAL  19          HG22      VAL  19 -19.876  -0.351  -5.306
  147   3HG2  VAL  19          HG23      VAL  19 -18.115  -0.423  -5.385
  148    H    LYS  20           HN       LYS  20 -16.158   1.942  -2.561
  149    HA   LYS  20           HA       LYS  20 -17.306   4.110  -1.027
  150   1HB   LYS  20          HB2       LYS  20 -16.707   2.020   0.066
  151   2HB   LYS  20          HB1       LYS  20 -15.060   2.138  -0.521
  152   1HG   LYS  20          HG2       LYS  20 -15.000   2.698   1.753
  153   2HG   LYS  20          HG1       LYS  20 -14.839   4.219   0.874
  154   1HD   LYS  20          HD2       LYS  20 -17.189   4.707   1.250
  155   2HD   LYS  20          HD1       LYS  20 -17.396   3.156   2.071
  156   1HE   LYS  20          HE2       LYS  20 -15.652   5.449   2.959
  157   2HE   LYS  20          HE1       LYS  20 -17.159   4.923   3.706
  158   1HZ   LYS  20          HZ1       LYS  20 -14.764   3.185   3.477
  159   2HZ   LYS  20          HZ2       LYS  20 -16.159   2.905   4.401
  160   3HZ   LYS  20          HZ3       LYS  20 -15.089   4.145   4.834
  161    H    GLY  21           HN       GLY  21 -15.346   4.152  -3.562
  162   1HA   GLY  21          HA2       GLY  21 -14.195   5.991  -4.406
  163   2HA   GLY  21          HA1       GLY  21 -14.203   6.702  -2.796
  164    H    ALA  22           HN       ALA  22 -13.070   3.448  -3.458
  165    HA   ALA  22           HA       ALA  22 -10.739   3.977  -1.917
  166   1HB   ALA  22          HB1       ALA  22 -10.166   1.645  -2.312
  167   2HB   ALA  22          HB2       ALA  22 -11.420   1.534  -3.546
  168   3HB   ALA  22          HB3       ALA  22 -11.863   1.806  -1.861
  169    H    ASP  23           HN       ASP  23 -11.447   4.069  -5.276
  170    HA   ASP  23           HA       ASP  23  -8.935   3.580  -6.373
  171   1HB   ASP  23          HB2       ASP  23 -10.774   3.799  -7.867
  172   2HB   ASP  23          HB1       ASP  23 -11.178   5.401  -7.252
  173    H    LYS  24           HN       LYS  24 -10.332   6.664  -5.235
  174    HA   LYS  24           HA       LYS  24  -8.073   8.153  -6.086
  175   1HB   LYS  24          HB2       LYS  24 -10.361   8.805  -4.243
  176   2HB   LYS  24          HB1       LYS  24  -9.050   9.942  -4.524
  177   1HG   LYS  24          HG2       LYS  24 -10.798  10.552  -5.982
  178   2HG   LYS  24          HG1       LYS  24  -9.575   9.764  -6.979
  179   1HD   LYS  24          HD2       LYS  24 -10.886   7.662  -6.833
  180   2HD   LYS  24          HD1       LYS  24 -12.138   8.546  -5.958
  181   1HE   LYS  24          HE2       LYS  24 -11.201   9.037  -8.781
  182   2HE   LYS  24          HE1       LYS  24 -12.761   8.390  -8.275
  183   1HZ   LYS  24          HZ1       LYS  24 -13.076  10.661  -8.787
  184   2HZ   LYS  24          HZ2       LYS  24 -11.729  11.140  -7.878
  185   3HZ   LYS  24          HZ3       LYS  24 -13.113  10.553  -7.093
  186    H    VAL  25           HN       VAL  25  -8.929   6.597  -3.040
  187    HA   VAL  25           HA       VAL  25  -6.880   7.912  -1.571
  188    HB   VAL  25           HB       VAL  25  -7.314   5.976   0.025
  189   1HG1  VAL  25          HG11      VAL  25  -9.498   7.920  -0.685
  190   2HG1  VAL  25          HG12      VAL  25  -8.142   8.222   0.401
  191   3HG1  VAL  25          HG13      VAL  25  -9.383   7.051   0.844
  192   1HG2  VAL  25          HG21      VAL  25  -9.427   4.837  -0.182
  193   2HG2  VAL  25          HG22      VAL  25  -8.387   4.468  -1.559
  194   3HG2  VAL  25          HG23      VAL  25  -9.709   5.622  -1.733
  195    H    VAL  26           HN       VAL  26  -7.160   4.756  -3.164
  196    HA   VAL  26           HA       VAL  26  -4.529   3.969  -2.430
  197    HB   VAL  26           HB       VAL  26  -4.624   2.253  -4.112
  198   1HG1  VAL  26          HG11      VAL  26  -6.634   1.065  -3.422
  199   2HG1  VAL  26          HG12      VAL  26  -7.305   2.566  -2.779
  200   3HG1  VAL  26          HG13      VAL  26  -5.856   1.867  -2.055
  201   1HG2  VAL  26          HG21      VAL  26  -7.132   3.566  -5.130
  202   2HG2  VAL  26          HG22      VAL  26  -6.439   2.045  -5.707
  203   3HG2  VAL  26          HG23      VAL  26  -5.563   3.561  -5.939
  204    H    HIS  27           HN       HIS  27  -5.879   5.953  -4.995
  205    HA   HIS  27           HA       HIS  27  -3.585   6.129  -6.595
  206   1HB   HIS  27          HB2       HIS  27  -5.781   7.018  -7.316
  207   2HB   HIS  27          HB1       HIS  27  -5.622   8.307  -6.116
  208    HD1  HIS  27           HD1      HIS  27  -3.835  10.141  -6.572
  209    HD2  HIS  27           HD2      HIS  27  -4.263   7.344  -9.621
  210    HE1  HIS  27           HE1      HIS  27  -2.456  11.012  -8.481
