*HEADER    SIGNALING PROTEIN                       12-MAR-18   6COR              
*TITLE     CSP1-F11A                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COMPETENCE-STIMULATING PEPTIDE TYPE 1;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 25-41;                                        
*COMPND   5 SYNONYM: CSP-1;                                                      
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE;                       
*SOURCE   4 ORGANISM_TAXID: 1313                                                 
*KEYWDS    PNEUMOCOCCUS, QUORUM SENSING, SIGNALING MOLECULE, CSP, SIGNALING      
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.YANG                                                                
*REVDAT   1   29-AUG-18 6COR    0                                                
# Restraints file 1: CSP1F11A_NOErestraint.tbl
assign (resid   2 and name HA  ) (resid   2 and (name HB1 or name HB2  )) 2.8  1.0  1.0
assign (resid   2 and name HA  ) (resid   2 and (name HB2 or name HB1  )) 3.7  1.3  1.3
assign (resid   2 and name HA  ) (resid   2 and (name HG1 or name HG2  )) 3.5  1.2  1.2
assign (resid   2 and name HA  ) (resid   2 and (name HG2 or name HG1  )) 3.3  1.2  1.2
assign (resid   2 and (name HB1 or name HB2  )) (resid   2 and (name HG1 or name HG2  )) 2.8  1.0  1.0
assign (resid   2 and (name HB1 or name HB2  )) (resid   2 and (name HG2 or name HG1  )) 2.8  1.0  1.0
assign (resid   2 and (name HB2 or name HB1  )) (resid   2 and (name HG1 or name HG2  )) 3.5  1.2  1.2
assign (resid   2 and (name HB2 or name HB1  )) (resid   2 and (name HG2 or name HG1  )) 3.1  1.1  1.1
assign (resid   2 and name HA  ) (resid   3 and (name HB1 or name HB2  )) 3.4  1.2  1.2
assign (resid   2 and name HA  ) (resid   3 and (name HB2 or name HB1  )) 3.6  1.3  1.3
assign (resid   2 and name HA  ) (resid   3 and name HG#  )  3.8  1.3  1.3
assign (resid   2 and name HA  ) (resid   3 and name HN  )  3.1  1.1  1.1
assign (resid   2 and (name HB1 or name HB2  )) (resid   3 and name HA  )  3.6  1.3  1.3
assign (resid   2 and (name HB1 or name HB2  )) (resid   3 and name HG#  )  3.4  1.2  1.2
assign (resid   2 and (name HB1 or name HB2  )) (resid   3 and name HN  )  3.3  1.2  1.2
assign (resid   2 and (name HB2 or name HB1  )) (resid   3 and name HN  )  4.3  1.5  1.5
assign (resid   2 and name HA  ) (resid   4 and name HN  )  4.0  1.4  1.4
assign (resid   2 and (name HB1 or name HB2  )) (resid   4 and (name HD1# or name HD2#  )) 3.6  1.3  1.3
assign (resid   2 and (name HB1 or name HB2  )) (resid   4 and (name HD2# or name HD1#  )) 3.5  1.2  1.2
assign (resid   2 and (name HB1 or name HB2  )) (resid   4 and name HG  )  3.5  1.2  1.2
assign (resid   2 and (name HB1 or name HB2  )) (resid   4 and name HN  )  3.6  1.3  1.3
assign (resid   2 and (name HB2 or name HB1  )) (resid   4 and (name HD1# or name HD2#  )) 3.4  1.2  1.2
assign (resid   2 and (name HB2 or name HB1  )) (resid   4 and (name HD2# or name HD1#  )) 3.5  1.2  1.2
assign (resid   2 and (name HB2 or name HB1  )) (resid   4 and name HN  )  3.9  1.4  1.4
assign (resid   2 and (name HB1 or name HB2  )) (resid   5 and name HA  )  3.3  1.2  1.2
assign (resid   2 and (name HB1 or name HB2  )) (resid   5 and (name HB1 or name HB2  )) 3.2  1.1  1.1
assign (resid   2 and (name HB1 or name HB2  )) (resid   5 and (name HB2 or name HB1  )) 3.2  1.1  1.1
assign (resid   2 and (name HB1 or name HB2  )) (resid   5 and name HN  )  3.5  1.2  1.2
assign (resid   2 and (name HB2 or name HB1  )) (resid   5 and name HA  )  3.7  1.3  1.3
assign (resid   2 and (name HB2 or name HB1  )) (resid   5 and (name HB1 or name HB2  )) 3.2  1.1  1.1
assign (resid   2 and (name HB2 or name HB1  )) (resid   5 and (name HB2 or name HB1  )) 4.1  1.4  1.4
assign (resid   2 and (name HB2 or name HB1  )) (resid   5 and name HN  )  4.2  1.5  1.5
assign (resid   2 and (name HB2 or name HB1  )) (resid   6 and name HA  )  3.3  1.2  2.0
assign (resid   3 and name HA  ) (resid   3 and (name HB1 or name HB2  )) 2.6  0.9  0.9
assign (resid   3 and name HA  ) (resid   3 and (name HB2 or name HB1  )) 2.9  1.0  1.0
assign (resid   3 and name HA  ) (resid   3 and (name HD1 or name HD2  )) 3.3  1.2  1.2
assign (resid   3 and name HA  ) (resid   3 and (name HD2 or name HD1  )) 3.4  1.2  1.2
assign (resid   3 and name HA  ) (resid   3 and name HG#  )  2.8  1.0  1.0
assign (resid   3 and name HA  ) (resid   3 and name HN  )  3.3  1.2  1.2
assign (resid   3 and (name HB1 or name HB2  )) (resid   3 and (name HD1 or name HD2  )) 3.1  1.1  1.1
assign (resid   3 and (name HB1 or name HB2  )) (resid   3 and (name HD2 or name HD1  )) 2.5  0.9  0.9
assign (resid   3 and (name HB1 or name HB2  )) (resid   3 and name HN  )  3.0  1.0  1.0
assign (resid   3 and (name HB2 or name HB1  )) (resid   3 and (name HD1 or name HD2  )) 2.9  1.0  1.0
assign (resid   3 and (name HB2 or name HB1  )) (resid   3 and (name HD2 or name HD1  )) 2.7  0.9  0.9
assign (resid   3 and (name HB2 or name HB1  )) (resid   3 and name HN  )  3.5  1.2  1.2
assign (resid   3 and (name HD1 or name HD2  )) (resid   3 and name HG#  )  2.8  1.0  1.0
assign (resid   3 and (name HD2 or name HD1  )) (resid   3 and name HG#  )  2.8  1.0  1.0
assign (resid   3 and name HG#  ) (resid   3 and name HN  )  3.5  1.2  1.2
assign (resid   3 and name HA  ) (resid   4 and (name HB1 or name HB2  )) 3.2  1.1  1.9
assign (resid   3 and name HA  ) (resid   4 and (name HD1# or name HD2#  )) 4.0  1.4  1.4
assign (resid   3 and name HA  ) (resid   4 and (name HD2# or name HD1#  )) 4.2  1.5  1.5
assign (resid   3 and name HA  ) (resid   4 and name HG  )  3.5  1.2  1.2
assign (resid   3 and name HA  ) (resid   4 and name HN  )  2.9  1.0  1.0
assign (resid   3 and (name HB1 or name HB2  )) (resid   4 and name HN  )  3.0  1.0  1.0
assign (resid   3 and (name HB2 or name HB1  )) (resid   4 and name HN  )  3.5  1.2  1.2
assign (resid   3 and (name HD1 or name HD2  )) (resid   4 and (name HD2# or name HD1#  )) 2.7  0.9  1.5
assign (resid   3 and name HG#  ) (resid   4 and (name HD1# or name HD2#  )) 2.8  1.0  1.0
assign (resid   3 and name HG#  ) (resid   4 and (name HD2# or name HD1#  )) 2.8  1.0  1.0
assign (resid   3 and name HN  ) (resid   4 and (name HB1 or name HB2  )) 3.7  1.3  1.3
assign (resid   3 and name HN  ) (resid   4 and name HN  )  3.7  1.3  1.3
assign (resid   3 and name HA  ) (resid   5 and name HN  )  3.5  1.2  1.2
assign (resid   3 and name HA  ) (resid   6 and name HA  )  3.6  1.3  1.3
assign (resid   3 and name HA  ) (resid   6 and name HN  )  3.8  1.3  1.3
assign (resid   3 and (name HD2 or name HD1  )) (resid   6 and name HA  )  3.4  1.2  1.7
assign (resid   3 and name HA  ) (resid   7 and name HN  )  3.9  1.4  1.4
assign (resid   3 and name HA  ) (resid   9 and (name HD2 or name HD1  )) 3.3  1.2  2.1
assign (resid   4 and name HA  ) (resid   4 and (name HB1 or name HB2  )) 2.5  0.9  0.9
assign (resid   4 and name HA  ) (resid   4 and (name HB2 or name HB1  )) 2.6  0.9  0.9