  211    HE2  HIS  27           HE2      HIS  27  -2.945   9.437 -10.400
  212    H    ALA  28           HN       ALA  28  -4.627   7.985  -3.833
  213    HA   ALA  28           HA       ALA  28  -2.508   9.791  -3.702
  214   1HB   ALA  28          HB1       ALA  28  -3.035   9.973  -1.304
  215   2HB   ALA  28          HB2       ALA  28  -4.074   8.551  -1.433
  216   3HB   ALA  28          HB3       ALA  28  -4.488  10.029  -2.303
  217    H    PHE  29           HN       PHE  29  -2.930   6.546  -2.453
  218    HA   PHE  29           HA       PHE  29  -0.554   6.161  -1.056
  219   1HB   PHE  29          HB2       PHE  29  -2.584   4.654  -1.250
  220   2HB   PHE  29          HB1       PHE  29  -1.931   4.109  -2.779
  221    HD1  PHE  29           HD1      PHE  29   0.638   4.885  -0.479
  222    HD2  PHE  29           HD2      PHE  29  -2.151   1.868  -1.573
  223    HE1  PHE  29           HE1      PHE  29   2.013   3.212   0.661
  224    HE2  PHE  29           HE2      PHE  29  -0.778   0.182  -0.428
  225    HZ   PHE  29           HZ       PHE  29   1.309   0.852   0.690
  226    H    LYS  30           HN       LYS  30  -1.328   5.476  -4.430
  227    HA   LYS  30           HA       LYS  30   1.101   4.495  -5.298
  228   1HB   LYS  30          HB2       LYS  30  -0.986   4.656  -6.678
  229   2HB   LYS  30          HB1       LYS  30  -0.626   6.362  -6.917
  230   1HG   LYS  30          HG2       LYS  30   1.546   5.689  -7.933
  231   2HG   LYS  30          HG1       LYS  30   1.014   4.011  -7.833
  232   1HD   LYS  30          HD2       LYS  30  -0.298   6.234  -9.396
  233   2HD   LYS  30          HD1       LYS  30   0.596   4.867 -10.058
  234   1HE   LYS  30          HE2       LYS  30  -1.108   3.357  -9.024
  235   2HE   LYS  30          HE1       LYS  30  -2.031   4.794  -8.586
  236   1HZ   LYS  30          HZ1       LYS  30  -2.982   4.193 -10.575
  237   2HZ   LYS  30          HZ2       LYS  30  -1.525   3.652 -11.249
  238   3HZ   LYS  30          HZ3       LYS  30  -1.824   5.315 -11.106
  239    H    GLU  31           HN       GLU  31   0.084   7.814  -5.097
  240    HA   GLU  31           HA       GLU  31   2.614   8.873  -5.963
  241   1HB   GLU  31          HB2       GLU  31   0.256  10.245  -4.664
  242   2HB   GLU  31          HB1       GLU  31   1.624  11.070  -5.392
  243   1HG   GLU  31          HG2       GLU  31  -0.238   9.242  -6.880
  244   2HG   GLU  31          HG1       GLU  31  -0.384  10.999  -6.826
  245    H    GLN  32           HN       GLN  32   1.131   8.141  -2.972
  246    HA   GLN  32           HA       GLN  32   2.830   9.471  -1.212
  247   1HB   GLN  32          HB2       GLN  32   1.046   7.100  -0.989
  248   2HB   GLN  32          HB1       GLN  32   2.088   7.520   0.325
  249   1HG   GLN  32          HG2       GLN  32   0.057   9.321  -0.940
  250   2HG   GLN  32          HG1       GLN  32  -0.148   8.451   0.586
  251   1HE2  GLN  32          HE21      GLN  32   2.516   8.728   1.423
  252   2HE2  GLN  32          HE22      GLN  32   2.742  10.361   1.872
  253    H    LEU  33           HN       LEU  33   3.145   6.473  -3.000
  254    HA   LEU  33           HA       LEU  33   5.364   5.342  -1.838
  255   1HB   LEU  33          HB2       LEU  33   4.018   4.795  -4.030
  256   2HB   LEU  33          HB1       LEU  33   5.256   5.775  -4.793
  257    HG   LEU  33           HG       LEU  33   5.701   3.388  -4.901
  258   1HD1  LEU  33          HD11      LEU  33   7.625   4.881  -4.971
  259   2HD1  LEU  33          HD12      LEU  33   8.036   3.410  -4.083
  260   3HD1  LEU  33          HD13      LEU  33   7.687   4.901  -3.208
  261   1HD2  LEU  33          HD21      LEU  33   6.322   2.186  -2.871
  262   2HD2  LEU  33          HD22      LEU  33   4.646   2.737  -2.838
  263   3HD2  LEU  33          HD23      LEU  33   5.881   3.605  -1.924
  264    H    LYS  34           HN       LYS  34   5.269   7.680  -4.438
  265    HA   LYS  34           HA       LYS  34   6.514   9.405  -5.094
  266   1HB   LYS  34          HB2       LYS  34   7.322  10.993  -3.423
  267   2HB   LYS  34          HB1       LYS  34   5.704  10.422  -3.049
  268   1HG   LYS  34          HG2       LYS  34   6.770  10.453  -0.982
  269   2HG   LYS  34          HG1       LYS  34   6.870   8.761  -1.472
  270   1HD   LYS  34          HD2       LYS  34   9.180   9.411  -2.427
  271   2HD   LYS  34          HD1       LYS  34   9.034  10.838  -1.400
  272   1HE   LYS  34          HE2       LYS  34   8.733   9.382   0.560
  273   2HE   LYS  34          HE1       LYS  34   8.898   7.958  -0.475
  274   1HZ   LYS  34          HZ1       LYS  34  10.969   8.426   0.609