assign (resid   4 and name HA  ) (resid   4 and (name HD1# or name HD2#  )) 2.9  1.0  1.0
assign (resid   4 and name HA  ) (resid   4 and (name HD2# or name HD1#  )) 2.6  0.9  0.9
assign (resid   4 and name HA  ) (resid   4 and name HG  )  2.9  1.0  1.0
assign (resid   4 and name HA  ) (resid   4 and name HN  )  3.0  1.1  1.1
assign (resid   4 and (name HB1 or name HB2  )) (resid   4 and (name HD1# or name HD2#  )) 2.8  1.0  1.0
assign (resid   4 and (name HB1 or name HB2  )) (resid   4 and (name HD2# or name HD1#  )) 3.0  1.0  1.0
assign (resid   4 and (name HB1 or name HB2  )) (resid   4 and name HN  )  2.9  1.0  1.0
assign (resid   4 and (name HB2 or name HB1  )) (resid   4 and (name HD1# or name HD2#  )) 2.7  0.9  0.9
assign (resid   4 and (name HB2 or name HB1  )) (resid   4 and (name HD2# or name HD1#  )) 2.7  0.9  0.9
assign (resid   4 and (name HB2 or name HB1  )) (resid   4 and name HN  )  3.0  1.0  1.0
assign (resid   4 and (name HD1# or name HD2#  )) (resid   4 and name HG  )  2.6  0.9  0.9
assign (resid   4 and (name HD1# or name HD2#  )) (resid   4 and name HN  )  3.3  1.2  1.2
assign (resid   4 and (name HD2# or name HD1#  )) (resid   4 and name HG  )  2.6  0.9  0.9
assign (resid   4 and (name HD2# or name HD1#  )) (resid   4 and name HN  )  3.4  1.2  1.2
assign (resid   4 and name HG  ) (resid   4 and name HN  )  3.0  1.0  1.0
assign (resid   4 and name HA  ) (resid   5 and name HN  )  3.1  1.1  1.1
assign (resid   4 and (name HB1 or name HB2  )) (resid   5 and name HN  )  3.0  1.1  1.1
assign (resid   4 and (name HB2 or name HB1  )) (resid   5 and name HA  )  4.1  1.4  1.4
assign (resid   4 and (name HB2 or name HB1  )) (resid   5 and name HN  )  3.0  1.1  1.1
assign (resid   4 and (name HD1# or name HD2#  )) (resid   5 and name HA  )  3.7  1.3  1.3
assign (resid   4 and (name HD1# or name HD2#  )) (resid   5 and (name HB1 or name HB2  )) 3.9  1.4  1.4
assign (resid   4 and (name HD1# or name HD2#  )) (resid   5 and name HN  )  3.6  1.3  1.3
assign (resid   4 and (name HD2# or name HD1#  )) (resid   5 and (name HB1 or name HB2  )) 3.8  1.3  1.3
assign (resid   4 and (name HD2# or name HD1#  )) (resid   5 and (name HB2 or name HB1  )) 4.3  1.5  1.5
assign (resid   4 and (name HD2# or name HD1#  )) (resid   5 and name HN  )  3.6  1.3  1.3
assign (resid   4 and name HG  ) (resid   5 and name HN  )  3.5  1.2  1.2
assign (resid   4 and name HN  ) (resid   5 and name HA  )  3.8  1.3  1.3
assign (resid   4 and name HN  ) (resid   5 and (name HB1 or name HB2  )) 3.9  1.4  1.4
assign (resid   4 and name HN  ) (resid   5 and (name HB2 or name HB1  )) 3.8  1.3  1.3
assign (resid   4 and name HN  ) (resid   5 and name HN  )  3.2  1.1  1.1
assign (resid   4 and name HN  ) (resid   6 and name HN  )  3.8  1.3  1.3
assign (resid   4 and name HA  ) (resid   7 and (name HB1 or name HB2  )) 3.0  1.1  1.1
assign (resid   4 and name HA  ) (resid   7 and (name HB2 or name HB1  )) 3.0  1.0  1.0
assign (resid   4 and name HA  ) (resid   7 and name HD#  )  3.3  1.2  1.2
assign (resid   4 and name HA  ) (resid   7 and name HE#  )  4.1  1.4  1.4
assign (resid   4 and name HA  ) (resid   7 and name HN  )  3.1  1.1  1.1
assign (resid   4 and (name HB1 or name HB2  )) (resid   7 and name HD#  )  3.0  1.0  1.4
assign (resid   4 and (name HB2 or name HB1  )) (resid   7 and name HD#  )  3.9  1.4  1.4
assign (resid   4 and (name HD1# or name HD2#  )) (resid   7 and (name HB1 or name HB2  )) 3.9  1.4  1.4
assign (resid   4 and (name HD1# or name HD2#  )) (resid   7 and (name HB2 or name HB1  )) 3.6  1.3  1.3
assign (resid   4 and (name HD1# or name HD2#  )) (resid   7 and name HD#  )  3.6  1.3  1.3
assign (resid   4 and (name HD1# or name HD2#  )) (resid   7 and name HN  )  4.0  1.4  1.4
assign (resid   4 and (name HD2# or name HD1#  )) (resid   7 and name HA  )  4.5  1.6  1.8
assign (resid   4 and (name HD2# or name HD1#  )) (resid   7 and (name HB1 or name HB2  )) 3.2  1.1  1.1
assign (resid   4 and (name HD2# or name HD1#  )) (resid   7 and (name HB2 or name HB1  )) 3.4  1.2  1.2
assign (resid   4 and (name HD2# or name HD1#  )) (resid   7 and name HD#  )  3.5  1.2  1.2
assign (resid   4 and (name HD2# or name HD1#  )) (resid   7 and name HN  )  3.7  1.3  1.3
assign (resid   4 and name HA  ) (resid   8 and name HB#  )  3.8  1.3  1.4
assign (resid   4 and name HA  ) (resid   8 and name HE#  )  3.9  1.4  1.4
assign (resid   4 and name HA  ) (resid   8 and name HN  )  3.3  1.2  1.2
assign (resid   4 and name HA  ) (resid   8 and name HZ  )  4.0  1.4  2.3
assign (resid   4 and (name HB1 or name HB2  )) (resid   8 and name HE#  )  3.7  1.3  1.3
assign (resid   4 and (name HB1 or name HB2  )) (resid   8 and name HZ  )  3.8  1.3  1.3
assign (resid   4 and (name HB2 or name HB1  )) (resid   8 and name HE#  )  3.5  1.2  1.2
assign (resid   4 and (name HB2 or name HB1  )) (resid   8 and name HZ  )  3.7  1.3  1.3
assign (resid   4 and (name HD1# or name HD2#  )) (resid   8 and name HB#  )  3.7  1.3  1.6
assign (resid   4 and (name HD1# or name HD2#  )) (resid   8 and name HD#  )  3.7  1.3  1.3
assign (resid   4 and (name HD1# or name HD2#  )) (resid   8 and name HE#  )  3.6  1.3  1.3
assign (resid   4 and (name HD1# or name HD2#  )) (resid   8 and name HN  )  4.2  1.5  1.5
assign (resid   4 and (name HD1# or name HD2#  )) (resid   8 and name HZ  )  3.4  1.2  1.2
assign (resid   4 and (name HD2# or name HD1#  )) (resid   8 and name HB#  )  3.6  1.3  1.8
assign (resid   4 and (name HD2# or name HD1#  )) (resid   8 and name HD#  )  3.5  1.2  1.2
assign (resid   4 and (name HD2# or name HD1#  )) (resid   8 and name HE#  )  3.5  1.2  1.2
assign (resid   4 and (name HD2# or name HD1#  )) (resid   8 and name HN  )  3.8  1.3  1.3
assign (resid   4 and (name HD2# or name HD1#  )) (resid   8 and name HZ  )  3.4  1.2  1.2
assign (resid   4 and name HG  ) (resid   8 and name HE#  )  3.6  1.3  1.3
assign (resid   4 and name HG  ) (resid   8 and name HZ  )  3.9  1.4  1.4
assign (resid   5 and name HA  ) (resid   5 and (name HB1 or name HB2  )) 2.7  0.9  0.9
assign (resid   5 and name HA  ) (resid   5 and (name HB2 or name HB1  )) 2.7  0.9  0.9
assign (resid   5 and name HA  ) (resid   5 and name HN  )  2.9  1.0  1.0
assign (resid   5 and (name HB1 or name HB2  )) (resid   5 and name HN  )  3.0  1.0  1.0
assign (resid   5 and (name HB2 or name HB1  )) (resid   5 and name HN  )  2.9  1.0  1.0
assign (resid   5 and name HA  ) (resid   6 and name HN  )  3.1  1.1  1.1
assign (resid   5 and name HN  ) (resid   6 and (name HB1 or name HB2  )) 2.9  1.0  1.0
assign (resid   5 and name HN  ) (resid   6 and name HN  )  3.1  1.1  1.1
assign (resid   5 and name HA  ) (resid   7 and name HN  )  3.1  1.1  1.1
assign (resid   5 and name HN  ) (resid   7 and name HN  )  3.9  1.4  1.4
assign (resid   5 and (name HB1 or name HB2  )) (resid   8 and name HB#  )  3.7  1.3  1.3
assign (resid   5 and (name HB1 or name HB2  )) (resid   8 and name HE#  )  3.9  1.4  1.4
assign (resid   5 and (name HB2 or name HB1  )) (resid   8 and name HB#  )  3.1  1.1  1.7
assign (resid   5 and (name HB2 or name HB1  )) (resid   8 and name HE#  )  4.6  1.6  1.6
assign (resid   5 and name HN  ) (resid   8 and name HB#  )  4.0  1.4  1.7
assign (resid   5 and name HA  ) (resid   9 and (name HB1 or name HB2  )) 3.3  1.2  1.2
assign (resid   6 and name HA  ) (resid   6 and (name HB1 or name HB2  )) 2.7  0.9  0.9
assign (resid   6 and name HA  ) (resid   6 and (name HB2 or name HB1  )) 2.6  0.9  0.9
assign (resid   6 and name HA  ) (resid   6 and name HD#  )  3.0  1.0  1.0
assign (resid   6 and name HA  ) (resid   6 and (name HE2 or name HE1  )) 4.0  1.4  1.4
assign (resid   6 and name HA  ) (resid   6 and name HG#  )  2.7  0.9  0.9
assign (resid   6 and name HA  ) (resid   6 and name HN  )  2.8  1.0  1.0
assign (resid   6 and (name HB1 or name HB2  )) (resid   6 and name HG#  )  2.6  0.9  0.9
assign (resid   6 and (name HB1 or name HB2  )) (resid   6 and name HN  )  2.8  1.0  1.0
assign (resid   6 and (name HB2 or name HB1  )) (resid   6 and name HG#  )  2.8  1.0  1.0
assign (resid   6 and (name HB2 or name HB1  )) (resid   6 and name HN  )  2.9  1.0  1.0
assign (resid   6 and name HD#  ) (resid   6 and name HN  )  2.6  0.9  0.9
assign (resid   6 and name HG#  ) (resid   6 and name HN  )  3.0  1.1  1.1
assign (resid   6 and name HA  ) (resid   7 and name HA  )  3.6  1.3  1.3
assign (resid   6 and name HA  ) (resid   7 and name HN  )  3.1  1.1  1.1
assign (resid   6 and (name HB1 or name HB2  )) (resid   7 and name HN  )  2.9  1.0  1.0
assign (resid   6 and (name HB2 or name HB1  )) (resid   7 and name HN  )  3.1  1.1  1.1
assign (resid   6 and name HD#  ) (resid   7 and name HN  )  2.5  0.9  0.9
assign (resid   6 and name HG#  ) (resid   7 and name HA  )  3.4  1.2  1.2
assign (resid   6 and name HG#  ) (resid   7 and name HN  )  3.2  1.1  1.1
assign (resid   6 and name HN  ) (resid   7 and name HA  )  3.8  1.3  1.3
assign (resid   6 and name HN  ) (resid   7 and (name HB1 or name HB2  )) 3.9  1.4  1.4
assign (resid   6 and name HN  ) (resid   7 and (name HB2 or name HB1  )) 3.6  1.3  1.3
assign (resid   6 and name HN  ) (resid   7 and name HN  )  3.0  1.1  1.1
assign (resid   6 and name HA  ) (resid   8 and name HB#  )  3.1  1.1  3.1
assign (resid   6 and name HA  ) (resid   8 and name HE#  )  3.6  1.3  2.6
assign (resid   6 and name HA  ) (resid   8 and name HN  )  3.5  1.2  1.2
assign (resid   6 and name HA  ) (resid   9 and (name HB1 or name HB2  )) 2.8  1.0  1.0
assign (resid   6 and name HA  ) (resid   9 and (name HD1 or name HD2  )) 3.5  1.2  1.2
assign (resid   6 and name HA  ) (resid   9 and (name HD2 or name HD1  )) 3.5  1.2  1.2
assign (resid   6 and name HA  ) (resid   9 and name HG#  )  3.0  1.0  1.0
assign (resid   6 and name HA  ) (resid   9 and name HN  )  3.2  1.1  1.1
assign (resid   6 and name HG#  ) (resid   9 and (name HB1 or name HB2  )) 3.3  1.2  1.2
assign (resid   6 and name HA  ) (resid  10 and name HN  )  3.4  1.2  1.2
assign (resid   7 and name HA  ) (resid   7 and (name HB1 or name HB2  )) 2.8  1.0  1.0
assign (resid   7 and name HA  ) (resid   7 and (name HB2 or name HB1  )) 2.8  1.0  1.0
assign (resid   7 and name HA  ) (resid   7 and name HD#  )  2.8  1.0  1.0
assign (resid   7 and name HA  ) (resid   7 and name HE#  )  3.5  1.2  1.2
assign (resid   7 and name HA  ) (resid   7 and name HN  )  2.9  1.0  1.0
assign (resid   7 and (name HB1 or name HB2  )) (resid   7 and name HD#  )  2.8  1.0  1.0
assign (resid   7 and (name HB1 or name HB2  )) (resid   7 and name HE#  )  3.8  1.3  1.3
assign (resid   7 and (name HB1 or name HB2  )) (resid   7 and name HN  )  2.9  1.0  1.0
assign (resid   7 and (name HB2 or name HB1  )) (resid   7 and name HD#  )  2.8  1.0  1.0
assign (resid   7 and (name HB2 or name HB1  )) (resid   7 and name HE#  )  3.6  1.3  1.3
assign (resid   7 and (name HB2 or name HB1  )) (resid   7 and name HN  )  2.9  1.0  1.0
assign (resid   7 and name HD#  ) (resid   7 and name HN  )  3.2  1.1  1.1
assign (resid   7 and name HE#  ) (resid   7 and name HN  )  4.5  1.6  1.6
assign (resid   7 and name HA  ) (resid   8 and name HB#  )  3.5  1.2  1.5
assign (resid   7 and name HA  ) (resid   8 and name HE#  )  4.2  1.5  2.5
assign (resid   7 and (name HB1 or name HB2  )) (resid   8 and name HA  )  3.5  1.2  1.2
assign (resid   7 and (name HB1 or name HB2  )) (resid   8 and name HE#  )  3.8  1.3  1.3
assign (resid   7 and (name HB1 or name HB2  )) (resid   8 and name HN  )  3.0  1.0  1.0
assign (resid   7 and (name HB2 or name HB1  )) (resid   8 and name HA  )  2.8  1.0  1.1
assign (resid   7 and (name HB2 or name HB1  )) (resid   8 and name HE#  )  3.7  1.3  1.3
assign (resid   7 and (name HB2 or name HB1  )) (resid   8 and name HN  )  3.0  1.0  1.0
assign (resid   7 and name HD#  ) (resid   8 and name HA  )  3.2  1.1  1.1
assign (resid   7 and name HD#  ) (resid   8 and name HB#  )  3.3  1.2  1.7
assign (resid   7 and name HD#  ) (resid   8 and name HN  )  3.3  1.2  1.2
assign (resid   7 and name HE#  ) (resid   8 and name HA  )  3.7  1.3  2.1
assign (resid   7 and name HE#  ) (resid   8 and name HN  )  3.1  1.1  2.5
assign (resid   7 and name HN  ) (resid   8 and name HB#  )  3.1  1.1  1.7
assign (resid   7 and name HN  ) (resid   8 and name HE#  )  4.2  1.5  1.5
assign (resid   7 and name HN  ) (resid   8 and name HN  )  3.0  1.1  1.1
assign (resid   7 and name HA  ) (resid   9 and name HN  )  4.0  1.4  1.4
assign (resid   7 and (name HB2 or name HB1  )) (resid   9 and name HN  )  3.8  1.3  1.3
assign (resid   7 and name HN  ) (resid   9 and name HN  )  3.8  1.3  1.3
assign (resid   7 and name HA  ) (resid  10 and (name HB1 or name HB2  )) 3.0  1.0  1.0
assign (resid   7 and name HA  ) (resid  10 and (name HB2 or name HB1  )) 3.1  1.1  1.1
assign (resid   7 and name HA  ) (resid  10 and name HN  )  3.5  1.2  1.2
assign (resid   7 and name HN  ) (resid  10 and name HN  )  3.8  1.3  1.3
assign (resid   7 and name HA  ) (resid  11 and name HB#  )  3.6  1.3  1.3
assign (resid   7 and name HD#  ) (resid  11 and name HB#  )  3.6  1.3  1.3
assign (resid   7 and name HE#  ) (resid  11 and name HB#  )  3.3  1.2  1.4
assign (resid   8 and name HA  ) (resid   8 and name HB#  )  2.5  0.9  0.9
assign (resid   8 and name HA  ) (resid   8 and name HE#  )  2.8  1.0  2.2
assign (resid   8 and name HA  ) (resid   8 and name HN  )  2.8  1.0  1.0
assign (resid   8 and name HA  ) (resid   8 and name HZ  )  3.4  1.2  3.2
assign (resid   8 and name HB#  ) (resid   8 and name HE#  )  2.8  1.0  1.0
assign (resid   8 and name HB#  ) (resid   8 and name HN  )  2.7  0.9  0.9
assign (resid   8 and name HB#  ) (resid   8 and name HZ  )  3.5  1.2  1.2
assign (resid   8 and name HE#  ) (resid   8 and name HN  )  3.2  1.1  1.1
assign (resid   8 and name HN  ) (resid   8 and name HZ  )  3.4  1.2  1.5
assign (resid   8 and name HA  ) (resid   9 and (name HB1 or name HB2  )) 3.4  1.2  1.2
assign (resid   8 and name HA  ) (resid   9 and name HN  )  3.0  1.1  1.1
assign (resid   8 and name HB#  ) (resid   9 and name HA  )  3.3  1.2  1.2