  275   2HZ   LYS  34          HZ2       LYS  34  10.983  10.018   0.029
  276   3HZ   LYS  34          HZ3       LYS  34  11.135   8.720  -1.051
  277    H    ILE  35           HN       ILE  35   7.855   6.815  -3.914
  278    HA   ILE  35           HA       ILE  35   9.797   5.772  -4.047
  279    HB   ILE  35           HB       ILE  35  10.901   6.823  -6.377
  280   1HG1  ILE  35          HG12      ILE  35   7.877   6.827  -6.471
  281   2HG1  ILE  35          HG11      ILE  35   8.962   8.184  -6.742
  282   1HG2  ILE  35          HG21      ILE  35   9.962   4.743  -7.347
  283   2HG2  ILE  35          HG22      ILE  35   9.018   4.538  -5.866
  284   3HG2  ILE  35          HG23      ILE  35  10.781   4.492  -5.804
  285   1HD1  ILE  35          HD11      ILE  35   8.096   7.360  -8.844
  286   2HD1  ILE  35          HD12      ILE  35   8.738   5.756  -8.493
  287   3HD1  ILE  35          HD13      ILE  35   9.838   7.109  -8.747
  288    H    ASP  36           HN       ASP  36  12.207   6.463  -5.195
  289    HA   ASP  36           HA       ASP  36  13.286   8.747  -3.841
  290   1HB   ASP  36          HB2       ASP  36  12.940   6.839  -2.095
  291   2HB   ASP  36          HB1       ASP  36  14.301   6.058  -2.893
  292    H    ILE  37           HN       ILE  37  13.687   5.634  -5.202
  293    HA   ILE  37           HA       ILE  37  15.463   6.486  -7.302
  294    HB   ILE  37           HB       ILE  37  16.975   4.558  -6.627
  295   1HG1  ILE  37          HG12      ILE  37  15.359   5.023  -4.183
  296   2HG1  ILE  37          HG11      ILE  37  15.652   3.503  -5.031
  297   1HG2  ILE  37          HG21      ILE  37  17.780   6.848  -6.545
  298   2HG2  ILE  37          HG22      ILE  37  18.374   5.943  -5.154
  299   3HG2  ILE  37          HG23      ILE  37  17.026   7.064  -4.966
  300   1HD1  ILE  37          HD11      ILE  37  17.678   5.051  -3.403
  301   2HD1  ILE  37          HD12      ILE  37  17.983   3.537  -4.255
  302   3HD1  ILE  37          HD13      ILE  37  16.850   3.577  -2.905
  303    H    GLY  38           HN       GLY  38  12.865   4.757  -6.352
  304   1HA   GLY  38          HA2       GLY  38  12.511   2.865  -8.176
  305   2HA   GLY  38          HA1       GLY  38  13.760   2.126  -7.201
  306    H    ASP  39           HN       ASP  39  12.649   3.435  -4.785
  307    HA   ASP  39           HA       ASP  39  10.264   1.809  -4.315
  308   1HB   ASP  39          HB2       ASP  39  12.045   0.387  -3.712
  309   2HB   ASP  39          HB1       ASP  39  12.860   1.682  -2.871
  310    H    VAL  40           HN       VAL  40   9.423   2.068  -2.339
  311    HA   VAL  40           HA       VAL  40   8.200   4.250  -1.549
  312    HB   VAL  40           HB       VAL  40   9.624   2.175   0.056
  313   1HG1  VAL  40          HG11      VAL  40   7.917   4.368   1.190
  314   2HG1  VAL  40          HG12      VAL  40   9.628   4.072   1.505
  315   3HG1  VAL  40          HG13      VAL  40   8.418   2.918   2.062
  316   1HG2  VAL  40          HG21      VAL  40   7.382   1.417   0.532
  317   2HG2  VAL  40          HG22      VAL  40   7.728   1.495  -1.194
  318   3HG2  VAL  40          HG23      VAL  40   6.741   2.744  -0.435
  319    H    THR  41           HN       THR  41  11.230   3.339  -0.332
  320    HA   THR  41           HA       THR  41  12.369   5.920  -0.533
  321    HB   THR  41           HB       THR  41  11.846   4.946   2.269
  322    HG1  THR  41           HG1      THR  41  10.273   6.310   0.847
  323   1HG2  THR  41          HG21      THR  41  13.446   7.328   1.328
  324   2HG2  THR  41          HG22      THR  41  14.095   5.879   2.091
  325   3HG2  THR  41          HG23      THR  41  13.043   6.961   3.002
  326    HA   PRO  42           HA       PRO  42  15.723   3.330   1.167
  327   1HB   PRO  42          HB2       PRO  42  14.904   0.780   2.228
  328   2HB   PRO  42          HB1       PRO  42  15.628   2.144   3.082
  329   1HG   PRO  42          HG2       PRO  42  13.033   1.332   3.411
  330   2HG   PRO  42          HG1       PRO  42  13.601   2.985   3.712
  331   1HD   PRO  42          HD2       PRO  42  12.192   1.871   1.318
  332   2HD   PRO  42          HD1       PRO  42  11.968   3.433   2.130
  333    H    ASP  43           HN       ASP  43  13.604   2.124  -1.073
  334    HA   ASP  43           HA       ASP  43  14.049   1.129  -3.061
  335   1HB   ASP  43          HB2       ASP  43  16.385   2.060  -2.942
  336   2HB   ASP  43          HB1       ASP  43  16.875   0.583  -2.117
  337    H    GLY  44           HN       GLY  44  13.308  -0.019  -0.414
  338   1HA   GLY  44          HA2       GLY  44  12.893  -2.576  -1.482
  339   2HA   GLY  44          HA1       GLY  44  14.155  -2.692  -0.262
  340    H    ARG  45           HN       ARG  45  11.030  -1.080  -0.638
  341    HA   ARG  45           HA       ARG  45  10.193  -2.228   1.926
  342   1HB   ARG  45          HB2       ARG  45   9.905   0.456   0.654
  343   2HB   ARG  45          HB1       ARG  45   8.652  -0.113   1.741
  344   1HG   ARG  45          HG2       ARG  45  11.568   0.109   2.448
  345   2HG   ARG  45          HG1       ARG  45  10.330   1.291   2.878
  346   1HD   ARG  45          HD2       ARG  45   9.439  -0.029   4.498
  347   2HD   ARG  45          HD1       ARG  45   9.813  -1.521   3.637
  348    HE   ARG  45           HE       ARG  45  12.202  -1.016   4.341
  349   1HH1  ARG  45          HH11      ARG  45   9.457   0.074   6.228
  350   2HH1  ARG  45          HH12      ARG  45  10.284  -0.118   7.753
  351   1HH2  ARG  45          HH21      ARG  45  13.294  -1.215   6.346
  352   2HH2  ARG  45          HH22      ARG  45  12.451  -0.828   7.811
  353    H    PHE  46           HN       PHE  46   9.212  -1.148  -1.298
  354    HA   PHE  46           HA       PHE  46   6.727  -2.628  -0.954
  355   1HB   PHE  46          HB2       PHE  46   5.636  -0.838  -1.751
  356   2HB   PHE  46          HB1       PHE  46   7.041   0.008  -1.126
  357    HD1  PHE  46           HD1      PHE  46   8.954   0.423  -2.725
  358    HD2  PHE  46           HD2      PHE  46   4.987  -0.513  -3.973
  359    HE1  PHE  46           HE1      PHE  46   9.389   1.437  -4.943
  360    HE2  PHE  46           HE2      PHE  46   5.430   0.461  -6.186
  361    HZ   PHE  46           HZ       PHE  46   7.639   1.438  -6.673
  362    H    SER  47           HN       SER  47   6.095  -4.011  -2.440
  363    HA   SER  47           HA       SER  47   6.738  -3.643  -5.229
  364   1HB   SER  47          HB2       SER  47   8.562  -5.190  -4.381
  365   2HB   SER  47          HB1       SER  47   7.302  -6.328  -3.907
  366    HG   SER  47           HG       SER  47   7.506  -5.339  -6.554
  367    H    ILE  48           HN       ILE  48   4.702  -3.439  -5.850
  368    HA   ILE  48           HA       ILE  48   2.689  -4.393  -4.002
  369    HB   ILE  48           HB       ILE  48   1.204  -2.837  -5.112
  370   1HG1  ILE  48          HG12      ILE  48   3.500  -2.133  -6.933
  371   2HG1  ILE  48          HG11      ILE  48   2.230  -3.264  -7.395
  372   1HG2  ILE  48          HG21      ILE  48   2.649  -1.939  -3.386
  373   2HG2  ILE  48          HG22      ILE  48   2.418  -0.746  -4.664
  374   3HG2  ILE  48          HG23      ILE  48   3.924  -1.657  -4.572
  375   1HD1  ILE  48          HD11      ILE  48   1.894  -0.386  -6.660
  376   2HD1  ILE  48          HD12      ILE  48   0.578  -1.511  -7.009
  377   3HD1  ILE  48          HD13      ILE  48   1.749  -1.097  -8.268
  378    H    ASP  49           HN       ASP  49   0.957  -5.614  -4.453
  379    HA   ASP  49           HA       ASP  49  -0.058  -5.649  -7.111
  380   1HB   ASP  49          HB2       ASP  49  -0.194  -8.034  -7.481
  381   2HB   ASP  49          HB1       ASP  49   1.489  -7.584  -7.257
  382    H    THR  50           HN       THR  50  -2.135  -5.596  -7.048
  383    HA   THR  50           HA       THR  50  -3.954  -5.679  -5.098
  384    HB   THR  50           HB       THR  50  -4.413  -7.015  -7.761
  385    HG1  THR  50           HG1      THR  50  -4.690  -4.224  -7.285
  386   1HG2  THR  50          HG21      THR  50  -6.651  -6.057  -7.551
  387   2HG2  THR  50          HG22      THR  50  -6.211  -5.338  -6.001
  388   3HG2  THR  50          HG23      THR  50  -6.288  -7.093  -6.169
  389    H    LEU  51           HN       LEU  51  -2.447  -8.637  -6.437
  390    HA   LEU  51           HA       LEU  51  -4.755 -10.169  -6.459
  391   1HB   LEU  51          HB2       LEU  51  -2.745 -10.676  -7.721
  392   2HB   LEU  51          HB1       LEU  51  -1.903 -11.091  -6.243
  393    HG   LEU  51           HG       LEU  51  -3.491 -12.974  -5.910
  394   1HD1  LEU  51          HD11      LEU  51  -4.898 -13.670  -7.790
  395   2HD1  LEU  51          HD12      LEU  51  -4.470 -12.194  -8.651
  396   3HD1  LEU  51          HD13      LEU  51  -5.387 -12.104  -7.147
  397   1HD2  LEU  51          HD21      LEU  51  -1.329 -13.358  -6.952
  398   2HD2  LEU  51          HD22      LEU  51  -1.999 -12.952  -8.531
  399   3HD2  LEU  51          HD23      LEU  51  -2.558 -14.392  -7.681
  400    H    ARG  52           HN       ARG  52  -2.375 -10.029  -3.787
  401    HA   ARG  52           HA       ARG  52  -3.495 -12.173  -2.305
  402   1HB   ARG  52          HB2       ARG  52  -2.427  -9.897  -0.740
  403   2HB   ARG  52          HB1       ARG  52  -2.038 -11.607  -0.650