assign (resid   8 and name HB#  ) (resid   9 and (name HB1 or name HB2  )) 3.1  1.1  1.6
assign (resid   8 and name HB#  ) (resid   9 and (name HB2 or name HB1  )) 3.1  1.1  1.6
assign (resid   8 and name HB#  ) (resid   9 and name HG#  )  2.7  0.9  1.5
assign (resid   8 and name HB#  ) (resid   9 and name HN  )  2.8  1.0  1.0
assign (resid   8 and name HE#  ) (resid   9 and name HA  )  3.8  1.3  1.6
assign (resid   8 and name HE#  ) (resid   9 and (name HB1 or name HB2  )) 4.0  1.4  1.4
assign (resid   8 and name HE#  ) (resid   9 and name HN  )  3.7  1.3  1.3
assign (resid   8 and name HN  ) (resid   9 and name HA  )  3.8  1.3  1.3
assign (resid   8 and name HN  ) (resid   9 and (name HB1 or name HB2  )) 3.0  1.0  1.0
assign (resid   8 and name HN  ) (resid   9 and name HN  )  3.0  1.1  1.1
assign (resid   8 and name HA  ) (resid  10 and name HN  )  3.6  1.3  1.3
assign (resid   8 and name HB#  ) (resid  10 and name HN  )  3.6  1.3  1.3
assign (resid   8 and name HN  ) (resid  10 and name HN  )  3.9  1.3  1.3
assign (resid   8 and name HA  ) (resid  11 and name HB#  )  2.8  1.0  1.0
assign (resid   8 and name HB#  ) (resid  11 and name HB#  )  3.2  1.1  1.1
assign (resid   8 and name HB#  ) (resid  11 and name HN  )  3.7  1.3  1.3
assign (resid   8 and name HE#  ) (resid  11 and name HB#  )  3.4  1.2  2.0
assign (resid   8 and name HE#  ) (resid  11 and name HN  )  4.1  1.4  2.6
assign (resid   8 and name HN  ) (resid  11 and name HB#  )  3.7  1.3  1.3
assign (resid   8 and name HZ  ) (resid  11 and name HB#  )  4.0  1.4  2.9
assign (resid   8 and name HA  ) (resid  12 and name HB  )  2.2  0.8  2.6
assign (resid   8 and name HA  ) (resid  12 and (name HD1# or name HG2#  )) 3.1  1.1  1.1
assign (resid   8 and name HA  ) (resid  12 and (name HG11 or name HG12  )) 3.4  1.2  1.2
assign (resid   8 and name HA  ) (resid  12 and (name HG12 or name HG11  )) 3.5  1.2  1.2
assign (resid   8 and name HA  ) (resid  12 and (name HG2# or name HD1#  )) 3.8  1.3  1.3
assign (resid   8 and name HA  ) (resid  12 and name HN  )  3.5  1.2  1.2
assign (resid   8 and name HB#  ) (resid  12 and name HB  )  3.6  1.3  1.3
assign (resid   8 and name HB#  ) (resid  12 and (name HD1# or name HG2#  )) 3.3  1.2  1.2
assign (resid   8 and name HB#  ) (resid  12 and name HN  )  3.7  1.3  1.3
assign (resid   8 and name HD#  ) (resid  12 and (name HD1# or name HG2#  )) 3.9  1.3  1.3
assign (resid   8 and name HD#  ) (resid  12 and (name HG2# or name HD1#  )) 4.0  1.4  1.4
assign (resid   8 and name HE#  ) (resid  12 and name HB  )  3.9  1.3  2.4
assign (resid   8 and name HE#  ) (resid  12 and (name HD1# or name HG2#  )) 3.5  1.2  1.2
assign (resid   8 and name HE#  ) (resid  12 and (name HG11 or name HG12  )) 3.9  1.4  1.4
assign (resid   8 and name HE#  ) (resid  12 and (name HG12 or name HG11  )) 4.2  1.5  1.5
assign (resid   8 and name HE#  ) (resid  12 and (name HG2# or name HD1#  )) 3.8  1.3  1.3
assign (resid   8 and name HN  ) (resid  12 and (name HD1# or name HG2#  )) 4.3  1.5  1.5
assign (resid   8 and name HZ  ) (resid  12 and (name HD1# or name HG2#  )) 3.8  1.3  1.3
assign (resid   8 and name HZ  ) (resid  12 and (name HG2# or name HD1#  )) 3.8  1.3  1.3
assign (resid   8 and name HA  ) (resid  13 and (name HD1# or name HD2#  )) 4.2  1.5  1.5
assign (resid   8 and name HA  ) (resid  13 and name HN  )  3.9  1.4  1.4
assign (resid   8 and name HB#  ) (resid  13 and (name HD1# or name HD2#  )) 3.8  1.3  1.3
assign (resid   8 and name HE#  ) (resid  13 and (name HD1# or name HD2#  )) 3.9  1.4  1.4
assign (resid   8 and name HE#  ) (resid  13 and name HG  )  4.1  1.4  2.4
assign (resid   8 and name HZ  ) (resid  13 and (name HD1# or name HD2#  )) 3.8  1.3  3.0
assign (resid   9 and name HA  ) (resid   9 and (name HB1 or name HB2  )) 2.6  0.9  0.9
assign (resid   9 and name HA  ) (resid   9 and (name HB2 or name HB1  )) 2.9  1.0  1.0
assign (resid   9 and name HA  ) (resid   9 and (name HD1 or name HD2  )) 3.5  1.2  1.2
assign (resid   9 and name HA  ) (resid   9 and (name HD2 or name HD1  )) 3.3  1.2  1.2
assign (resid   9 and name HA  ) (resid   9 and name HG#  )  2.9  1.0  1.0
assign (resid   9 and name HA  ) (resid   9 and name HN  )  2.9  1.0  1.0
assign (resid   9 and (name HB1 or name HB2  )) (resid   9 and (name HD1 or name HD2  )) 3.0  1.0  1.0
assign (resid   9 and (name HB1 or name HB2  )) (resid   9 and (name HD2 or name HD1  )) 3.0  1.1  1.1
assign (resid   9 and (name HB1 or name HB2  )) (resid   9 and name HE  )  3.5  1.2  1.2
assign (resid   9 and (name HB1 or name HB2  )) (resid   9 and name HG#  )  2.7  0.9  0.9
assign (resid   9 and (name HB1 or name HB2  )) (resid   9 and name HN  )  2.7  0.9  0.9
assign (resid   9 and (name HB2 or name HB1  )) (resid   9 and (name HD1 or name HD2  )) 2.9  1.0  1.0
assign (resid   9 and (name HB2 or name HB1  )) (resid   9 and (name HD2 or name HD1  )) 2.8  1.0  1.0
assign (resid   9 and (name HB2 or name HB1  )) (resid   9 and name HE  )  3.6  1.3  1.3
assign (resid   9 and (name HB2 or name HB1  )) (resid   9 and name HN  )  3.0  1.1  1.1
assign (resid   9 and (name HD1 or name HD2  )) (resid   9 and name HE  )  3.2  1.1  1.1
assign (resid   9 and (name HD1 or name HD2  )) (resid   9 and name HG#  )  2.9  1.0  1.0
assign (resid   9 and (name HD1 or name HD2  )) (resid   9 and name HN  )  3.9  1.4  1.4
assign (resid   9 and (name HD2 or name HD1  )) (resid   9 and name HE  )  3.2  1.1  1.1
assign (resid   9 and (name HD2 or name HD1  )) (resid   9 and name HG#  )  2.7  0.9  0.9
assign (resid   9 and (name HD2 or name HD1  )) (resid   9 and name HN  )  3.4  1.2  1.2
assign (resid   9 and name HE  ) (resid   9 and name HG#  )  3.6  1.3  1.3
assign (resid   9 and name HG#  ) (resid   9 and name HN  )  3.2  1.1  1.1
assign (resid   9 and name HA  ) (resid  10 and name HA  )  3.6  1.3  1.3
assign (resid   9 and name HA  ) (resid  10 and name HN  )  3.2  1.1  1.1
assign (resid   9 and (name HB1 or name HB2  )) (resid  10 and name HA  )  3.1  1.1  1.1
assign (resid   9 and (name HB1 or name HB2  )) (resid  10 and (name HB1 or name HB2  )) 3.3  1.2  1.2
assign (resid   9 and (name HB1 or name HB2  )) (resid  10 and name HN  )  2.9  1.0  1.0
assign (resid   9 and (name HB2 or name HB1  )) (resid  10 and name HN  )  3.4  1.2  1.2
assign (resid   9 and (name HD1 or name HD2  )) (resid  10 and name HN  )  3.8  1.3  1.3
assign (resid   9 and (name HD2 or name HD1  )) (resid  10 and name HN  )  3.5  1.2  1.2
assign (resid   9 and name HG#  ) (resid  10 and name HN  )  3.5  1.2  1.2
assign (resid   9 and name HN  ) (resid  10 and name HA  )  3.9  1.3  1.3
assign (resid   9 and name HN  ) (resid  10 and (name HB1 or name HB2  )) 3.7  1.3  1.3
assign (resid   9 and name HN  ) (resid  10 and (name HB2 or name HB1  )) 4.0  1.4  1.4
assign (resid   9 and name HN  ) (resid  10 and name HN  )  3.0  1.0  1.0
assign (resid   9 and name HA  ) (resid  11 and name HB#  )  3.5  1.2  1.2
assign (resid   9 and name HA  ) (resid  11 and name HN  )  3.5  1.2  1.2