  404   1HG   ARG  52          HG2       ARG  52  -1.057  -9.762  -2.810
  405   2HG   ARG  52          HG1       ARG  52  -0.158 -10.154  -1.349
  406   1HD   ARG  52          HD2       ARG  52   0.116 -12.395  -1.988
  407   2HD   ARG  52          HD1       ARG  52  -1.143 -12.284  -3.222
  408    HE   ARG  52           HE       ARG  52   0.526 -10.543  -4.216
  409   1HH1  ARG  52          HH11      ARG  52   1.396 -13.581  -2.660
  410   2HH1  ARG  52          HH12      ARG  52   2.833 -13.779  -3.622
  411   1HH2  ARG  52          HH21      ARG  52   2.392 -10.783  -5.405
  412   2HH2  ARG  52          HH22      ARG  52   3.408 -12.181  -5.187
  413    H    CYS  53           HN       CYS  53  -3.801  -8.743  -1.903
  414    HA   CYS  53           HA       CYS  53  -6.051  -8.705  -0.213
  415   1HB   CYS  53          HB2       CYS  53  -4.372  -6.891  -0.348
  416   2HB   CYS  53          HB1       CYS  53  -4.984  -6.487  -1.952
  417    H    VAL  54           HN       VAL  54  -8.064  -7.360  -0.908
  418    HA   VAL  54           HA       VAL  54 -10.065  -7.464  -1.973
  419    HB   VAL  54           HB       VAL  54  -8.589  -8.392  -4.450
  420   1HG1  VAL  54          HG11      VAL  54 -10.480  -7.433  -5.661
  421   2HG1  VAL  54          HG12      VAL  54 -11.241  -6.987  -4.135
  422   3HG1  VAL  54          HG13      VAL  54 -11.017  -8.688  -4.544
  423   1HG2  VAL  54          HG21      VAL  54  -7.591  -6.323  -3.690
  424   2HG2  VAL  54          HG22      VAL  54  -9.183  -5.580  -3.531
  425   3HG2  VAL  54          HG23      VAL  54  -8.572  -6.021  -5.125
  426    H    GLY  55           HN       GLY  55  -8.712  -9.606  -0.616
  427   1HA   GLY  55          HA2       GLY  55 -10.227 -11.888  -1.678
  428   2HA   GLY  55          HA1       GLY  55  -8.762 -12.033  -0.721
  429    H    GLY  56           HN       GLY  56 -11.977 -10.401  -0.383
  430   1HA   GLY  56          HA2       GLY  56 -13.530 -10.638   1.304
  431   2HA   GLY  56          HA1       GLY  56 -12.780 -12.184   1.642
  432    H    CYS  57           HN       CYS  57 -12.156  -8.636   2.282
  433    HA   CYS  57           HA       CYS  57 -10.515  -9.565   4.608
  434   1HB   CYS  57          HB2       CYS  57  -9.817  -7.064   3.248
  435   2HB   CYS  57          HB1       CYS  57  -8.776  -8.269   3.931
  436    H    ALA  58           HN       ALA  58 -12.512  -7.167   3.026
  437    HA   ALA  58           HA       ALA  58 -11.738  -4.823   4.165
  438   1HB   ALA  58          HB1       ALA  58 -14.538  -5.521   3.331
  439   2HB   ALA  58          HB2       ALA  58 -13.231  -5.032   2.251
  440   3HB   ALA  58          HB3       ALA  58 -13.851  -3.903   3.456
  441    H    LEU  59           HN       LEU  59 -13.828  -7.189   5.793
  442    HA   LEU  59           HA       LEU  59 -14.749  -5.267   7.703
  443   1HB   LEU  59          HB2       LEU  59 -15.510  -7.180   9.018
  444   2HB   LEU  59          HB1       LEU  59 -16.012  -7.300   7.346
  445    HG   LEU  59           HG       LEU  59 -13.603  -8.778   8.397
  446   1HD1  LEU  59          HD11      LEU  59 -15.058 -10.734   8.629
  447   2HD1  LEU  59          HD12      LEU  59 -16.462  -9.725   8.279
  448   3HD1  LEU  59          HD13      LEU  59 -15.515  -9.444   9.739
  449   1HD2  LEU  59          HD21      LEU  59 -15.400  -9.199   6.008
  450   2HD2  LEU  59          HD22      LEU  59 -14.066 -10.248   6.482
  451   3HD2  LEU  59          HD23      LEU  59 -13.744  -8.590   5.978
  452    H    ALA  60           HN       ALA  60 -11.677  -6.423   7.214
  453    HA   ALA  60           HA       ALA  60 -10.975  -5.261   9.839
  454   1HB   ALA  60          HB1       ALA  60  -9.297  -6.985   8.001
  455   2HB   ALA  60          HB2       ALA  60  -9.976  -7.474   9.551
  456   3HB   ALA  60          HB3       ALA  60  -8.726  -6.232   9.488
  457    HA   PRO  61           HA       PRO  61  -9.175  -2.088   7.079
  458   1HB   PRO  61          HB2       PRO  61  -7.142  -1.422   9.049
  459   2HB   PRO  61          HB1       PRO  61  -8.514  -0.448   8.517
  460   1HG   PRO  61          HG2       PRO  61  -8.309  -1.522  11.023
  461   2HG   PRO  61          HG1       PRO  61  -9.853  -1.166  10.232
  462   1HD   PRO  61          HD2       PRO  61  -8.441  -3.786  10.543
  463   2HD   PRO  61          HD1       PRO  61 -10.178  -3.419  10.637
  464    H    ILE  62           HN       ILE  62  -7.911  -2.899   5.455
  465    HA   ILE  62           HA       ILE  62  -5.458  -4.287   6.273
  466    HB   ILE  62           HB       ILE  62  -5.535  -5.171   3.828
  467   1HG1  ILE  62          HG12      ILE  62  -8.025  -5.651   3.272
  468   2HG1  ILE  62          HG11      ILE  62  -8.368  -4.257   4.287
  469   1HG2  ILE  62          HG21      ILE  62  -7.374  -6.189   5.986
  470   2HG2  ILE  62          HG22      ILE  62  -5.658  -6.553   5.810
  471   3HG2  ILE  62          HG23      ILE  62  -6.806  -7.120   4.598
  472   1HD1  ILE  62          HD11      ILE  62  -6.718  -4.296   1.774
  473   2HD1  ILE  62          HD12      ILE  62  -6.929  -2.890   2.817
  474   3HD1  ILE  62          HD13      ILE  62  -8.320  -3.590   1.989
  475    H    VAL  63           HN       VAL  63  -3.552  -3.263   5.918
  476    HA   VAL  63           HA       VAL  63  -3.219  -2.318   3.164
  477    HB   VAL  63           HB       VAL  63  -1.746  -0.925   5.400
  478   1HG1  VAL  63          HG11      VAL  63  -2.341  -0.143   2.552
  479   2HG1  VAL  63          HG12      VAL  63  -0.812  -0.778   3.162
  480   3HG1  VAL  63          HG13      VAL  63  -1.394   0.795   3.708
  481   1HG2  VAL  63          HG21      VAL  63  -3.315   0.959   5.199
  482   2HG2  VAL  63          HG22      VAL  63  -4.090  -0.490   5.840
  483   3HG2  VAL  63          HG23      VAL  63  -4.342  -0.025   4.156
  484    H    MET  64           HN       MET  64  -1.574  -3.678   2.280
  485    HA   MET  64           HA       MET  64   0.064  -4.965   4.372
  486   1HB   MET  64          HB2       MET  64  -1.802  -6.326   3.310
  487   2HB   MET  64          HB1       MET  64  -0.879  -6.255   1.818
  488   1HG   MET  64          HG2       MET  64   0.990  -7.331   2.956
  489   2HG   MET  64          HG1       MET  64   0.016  -7.466   4.416
  490   1HE   MET  64          HE1       MET  64  -0.024 -11.201   3.243
  491   2HE   MET  64          HE2       MET  64   0.269 -10.097   4.587
  492   3HE   MET  64          HE3       MET  64   1.337 -10.080   3.185
  493    H    VAL  65           HN       VAL  65   2.250  -4.750   4.088
  494    HA   VAL  65           HA       VAL  65   3.185  -4.998   1.295
  495    HB   VAL  65           HB       VAL  65   5.444  -4.221   2.341
  496   1HG1  VAL  65          HG11      VAL  65   3.241  -2.178   2.070
  497   2HG1  VAL  65          HG12      VAL  65   4.175  -2.855   0.732
  498   3HG1  VAL  65          HG13      VAL  65   4.977  -1.875   1.961
  499   1HG2  VAL  65          HG21      VAL  65   3.468  -3.205   4.352
  500   2HG2  VAL  65          HG22      VAL  65   5.152  -2.677   4.236
  501   3HG2  VAL  65          HG23      VAL  65   4.776  -4.355   4.636
  502    H    GLY  66           HN       GLY  66   3.817  -7.098   0.982
  503   1HA   GLY  66          HA2       GLY  66   4.489  -9.226   1.436
  504   2HA   GLY  66          HA1       GLY  66   5.705  -8.438   2.461
  505    H    GLU  67           HN       GLU  67   5.479 -10.258   3.777
  506    HA   GLU  67           HA       GLU  67   3.114 -10.503   5.404
  507   1HB   GLU  67          HB2       GLU  67   5.877 -11.654   5.837
  508   2HB   GLU  67          HB1       GLU  67   4.445 -12.070   6.767
  509   1HG   GLU  67          HG2       GLU  67   3.404 -12.815   4.594
  510   2HG   GLU  67          HG1       GLU  67   5.009 -12.654   3.881
  511    H    LYS  68           HN       LYS  68   4.169  -7.863   5.265
  512    HA   LYS  68           HA       LYS  68   5.161  -7.448   7.993
  513   1HB   LYS  68          HB2       LYS  68   4.970  -5.425   5.759
  514   2HB   LYS  68          HB1       LYS  68   5.723  -5.176   7.323
  515   1HG   LYS  68          HG2       LYS  68   6.701  -7.023   5.138
  516   2HG   LYS  68          HG1       LYS  68   7.394  -5.474   5.607
  517   1HD   LYS  68          HD2       LYS  68   7.191  -7.869   7.426
  518   2HD   LYS  68          HD1       LYS  68   8.634  -7.410   6.523
  519   1HE   LYS  68          HE2       LYS  68   7.251  -5.807   8.668
  520   2HE   LYS  68          HE1       LYS  68   8.807  -6.621   8.799
  521   1HZ   LYS  68          HZ1       LYS  68   9.592  -5.127   6.978
  522   2HZ   LYS  68          HZ2       LYS  68   9.228  -4.337   8.430
  523   3HZ   LYS  68          HZ3       LYS  68   8.143  -4.263   7.133
  524    H    VAL  69           HN       VAL  69   2.468  -7.101   5.936
  525    HA   VAL  69           HA       VAL  69   0.461  -5.931   6.106
  526    HB   VAL  69           HB       VAL  69  -0.859  -6.885   8.085
  527   1HG1  VAL  69          HG11      VAL  69  -0.946  -7.754   5.810
  528   2HG1  VAL  69          HG12      VAL  69  -1.015  -9.061   6.996
  529   3HG1  VAL  69          HG13      VAL  69   0.483  -8.739   6.126
  530   1HG2  VAL  69          HG21      VAL  69   1.662  -8.521   8.358
  531   2HG2  VAL  69          HG22      VAL  69   0.129  -8.840   9.167
  532   3HG2  VAL  69          HG23      VAL  69   1.037  -7.378   9.548