assign (resid   9 and (name HB1 or name HB2  )) (resid  11 and name HN  )  2.8  1.0  1.0
assign (resid   9 and name HN  ) (resid  11 and name HB#  )  3.9  1.4  1.4
assign (resid   9 and name HN  ) (resid  11 and name HN  )  3.8  1.3  1.3
assign (resid   9 and name HA  ) (resid  12 and name HB  )  2.7  0.9  0.9
assign (resid   9 and name HA  ) (resid  12 and (name HD1# or name HG2#  )) 3.1  1.1  1.1
assign (resid   9 and name HA  ) (resid  12 and (name HG11 or name HG12  )) 2.6  0.9  1.4
assign (resid   9 and name HA  ) (resid  12 and (name HG12 or name HG11  )) 3.3  1.2  1.2
assign (resid   9 and name HA  ) (resid  12 and (name HG2# or name HD1#  )) 3.1  1.1  1.1
assign (resid   9 and name HA  ) (resid  12 and name HN  )  3.4  1.2  1.2
assign (resid   9 and (name HB1 or name HB2  )) (resid  12 and (name HD1# or name HG2#  )) 3.7  1.3  1.3
assign (resid   9 and (name HB1 or name HB2  )) (resid  12 and name HN  )  3.8  1.3  1.3
assign (resid   9 and name HN  ) (resid  12 and (name HD1# or name HG2#  )) 4.0  1.4  1.4
assign (resid   9 and name HA  ) (resid  13 and (name HD1# or name HD2#  )) 3.2  1.1  1.1
assign (resid   9 and name HA  ) (resid  13 and (name HD2# or name HD1#  )) 2.8  1.0  1.0
assign (resid   9 and name HA  ) (resid  13 and name HG  )  3.0  1.1  1.1
assign (resid   9 and name HA  ) (resid  13 and name HN  )  3.4  1.2  1.2
assign (resid   9 and (name HB1 or name HB2  )) (resid  13 and (name HD1# or name HD2#  )) 3.4  1.2  1.2
assign (resid   9 and (name HB1 or name HB2  )) (resid  13 and (name HD2# or name HD1#  )) 3.7  1.3  1.3
assign (resid   9 and (name HB2 or name HB1  )) (resid  13 and (name HD1# or name HD2#  )) 3.0  1.1  1.1
assign (resid   9 and (name HD1 or name HD2  )) (resid  13 and (name HD1# or name HD2#  )) 3.6  1.3  1.3
assign (resid   9 and (name HD2 or name HD1  )) (resid  13 and (name HD1# or name HD2#  )) 3.6  1.3  1.3
assign (resid   9 and name HN  ) (resid  13 and (name HD1# or name HD2#  )) 4.5  1.6  1.6
assign (resid   9 and name HN  ) (resid  13 and (name HD2# or name HD1#  )) 4.3  1.5  1.5
assign (resid  10 and name HA  ) (resid  10 and (name HB1 or name HB2  )) 2.8  1.0  1.0
assign (resid  10 and name HA  ) (resid  10 and (name HB2 or name HB1  )) 2.7  0.9  0.9
assign (resid  10 and name HA  ) (resid  10 and name HN  )  2.9  1.0  1.0
assign (resid  10 and (name HB1 or name HB2  )) (resid  10 and name HN  )  2.8  1.0  1.0
assign (resid  10 and (name HB2 or name HB1  )) (resid  10 and name HN  )  2.8  1.0  1.0
assign (resid  10 and name HA  ) (resid  11 and name HA  )  3.4  1.2  1.2
assign (resid  10 and name HA  ) (resid  11 and name HB#  )  3.5  1.2  1.2
assign (resid  10 and name HA  ) (resid  11 and name HN  )  3.0  1.0  1.0
assign (resid  10 and (name HB1 or name HB2  )) (resid  11 and name HA  )  3.5  1.2  1.2
assign (resid  10 and (name HB1 or name HB2  )) (resid  11 and name HB#  )  3.2  1.1  1.1
assign (resid  10 and (name HB1 or name HB2  )) (resid  11 and name HN  )  3.0  1.0  1.0
assign (resid  10 and (name HB2 or name HB1  )) (resid  11 and name HA  )  3.5  1.2  1.2
assign (resid  10 and (name HB2 or name HB1  )) (resid  11 and name HB#  )  3.3  1.2  1.2
assign (resid  10 and (name HB2 or name HB1  )) (resid  11 and name HN  )  3.0  1.0  1.0
assign (resid  10 and name HN  ) (resid  11 and name HA  )  3.8  1.3  1.3
assign (resid  10 and name HN  ) (resid  11 and name HB#  )  3.1  1.1  1.1
assign (resid  10 and name HN  ) (resid  11 and name HN  )  2.9  1.0  1.0
assign (resid  10 and name HA  ) (resid  12 and name HN  )  3.7  1.3  1.3
assign (resid  10 and name HN  ) (resid  12 and name HN  )  3.8  1.3  1.3
assign (resid  10 and name HA  ) (resid  13 and (name HB1 or name HB2  )) 2.7  0.9  0.9
assign (resid  10 and name HA  ) (resid  13 and (name HB2 or name HB1  )) 3.1  1.1  1.1
assign (resid  10 and name HA  ) (resid  13 and (name HD1# or name HD2#  )) 3.2  1.1  1.1
assign (resid  10 and name HA  ) (resid  13 and (name HD2# or name HD1#  )) 3.8  1.3  1.3
assign (resid  10 and name HA  ) (resid  13 and name HG  )  3.3  1.2  1.2
assign (resid  10 and name HA  ) (resid  13 and name HN  )  3.4  1.2  1.2
assign (resid  10 and name HN  ) (resid  13 and (name HB1 or name HB2  )) 2.5  0.9  1.6
assign (resid  10 and name HN  ) (resid  13 and (name HD1# or name HD2#  )) 4.2  1.5  1.5
assign (resid  10 and name HA  ) (resid  14 and (name HB1 or name HB2  )) 3.7  1.3  1.3
assign (resid  10 and name HA  ) (resid  14 and (name HB2 or name HB1  )) 2.4  0.8  0.8
assign (resid  10 and name HA  ) (resid  14 and name HG#  )  3.7  1.3  1.3
assign (resid  10 and name HN  ) (resid  17 and name HG#  )  3.6  1.3  3.6
assign (resid  11 and name HA  ) (resid  11 and name HB#  )  2.5  0.9  0.9
assign (resid  11 and name HA  ) (resid  11 and name HN  )  2.8  1.0  1.0
assign (resid  11 and name HB#  ) (resid  11 and name HN  )  2.6  0.9  0.9
assign (resid  11 and name HA  ) (resid  12 and name HB  )  3.6  1.3  1.8
assign (resid  11 and name HA  ) (resid  12 and (name HD1# or name HG2#  )) 4.0  1.4  1.4
assign (resid  11 and name HA  ) (resid  12 and (name HG11 or name HG12  )) 3.8  1.3  1.3
assign (resid  11 and name HA  ) (resid  12 and (name HG12 or name HG11  )) 3.4  1.2  1.2
assign (resid  11 and name HA  ) (resid  12 and (name HG2# or name HD1#  )) 4.0  1.4  1.4
assign (resid  11 and name HA  ) (resid  12 and name HN  )  3.1  1.1  1.1
assign (resid  11 and name HB#  ) (resid  12 and name HA  )  2.8  1.0  1.0
assign (resid  11 and name HB#  ) (resid  12 and name HB  )  3.2  1.1  1.1
assign (resid  11 and name HB#  ) (resid  12 and name HN  )  2.9  1.0  1.0
assign (resid  11 and name HN  ) (resid  12 and name HA  )  3.3  1.2  1.3
assign (resid  11 and name HN  ) (resid  12 and (name HD1# or name HG2#  )) 3.9  1.4  1.4
assign (resid  11 and name HN  ) (resid  12 and (name HG11 or name HG12  )) 3.5  1.2  1.2
assign (resid  11 and name HN  ) (resid  12 and (name HG12 or name HG11  )) 2.4  0.8  0.8
assign (resid  11 and name HN  ) (resid  12 and (name HG2# or name HD1#  )) 3.4  1.2  1.2
assign (resid  11 and name HN  ) (resid  12 and name HN  )  2.9  1.0  1.0
assign (resid  11 and name HA  ) (resid  13 and name HN  )  3.8  1.3  1.3
assign (resid  11 and name HB#  ) (resid  13 and name HN  )  3.4  1.2  1.2
assign (resid  11 and name HN  ) (resid  13 and (name HB1 or name HB2  )) 2.8  1.0  1.4
assign (resid  11 and name HN  ) (resid  13 and (name HD1# or name HD2#  )) 3.6  1.3  1.3
assign (resid  11 and name HN  ) (resid  13 and name HN  )  2.9  1.0  1.0
assign (resid  11 and name HA  ) (resid  14 and (name HB1 or name HB2  )) 3.4  1.2  1.2
assign (resid  11 and name HA  ) (resid  14 and (name HB2 or name HB1  )) 3.3  1.2  1.2
assign (resid  11 and name HA  ) (resid  14 and name HG#  )  3.6  1.3  1.3
assign (resid  11 and name HB#  ) (resid  14 and name HG#  )  3.6  1.3  1.3
assign (resid  11 and name HA  ) (resid  15 and name HG#  )  3.5  1.2  1.2
assign (resid  11 and name HA  ) (resid  15 and name HN  )  3.7  1.3  1.3
assign (resid  11 and name HB#  ) (resid  15 and (name HB1 or name HB2  )) 3.1  1.1  2.5
assign (resid  11 and name HB#  ) (resid  15 and name HD#  )  3.5  1.2  1.2
assign (resid  12 and name HA  ) (resid  12 and name HB  )  2.6  0.9  0.9
assign (resid  12 and name HA  ) (resid  12 and (name HD1# or name HG2#  )) 2.8  1.0  1.0
assign (resid  12 and name HA  ) (resid  12 and (name HG11 or name HG12  )) 2.9  1.0  1.0
assign (resid  12 and name HA  ) (resid  12 and (name HG12 or name HG11  )) 2.9  1.0  1.0
assign (resid  12 and name HA  ) (resid  12 and (name HG2# or name HD1#  )) 2.6  0.9  0.9
assign (resid  12 and name HA  ) (resid  12 and name HN  )  2.9  1.0  1.0
assign (resid  12 and name HB  ) (resid  12 and (name HD1# or name HG2#  )) 2.8  1.0  1.0
assign (resid  12 and name HB  ) (resid  12 and (name HG11 or name HG12  )) 2.9  1.0  1.0
assign (resid  12 and name HB  ) (resid  12 and (name HG12 or name HG11  )) 2.9  1.0  1.0
assign (resid  12 and name HB  ) (resid  12 and (name HG2# or name HD1#  )) 2.6  0.9  0.9
assign (resid  12 and name HB  ) (resid  12 and name HN  )  2.7  0.9  0.9
assign (resid  12 and (name HD1# or name HG2#  )) (resid  12 and (name HG11 or name HG12  )) 2.6  0.9  0.9
assign (resid  12 and (name HD1# or name HG2#  )) (resid  12 and (name HG12 or name HG11  )) 2.7  0.9  0.9
assign (resid  12 and (name HD1# or name HG2#  )) (resid  12 and name HN  )  3.2  1.1  1.1
assign (resid  12 and (name HG11 or name HG12  )) (resid  12 and (name HG2# or name HD1#  )) 2.8  1.0  1.0
assign (resid  12 and (name HG11 or name HG12  )) (resid  12 and name HN  )  2.9  1.0  1.0
assign (resid  12 and (name HG12 or name HG11  )) (resid  12 and (name HG2# or name HD1#  )) 2.7  0.9  0.9
assign (resid  12 and (name HG12 or name HG11  )) (resid  12 and name HN  )  2.9  1.0  1.0
assign (resid  12 and (name HG2# or name HD1#  )) (resid  12 and name HN  )  3.0  1.0  1.0
assign (resid  12 and name HA  ) (resid  13 and name HN  )  3.0  1.0  1.0
assign (resid  12 and name HB  ) (resid  13 and name HN  )  2.8  1.0  1.0
assign (resid  12 and (name HD1# or name HG2#  )) (resid  13 and name HN  )  3.5  1.2  1.2
assign (resid  12 and (name HG11 or name HG12  )) (resid  13 and name HN  )  3.4  1.2  1.2
assign (resid  12 and (name HG12 or name HG11  )) (resid  13 and name HN  )  3.5  1.2  1.2
assign (resid  12 and (name HG2# or name HD1#  )) (resid  13 and name HA  )  3.0  1.1  1.1
assign (resid  12 and (name HG2# or name HD1#  )) (resid  13 and (name HB2 or name HB1  )) 3.3  1.2  1.2
assign (resid  12 and (name HG2# or name HD1#  )) (resid  13 and name HG  )  3.0  1.1  1.1
assign (resid  12 and (name HG2# or name HD1#  )) (resid  13 and name HN  )  3.0  1.1  1.1
assign (resid  12 and name HN  ) (resid  13 and name HA  )  3.6  1.3  1.3
assign (resid  12 and name HN  ) (resid  13 and (name HB2 or name HB1  )) 3.6  1.3  1.3
assign (resid  12 and name HN  ) (resid  13 and (name HD1# or name HD2#  )) 4.1  1.4  1.4
assign (resid  12 and name HN  ) (resid  13 and (name HD2# or name HD1#  )) 3.8  1.3  1.3
assign (resid  12 and name HN  ) (resid  13 and name HG  )  3.5  1.2  1.2
assign (resid  12 and name HN  ) (resid  13 and name HN  )  2.9  1.0  1.0
assign (resid  12 and (name HG12 or name HG11  )) (resid  14 and name HN  )  3.3  1.2  1.3
assign (resid  12 and name HA  ) (resid  15 and (name HB2 or name HB1  )) 3.4  1.2  1.2
assign (resid  12 and name HA  ) (resid  15 and name HD#  )  3.3  1.2  1.2
assign (resid  12 and name HA  ) (resid  15 and name HG#  )  3.3  1.2  1.2
assign (resid  12 and name HA  ) (resid  15 and name HN  )  3.5  1.2  1.2
assign (resid  12 and name HB  ) (resid  15 and name HN  )  2.9  1.0  1.9
assign (resid  12 and (name HD1# or name HG2#  )) (resid  15 and name HD#  )  3.7  1.3  1.3
assign (resid  12 and (name HG2# or name HD1#  )) (resid  15 and (name HB2 or name HB1  )) 3.2  1.1  1.1
assign (resid  12 and (name HG2# or name HD1#  )) (resid  15 and name HD#  )  3.7  1.3  1.3
assign (resid  12 and (name HG2# or name HD1#  )) (resid  15 and name HG#  )  3.4  1.2  1.2
assign (resid  12 and (name HG2# or name HD1#  )) (resid  15 and name HN  )  3.9  1.4  1.4
assign (resid  12 and (name HG2# or name HD1#  )) (resid  16 and name HD#  )  3.4  1.2  1.2
assign (resid  12 and (name HG2# or name HD1#  )) (resid  16 and name HN  )  4.0  1.4  1.4
assign (resid  13 and name HA  ) (resid  13 and (name HB1 or name HB2  )) 2.5  0.9  0.9
assign (resid  13 and name HA  ) (resid  13 and (name HB2 or name HB1  )) 2.8  1.0  1.0
assign (resid  13 and name HA  ) (resid  13 and (name HD1# or name HD2#  )) 3.0  1.0  1.0
assign (resid  13 and name HA  ) (resid  13 and (name HD2# or name HD1#  )) 2.5  0.9  0.9
assign (resid  13 and name HA  ) (resid  13 and name HG  )  2.9  1.0  1.0
assign (resid  13 and name HA  ) (resid  13 and name HN  )  2.9  1.0  1.0
assign (resid  13 and (name HB1 or name HB2  )) (resid  13 and (name HD1# or name HD2#  )) 2.7  0.9  0.9
assign (resid  13 and (name HB1 or name HB2  )) (resid  13 and (name HD2# or name HD1#  )) 2.7  0.9  0.9
assign (resid  13 and (name HB1 or name HB2  )) (resid  13 and name HN  )  2.8  1.0  1.0
assign (resid  13 and (name HB2 or name HB1  )) (resid  13 and (name HD1# or name HD2#  )) 2.6  0.9  0.9
assign (resid  13 and (name HB2 or name HB1  )) (resid  13 and (name HD2# or name HD1#  )) 2.7  0.9  0.9
assign (resid  13 and (name HB2 or name HB1  )) (resid  13 and name HN  )  2.9  1.0  1.0
assign (resid  13 and (name HD1# or name HD2#  )) (resid  13 and name HG  )  2.6  0.9  0.9
assign (resid  13 and (name HD1# or name HD2#  )) (resid  13 and name HN  )  3.1  1.1  1.1
assign (resid  13 and (name HD2# or name HD1#  )) (resid  13 and name HG  )  2.6  0.9  0.9
assign (resid  13 and (name HD2# or name HD1#  )) (resid  13 and name HN  )  3.1  1.1  1.1
assign (resid  13 and name HG  ) (resid  13 and name HN  )  2.9  1.0  1.0
assign (resid  13 and name HA  ) (resid  14 and (name HB2 or name HB1  )) 3.7  1.3  1.3
assign (resid  13 and name HA  ) (resid  14 and name HG#  )  3.6  1.3  1.3
assign (resid  13 and name HA  ) (resid  14 and name HN  )  2.9  1.0  1.0
assign (resid  13 and (name HB1 or name HB2  )) (resid  14 and name HN  )  2.8  1.0  1.0
assign (resid  13 and (name HB2 or name HB1  )) (resid  14 and name HA  )  3.6  1.3  1.3
assign (resid  13 and (name HB2 or name HB1  )) (resid  14 and name HN  )  3.0  1.1  1.1
assign (resid  13 and (name HD1# or name HD2#  )) (resid  14 and name HN  )  3.4  1.2  1.2
assign (resid  13 and (name HD2# or name HD1#  )) (resid  14 and name HN  )  3.4  1.2  1.2
assign (resid  13 and name HG  ) (resid  14 and name HG#  )  3.3  1.2  1.7
assign (resid  13 and name HN  ) (resid  14 and name HA  )  3.6  1.3  1.3
assign (resid  13 and name HN  ) (resid  14 and name HG#  )  3.8  1.3  1.3
assign (resid  13 and name HN  ) (resid  14 and name HN  )  2.8  1.0  1.0
assign (resid  13 and name HA  ) (resid  15 and name HG#  )  2.8  1.0  1.0
assign (resid  13 and name HA  ) (resid  15 and name HN  )  3.5  1.2  1.2
assign (resid  13 and (name HB2 or name HB1  )) (resid  15 and name HN  )  3.2  1.1  1.1