  533    H    TYR  70           HN       TYR  70   0.368  -3.776   6.383
  534    HA   TYR  70           HA       TYR  70   0.633  -2.745   9.126
  535   1HB   TYR  70          HB2       TYR  70   1.395  -1.430   6.529
  536   2HB   TYR  70          HB1       TYR  70   1.308  -0.583   8.074
  537    HD1  TYR  70           HD1      TYR  70   2.612  -1.829  10.052
  538    HD2  TYR  70           HD2      TYR  70   3.400  -2.243   5.914
  539    HE1  TYR  70           HE1      TYR  70   4.877  -2.620  10.568
  540    HE2  TYR  70           HE2      TYR  70   5.612  -3.032   6.382
  541    HH   TYR  70           HH       TYR  70   6.662  -3.875   9.587
  542    H    GLY  71           HN       GLY  71  -0.130  -0.143   8.447
  543   1HA   GLY  71          HA2       GLY  71  -2.861  -0.317   7.449
  544   2HA   GLY  71          HA1       GLY  71  -2.645   0.180   9.127
  545    H    ASN  72           HN       ASN  72  -0.594   0.853   6.358
  546    HA   ASN  72           HA       ASN  72  -0.273   3.589   6.985
  547   1HB   ASN  72          HB2       ASN  72   1.533   3.215   5.701
  548   2HB   ASN  72          HB1       ASN  72   0.860   1.694   5.147
  549   1HD2  ASN  72          HD21      ASN  72   1.248   5.078   4.450
  550   2HD2  ASN  72          HD22      ASN  72   0.730   4.999   2.800
  551    H    VAL  73           HN       VAL  73  -2.772   1.998   5.656
  552    HA   VAL  73           HA       VAL  73  -4.768   2.514   4.825
  553    HB   VAL  73           HB       VAL  73  -5.607   4.885   5.643
  554   1HG1  VAL  73          HG11      VAL  73  -6.224   3.793   7.763
  555   2HG1  VAL  73          HG12      VAL  73  -5.072   2.502   7.415
  556   3HG1  VAL  73          HG13      VAL  73  -6.472   2.742   6.368
  557   1HG2  VAL  73          HG21      VAL  73  -3.274   4.299   7.474
  558   2HG2  VAL  73          HG22      VAL  73  -4.523   5.524   7.742
  559   3HG2  VAL  73          HG23      VAL  73  -3.410   5.682   6.382
  560    H    THR  74           HN       THR  74  -5.863   5.162   4.243
  561    HA   THR  74           HA       THR  74  -4.589   5.529   1.655
  562    HB   THR  74           HB       THR  74  -6.829   5.178   0.530
  563    HG1  THR  74           HG1      THR  74  -7.993   3.485   2.013
  564   1HG2  THR  74          HG21      THR  74  -5.007   3.555   0.406
  565   2HG2  THR  74          HG22      THR  74  -6.574   2.748   0.483
  566   3HG2  THR  74          HG23      THR  74  -5.552   2.834   1.920
  567    HA   PRO  75           HA       PRO  75  -7.867   8.995   1.897
  568   1HB   PRO  75          HB2       PRO  75  -9.053   9.156   4.532
  569   2HB   PRO  75          HB1       PRO  75  -9.837   8.829   2.985
  570   1HG   PRO  75          HG2       PRO  75  -9.598   6.964   4.953
  571   2HG   PRO  75          HG1       PRO  75  -9.671   6.562   3.228
  572   1HD   PRO  75          HD2       PRO  75  -7.271   6.770   5.020
  573   2HD   PRO  75          HD1       PRO  75  -7.662   5.534   3.802
  574    H    GLY  76           HN       GLY  76  -5.579   9.882   2.072
  575   1HA   GLY  76          HA2       GLY  76  -4.417  11.802   2.658
  576   2HA   GLY  76          HA1       GLY  76  -5.665  12.154   3.841
  577    H    GLN  77           HN       GLN  77  -5.096   9.263   4.777
  578    HA   GLN  77           HA       GLN  77  -3.533  10.191   7.031
  579   1HB   GLN  77          HB2       GLN  77  -4.413   7.350   6.606
  580   2HB   GLN  77          HB1       GLN  77  -4.227   8.225   8.117
  581   1HG   GLN  77          HG2       GLN  77  -6.216   9.540   7.593
  582   2HG   GLN  77          HG1       GLN  77  -6.409   8.639   6.088
  583   1HE2  GLN  77          HE21      GLN  77  -6.891   6.394   6.205
  584   2HE2  GLN  77          HE22      GLN  77  -7.659   5.741   7.615
  585    H    VAL  78           HN       VAL  78  -3.224   8.716   4.140
  586    HA   VAL  78           HA       VAL  78  -1.372   6.758   4.225
  587    HB   VAL  78           HB       VAL  78  -0.729   7.899   1.953
  588   1HG1  VAL  78          HG11      VAL  78  -3.437   6.750   2.483
  589   2HG1  VAL  78          HG12      VAL  78  -1.975   5.842   2.098
  590   3HG1  VAL  78          HG13      VAL  78  -2.704   6.906   0.886
  591   1HG2  VAL  78          HG21      VAL  78  -2.254   9.431   1.062
  592   2HG2  VAL  78          HG22      VAL  78  -1.825  10.030   2.680
  593   3HG2  VAL  78          HG23      VAL  78  -3.357   9.199   2.423
  594    H    LYS  79           HN       LYS  79  -0.853  10.304   4.092
  595    HA   LYS  79           HA       LYS  79   1.812  10.223   3.280
  596   1HB   LYS  79          HB2       LYS  79   0.571  12.308   5.092
  597   2HB   LYS  79          HB1       LYS  79   1.924  12.529   3.994