assign (resid  13 and (name HD1# or name HD2#  )) (resid  15 and name HD#  )  3.9  1.4  1.4
assign (resid  13 and (name HD2# or name HD1#  )) (resid  15 and name HN  )  3.7  1.3  1.3
assign (resid  13 and name HN  ) (resid  15 and name HN  )  3.7  1.3  1.3
assign (resid  13 and name HA  ) (resid  16 and name HG#  )  3.4  1.2  1.2
assign (resid  14 and name HA  ) (resid  14 and (name HB1 or name HB2  )) 2.8  1.0  1.0
assign (resid  14 and name HA  ) (resid  14 and (name HB2 or name HB1  )) 2.8  1.0  1.0
assign (resid  14 and name HA  ) (resid  14 and name HG#  )  2.9  1.0  1.0
assign (resid  14 and name HA  ) (resid  14 and name HN  )  2.7  0.9  0.9
assign (resid  14 and (name HB1 or name HB2  )) (resid  14 and name HG#  )  2.5  0.9  0.9
assign (resid  14 and (name HB1 or name HB2  )) (resid  14 and name HN  )  3.0  1.0  1.0
assign (resid  14 and (name HB2 or name HB1  )) (resid  14 and name HE2#  )  4.2  1.5  1.5
assign (resid  14 and (name HB2 or name HB1  )) (resid  14 and name HG#  )  3.0  1.0  1.0
assign (resid  14 and (name HB2 or name HB1  )) (resid  14 and name HN  )  2.9  1.0  1.0
assign (resid  14 and name HE2#  ) (resid  14 and name HG#  )  3.4  1.2  1.2
assign (resid  14 and name HG#  ) (resid  14 and name HN  )  3.0  1.1  1.1
assign (resid  14 and name HA  ) (resid  15 and name HN  )  2.8  1.0  1.0
assign (resid  14 and (name HB1 or name HB2  )) (resid  15 and name HA  )  3.8  1.3  1.3
assign (resid  14 and (name HB1 or name HB2  )) (resid  15 and name HN  )  3.4  1.2  1.2
assign (resid  14 and (name HB2 or name HB1  )) (resid  15 and name HA  )  3.9  1.4  1.4
assign (resid  14 and (name HB2 or name HB1  )) (resid  15 and name HN  )  3.4  1.2  1.2
assign (resid  14 and name HE2#  ) (resid  15 and name HG#  )  4.1  1.4  1.4
assign (resid  14 and name HG#  ) (resid  15 and name HA  )  3.8  1.3  1.6
assign (resid  14 and name HG#  ) (resid  15 and name HN  )  3.5  1.2  1.2
assign (resid  14 and name HN  ) (resid  15 and name HD#  )  2.6  0.9  1.6
assign (resid  14 and name HN  ) (resid  15 and name HN  )  2.9  1.0  1.0
assign (resid  14 and name HA  ) (resid  17 and name HG#  )  3.5  1.2  1.2
assign (resid  15 and name HA  ) (resid  15 and (name HB1 or name HB2  )) 2.8  1.0  1.0
assign (resid  15 and name HA  ) (resid  15 and (name HB2 or name HB1  )) 2.5  0.9  0.9
assign (resid  15 and name HA  ) (resid  15 and name HD#  )  3.0  1.0  1.0
assign (resid  15 and name HA  ) (resid  15 and name HG#  )  2.7  0.9  0.9
assign (resid  15 and name HA  ) (resid  15 and name HN  )  2.9  1.0  1.0
assign (resid  15 and (name HB1 or name HB2  )) (resid  15 and name HD#  )  3.0  1.0  1.0
assign (resid  15 and (name HB1 or name HB2  )) (resid  15 and name HE  )  3.6  1.3  1.3
assign (resid  15 and (name HB1 or name HB2  )) (resid  15 and name HN  )  2.9  1.0  1.0
assign (resid  15 and (name HB2 or name HB1  )) (resid  15 and name HD#  )  2.8  1.0  1.0
assign (resid  15 and (name HB2 or name HB1  )) (resid  15 and name HN  )  2.8  1.0  1.0
assign (resid  15 and name HD#  ) (resid  15 and name HE  )  3.2  1.1  1.1
assign (resid  15 and name HD#  ) (resid  15 and name HG#  )  2.5  0.9  0.9
assign (resid  15 and name HD#  ) (resid  15 and name HN  )  3.3  1.2  1.2
assign (resid  15 and name HE  ) (resid  15 and name HG#  )  3.5  1.2  1.2
assign (resid  15 and name HG#  ) (resid  15 and name HN  )  2.9  1.0  1.0
assign (resid  15 and name HA  ) (resid  16 and name HD#  )  2.6  0.9  0.9
assign (resid  15 and name HA  ) (resid  16 and name HN  )  2.8  1.0  1.0
assign (resid  15 and name HN  ) (resid  16 and name HN  )  3.1  1.1  1.1
assign (resid  15 and name HA  ) (resid  17 and name HN  )  3.6  1.3  1.3
assign (resid  16 and name HA  ) (resid  16 and (name HB1 or name HB2  )) 2.5  0.9  0.9
assign (resid  16 and name HA  ) (resid  16 and (name HB2 or name HB1  )) 2.5  0.9  0.9
assign (resid  16 and name HA  ) (resid  16 and name HD#  )  2.2  0.8  0.8
assign (resid  16 and name HA  ) (resid  16 and name HG#  )  2.9  1.0  1.0
assign (resid  16 and name HA  ) (resid  16 and name HN  )  2.8  1.0  1.0
assign (resid  16 and (name HB1 or name HB2  )) (resid  16 and name HN  )  2.9  1.0  1.0
assign (resid  16 and (name HB2 or name HB1  )) (resid  16 and name HN  )  2.8  1.0  1.0
assign (resid  16 and name HD#  ) (resid  16 and name HN  )  3.1  1.1  1.1
assign (resid  16 and name HG#  ) (resid  16 and name HN  )  3.0  1.1  1.1
assign (resid  16 and name HA  ) (resid  17 and name HN  )  2.6  0.9  0.9
assign (resid  16 and name HG#  ) (resid  17 and name HN  )  3.4  1.2  1.2
assign (resid  16 and name HN  ) (resid  17 and name HN  )  3.1  1.1  1.1
assign (resid  17 and name HA  ) (resid  17 and (name HB1 or name HB2  )) 2.5  0.9  0.9
assign (resid  17 and name HA  ) (resid  17 and (name HB2 or name HB1  )) 3.0  1.0  1.0
assign (resid  17 and name HA  ) (resid  17 and name HD#  )  3.5  1.2  1.2
assign (resid  17 and name HA  ) (resid  17 and name HG#  )  3.1  1.1  1.1
assign (resid  17 and name HA  ) (resid  17 and name HN  )  2.8  1.0  1.0
assign (resid  17 and (name HB1 or name HB2  )) (resid  17 and name HN  )  3.0  1.1  1.1
assign (resid  17 and (name HB2 or name HB1  )) (resid  17 and name HN  )  2.8  1.0  1.0
assign (resid  17 and name HD#  ) (resid  17 and name HN  )  3.9  1.4  1.4
assign (resid  17 and name HG#  ) (resid  17 and name HN  )  3.2  1.1  1.1
# Restraints file 2: CSP1F11A_hbda.tbl
!helix 1
!assign (resid  8 and name n)(resid  8 and name hn) (resid  4 and name o)
assign (resid  9 and name n)(resid  9 and name hn) (resid  5 and name o)
assign (resid  10 and name n)(resid  10 and name hn) (resid  6 and name o)
assign (resid 11 and name n)(resid 11 and name hn) (resid  7 and name o)
assign (resid 12 and name n)(resid 12 and name hn) (resid  8 and name o)
assign (resid 13 and name n)(resid 13 and name hn) (resid  9 and name o)
# Restraints file 3: CSP1F11A_hbonds.tbl
!! helix 1:

!assign ( resid  4  and name O ) ( resid  8  and name HN ) 1.9 0.4 0.6
!assign ( resid  4  and name O ) ( resid  8  and name N  ) 2.9 0.5 0.7

assign ( resid  5  and name O ) ( resid  9  and name HN ) 1.9 0.4 0.6
assign ( resid  5  and name O ) ( resid  9  and name N  ) 2.9 0.5 0.7

assign ( resid  6  and name O ) ( resid  10  and name HN ) 1.9 0.4 0.6
assign ( resid  6  and name O ) ( resid  10  and name N  ) 2.9 0.5 0.7

assign ( resid  7  and name O ) ( resid 11  and name HN ) 1.9 0.4 0.6
assign ( resid  7  and name O ) ( resid 11  and name N  ) 2.9 0.5 0.7

assign ( resid  8  and name O ) ( resid 12  and name HN ) 1.9 0.4 0.6
assign ( resid  8  and name O ) ( resid 12  and name N  ) 2.9 0.5 0.7

assign ( resid  9  and name O ) ( resid 13  and name HN ) 1.9 0.4 0.6
assign ( resid  9  and name O ) ( resid 13  and name N  ) 2.9 0.5 0.7



# Restraints file 4: CSP1F11A_phi_psi_dihe.tbl
! Phi/Psi Angles From 'Strong' TALOS-N Predictions: 
!    error margins are set to conservative default values of double the 
!    standard deviation observed in TALOS-N capped at a minimum of +/-20 degree.