  598   1HG   LYS  79          HG2       LYS  79   0.446  12.219   2.087
  599   2HG   LYS  79          HG1       LYS  79  -0.917  11.959   3.178
  600   1HD   LYS  79          HD2       LYS  79   0.734  14.480   3.113
  601   2HD   LYS  79          HD1       LYS  79  -0.766  14.265   2.211
  602   1HE   LYS  79          HE2       LYS  79  -1.961  13.861   4.319
  603   2HE   LYS  79          HE1       LYS  79  -0.457  14.102   5.209
  604   1HZ   LYS  79          HZ1       LYS  79  -1.672  16.162   3.445
  605   2HZ   LYS  79          HZ2       LYS  79  -0.376  16.364   4.521
  606   3HZ   LYS  79          HZ3       LYS  79  -1.939  16.083   5.118
  607    H    LYS  80           HN       LYS  80   0.327  10.383   6.404
  608    HA   LYS  80           HA       LYS  80   2.925  10.505   7.719
  609   1HB   LYS  80          HB2       LYS  80   0.777  10.635   9.567
  610   2HB   LYS  80          HB1       LYS  80   1.816  11.942   9.023
  611   1HG   LYS  80          HG2       LYS  80  -0.171  12.827   8.423
  612   2HG   LYS  80          HG1       LYS  80   0.149  11.925   6.948
  613   1HD   LYS  80          HD2       LYS  80  -2.033  11.340   7.397
  614   2HD   LYS  80          HD1       LYS  80  -1.141  10.030   8.180
  615   1HE   LYS  80          HE2       LYS  80  -1.381  11.014  10.337
  616   2HE   LYS  80          HE1       LYS  80  -2.003  12.514   9.655
  617   1HZ   LYS  80          HZ1       LYS  80  -3.390   9.884   9.593
  618   2HZ   LYS  80          HZ2       LYS  80  -3.989  11.337   8.955
  619   3HZ   LYS  80          HZ3       LYS  80  -3.755  11.174  10.626
  620    H    ILE  81           HN       ILE  81   0.133   8.518   7.393
  621    HA   ILE  81           HA       ILE  81   1.051   6.650   9.363
  622    HB   ILE  81           HB       ILE  81  -0.994   6.216   7.179
  623   1HG1  ILE  81          HG12      ILE  81  -1.633   8.066   8.670
  624   2HG1  ILE  81          HG11      ILE  81  -2.654   6.662   8.962
  625   1HG2  ILE  81          HG21      ILE  81  -1.761   4.388   8.645
  626   2HG2  ILE  81          HG22      ILE  81  -0.441   4.738   9.761
  627   3HG2  ILE  81          HG23      ILE  81  -0.089   4.144   8.138
  628   1HD1  ILE  81          HD11      ILE  81  -1.308   6.113  10.933
  629   2HD1  ILE  81          HD12      ILE  81  -2.032   7.718  11.043
  630   3HD1  ILE  81          HD13      ILE  81  -0.323   7.546  10.644
  631    H    LEU  82           HN       LEU  82   1.895   7.427   6.161
  632    HA   LEU  82           HA       LEU  82   2.974   5.030   5.193
  633   1HB   LEU  82          HB2       LEU  82   2.854   7.168   3.929
  634   2HB   LEU  82          HB1       LEU  82   4.147   7.810   4.926
  635    HG   LEU  82           HG       LEU  82   5.643   6.023   4.066
  636   1HD1  LEU  82          HD11      LEU  82   3.321   5.445   2.231
  637   2HD1  LEU  82          HD12      LEU  82   3.971   4.368   3.470
  638   3HD1  LEU  82          HD13      LEU  82   4.948   4.785   2.060
  639   1HD2  LEU  82          HD21      LEU  82   5.667   8.247   3.082
  640   2HD2  LEU  82          HD22      LEU  82   4.363   7.791   1.986
  641   3HD2  LEU  82          HD23      LEU  82   5.942   7.020   1.847
  642    H    ALA  83           HN       ALA  83   4.008   7.069   7.839
  643    HA   ALA  83           HA       ALA  83   6.529   6.082   8.387
  644   1HB   ALA  83          HB1       ALA  83   5.334   7.693   9.808
  645   2HB   ALA  83          HB2       ALA  83   6.031   6.375  10.747
  646   3HB   ALA  83          HB3       ALA  83   4.302   6.388  10.400
  647    H    GLU  84           HN       GLU  84   3.558   4.289   8.294
  648    HA   GLU  84           HA       GLU  84   4.254   1.984   9.736
  649   1HB   GLU  84          HB2       GLU  84   2.396   2.619   7.474
  650   2HB   GLU  84          HB1       GLU  84   2.608   0.967   8.006
  651   1HG   GLU  84          HG2       GLU  84   1.831   3.161   9.893
  652   2HG   GLU  84          HG1       GLU  84   0.638   2.267   8.947
  653    H    TYR  85           HN       TYR  85   4.715   2.976   6.388
  654    HA   TYR  85           HA       TYR  85   5.844   0.449   5.675
  655   1HB   TYR  85          HB2       TYR  85   4.876   2.872   4.240
  656   2HB   TYR  85          HB1       TYR  85   5.835   1.663   3.409
  657    HD1  TYR  85           HD1      TYR  85   4.273  -0.113   5.739
  658    HD2  TYR  85           HD2      TYR  85   3.463   1.995   2.256
  659    HE1  TYR  85           HE1      TYR  85   2.498  -1.673   5.291
  660    HE2  TYR  85           HE2      TYR  85   1.633   0.486   1.812
  661    HH   TYR  85           HH       TYR  85   0.908  -1.783   2.302