assign (resid    2 and name C    ) (resid    3 and name N    )
       (resid    3 and name CA   ) (resid    3 and name C    )    1.0  -61.2   20.0 2
assign (resid    3 and name N    ) (resid    3 and name CA   )
       (resid    3 and name C    ) (resid    4 and name N    )    1.0  -34.5   20.0 2
assign (resid    3 and name C    ) (resid    4 and name N    )
       (resid    4 and name CA   ) (resid    4 and name C    )    1.0  -66.7   20.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name C    ) (resid    5 and name N    )    1.0  -39.8   20.0 2
assign (resid    4 and name C    ) (resid    5 and name N    )
       (resid    5 and name CA   ) (resid    5 and name C    )    1.0  -64.1   20.0 2
assign (resid    5 and name N    ) (resid    5 and name CA   )
       (resid    5 and name C    ) (resid    6 and name N    )    1.0  -39.6   20.0 2
assign (resid    5 and name C    ) (resid    6 and name N    )
       (resid    6 and name CA   ) (resid    6 and name C    )    1.0  -66.2   20.0 2
assign (resid    6 and name N    ) (resid    6 and name CA   )
       (resid    6 and name C    ) (resid    7 and name N    )    1.0  -41.5   20.0 2
assign (resid    6 and name C    ) (resid    7 and name N    )
       (resid    7 and name CA   ) (resid    7 and name C    )    1.0  -65.3   20.0 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
       (resid    7 and name C    ) (resid    8 and name N    )    1.0  -42.6   20.0 2
assign (resid    7 and name C    ) (resid    8 and name N    )
       (resid    8 and name CA   ) (resid    8 and name C    )    1.0  -65.8   20.0 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name C    ) (resid    9 and name N    )    1.0  -38.6   20.0 2
assign (resid    8 and name C    ) (resid    9 and name N    )
       (resid    9 and name CA   ) (resid    9 and name C    )    1.0  -63.9   20.0 2
assign (resid    9 and name N    ) (resid    9 and name CA   )
       (resid    9 and name C    ) (resid   10 and name N    )    1.0  -40.5   20.0 2
assign (resid    9 and name C    ) (resid   10 and name N    )
       (resid   10 and name CA   ) (resid   10 and name C    )    1.0  -66.0   20.0 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name C    ) (resid   11 and name N    )    1.0  -38.4   20.0 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0  -66.3   20.0 2
assign (resid   11 and name N    ) (resid   11 and name CA   )
       (resid   11 and name C    ) (resid   12 and name N    )    1.0  -38.4   20.0 2
assign (resid   11 and name C    ) (resid   12 and name N    )
       (resid   12 and name CA   ) (resid   12 and name C    )    1.0  -67.8   20.0 2
assign (resid   12 and name N    ) (resid   12 and name CA   )
       (resid   12 and name C    ) (resid   13 and name N    )    1.0  -40.7   20.0 2
assign (resid   12 and name C    ) (resid   13 and name N    )
       (resid   13 and name CA   ) (resid   13 and name C    )    1.0  -65.4   20.0 2
assign (resid   13 and name N    ) (resid   13 and name CA   )
       (resid   13 and name C    ) (resid   14 and name N    )    1.0  -36.4   20.0 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0  -69.1   20.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name C    ) (resid   15 and name N    )    1.0  -30.7   20.0 2
assign (resid   14 and name C    ) (resid   15 and name N    )
       (resid   15 and name CA   ) (resid   15 and name C    )    1.0  -84.7   20.0 2
assign (resid   15 and name N    ) (resid   15 and name CA   )
       (resid   15 and name C    ) (resid   16 and name N    )    1.0  -14.7   23.8 2
assign (resid   15 and name C    ) (resid   16 and name N    )
       (resid   16 and name CA   ) (resid   16 and name C    )    1.0  -70.0   20.0 2
assign (resid   16 and name N    ) (resid   16 and name CA   )
       (resid   16 and name C    ) (resid   17 and name N    )    1.0  138.0   21.4 2
assign (resid    3 and name N    ) (resid    3 and name CA   )
       (resid    3 and name CB   ) (resid    3 and name CG   )    1.0  -60.0   30.0 2
assign (resid    4 and name N    ) (resid    4 and name CA   )
       (resid    4 and name CB   ) (resid    4 and name CG   )    1.0  -60.0   30.0 2
assign (resid    7 and name N    ) (resid    7 and name CA   )
       (resid    7 and name CB   ) (resid    7 and name CG   )    1.0  -60.0   30.0 2
assign (resid    8 and name N    ) (resid    8 and name CA   )
       (resid    8 and name CB   ) (resid    8 and name CG   )    1.0  -60.0   30.0 2
assign (resid   10 and name N    ) (resid   10 and name CA   )
       (resid   10 and name CB   ) (resid   10 and name CG   )    1.0  -60.0   30.0 2
assign (resid   14 and name N    ) (resid   14 and name CA   )
       (resid   14 and name CB   ) (resid   14 and name CG   )    1.0  -60.0   30.0 2
! Phi/Psi Angles From 'Generous' TALOS-N Predictions: 
!    error margins are set to default values of triple the standard
!    deviation observed in TALOS-N capped at a minimum of +/-20 degree.
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLU   1           HT1      GLU   1   3.393   7.829 -14.924
    2    H2   GLU   1           HT2      GLU   1   3.700   6.199 -15.293
    3    H3   GLU   1           HT3      GLU   1   3.218   6.640 -13.724
    4    HA   GLU   1           HA       GLU   1   1.155   7.565 -14.825
    5    HB2  GLU   1           HB2      GLU   1   2.292   5.702 -17.011
    6    HB3  GLU   1           HB1      GLU   1   0.521   6.025 -16.895
    7    HG2  GLU   1           HG2      GLU   1   0.940   8.506 -17.179
    8    HG3  GLU   1           HG1      GLU   1   2.714   8.190 -17.312
    9    H    MET   2           HN       MET   2   2.241   4.089 -15.380
   10    HA   MET   2           HA       MET   2   0.433   3.306 -13.177
   11    HB2  MET   2           HB2      MET   2   0.810   1.837 -15.864
   12    HB3  MET   2           HB1      MET   2  -0.074   1.169 -14.443
   13    HG2  MET   2           HG2      MET   2  -1.746   3.036 -14.603
   14    HG3  MET   2           HG1      MET   2  -0.871   3.706 -16.020
   15    HE1  MET   2           HE1      MET   2  -3.031   3.780 -17.392
   16    HE2  MET   2           HE2      MET   2  -3.926   3.146 -15.967
   17    HE3  MET   2           HE3      MET   2  -4.183   2.414 -17.588
   18    H    ARG   3           HN       ARG   3   1.184   1.611 -11.870
   19    HA   ARG   3           HA       ARG   3   4.040   1.111 -12.065
   20    HB2  ARG   3           HB2      ARG   3   2.032   0.273  -9.877
   21    HB3  ARG   3           HB1      ARG   3   3.824   0.123  -9.763
   22    HG2  ARG   3           HG2      ARG   3   2.222   2.751  -9.970
   23    HG3  ARG   3           HG1      ARG   3   2.946   2.059  -8.477
   24    HD2  ARG   3           HD2      ARG   3   5.268   2.208  -9.667
   25    HD3  ARG   3           HD1      ARG   3   4.436   3.170 -10.966
   26    HE   ARG   3           HE       ARG   3   3.754   4.336  -8.409
   27   HH11  ARG   3          HH11      ARG   3   6.640   3.945 -10.546
   28   HH12  ARG   3          HH12      ARG   3   7.406   5.396  -9.991
   29   HH21  ARG   3          HH21      ARG   3   4.839   6.282  -7.697
   30   HH22  ARG   3          HH22      ARG   3   6.373   6.733  -8.360
   31    H    LEU   4           HN       LEU   4   1.231  -0.408 -13.108
   32    HA   LEU   4           HA       LEU   4   2.319  -3.084 -12.821
   33    HB2  LEU   4           HB2      LEU   4  -0.205  -1.991 -14.159
   34    HB3  LEU   4           HB1      LEU   4   0.236  -3.738 -14.014
   35    HG   LEU   4           HG       LEU   4   0.567  -2.863 -11.408
   36   HD11  LEU   4          HD11      LEU   4  -1.654  -1.653 -10.812
   37   HD12  LEU   4          HD12      LEU   4  -1.724  -1.182 -12.554
   38   HD13  LEU   4          HD13      LEU   4  -0.313  -0.671 -11.533
   39   HD21  LEU   4          HD21      LEU   4  -2.010  -4.072 -12.599
   40   HD22  LEU   4          HD22      LEU   4  -1.444  -4.211 -10.889
   41   HD23  LEU   4          HD23      LEU   4  -0.495  -4.985 -12.225
   42    H    SER   5           HN       SER   5   2.013  -0.442 -15.135
   43    HA   SER   5           HA       SER   5   2.861  -2.064 -17.302
   44    HB2  SER   5           HB2      SER   5   2.843   1.003 -17.151
   45    HB3  SER   5           HB1      SER   5   3.114  -0.013 -18.628
   46    HG   SER   5           HG       SER   5   0.909  -0.886 -17.588
   47    H    LYS   6           HN       LYS   6   4.305  -0.584 -14.495
   48    HA   LYS   6           HA       LYS   6   6.849  -0.314 -15.721
   49    HB2  LYS   6           HB2      LYS   6   6.149   1.352 -14.036
   50    HB3  LYS   6           HB1      LYS   6   5.876   0.047 -12.854
   51    HG2  LYS   6           HG2      LYS   6   8.694   0.108 -13.894
   52    HG3  LYS   6           HG1      LYS   6   8.194   1.635 -13.085
   53    HD2  LYS   6           HD2      LYS   6   7.489   0.371 -11.062
   54    HD3  LYS   6           HD1      LYS   6   7.886  -1.187 -11.868
   55    HE2  LYS   6           HE2      LYS   6  10.325  -0.540 -11.951
   56    HE3  LYS   6           HE1      LYS   6   9.938   1.061 -11.195
   57    HZ1  LYS   6           HZ1      LYS   6  10.011  -1.617 -10.016
   58    HZ2  LYS   6           HZ2      LYS   6   8.864  -0.523  -9.409
   59    HZ3  LYS   6           HZ3      LYS   6  10.513  -0.120  -9.393
   60    H    PHE   7           HN       PHE   7   4.965  -2.550 -13.699
   61    HA   PHE   7           HA       PHE   7   6.998  -4.265 -12.836
   62    HB2  PHE   7           HB2      PHE   7   4.081  -4.230 -12.715
   63    HB3  PHE   7           HB1      PHE   7   4.596  -5.867 -13.206
   64    HD1  PHE   7           HD1      PHE   7   4.150  -3.612 -10.398
   65    HD2  PHE   7           HD2      PHE   7   6.239  -7.012 -11.894
   66    HE1  PHE   7           HE1      PHE   7   4.653  -4.349  -8.112
   67    HE2  PHE   7           HE2      PHE   7   6.727  -7.729  -9.686
   68    HZ   PHE   7           HZ       PHE   7   5.944  -6.414  -7.723
   69    H    PHE   8           HN       PHE   8   4.596  -4.659 -15.398
   70    HA   PHE   8           HA       PHE   8   5.707  -7.112 -16.177
   71    HB2  PHE   8           HB2      PHE   8   4.548  -5.501 -18.310
   72    HB3  PHE   8           HB1      PHE   8   4.219  -7.187 -17.830
   73    HD1  PHE   8           HD1      PHE   8   3.178  -4.332 -18.657
   74    HD2  PHE   8           HD2      PHE   8   2.634  -7.134 -15.514
   75    HE1  PHE   8           HE1      PHE   8   1.107  -3.497 -18.349
   76    HE2  PHE   8           HE2      PHE   8   0.427  -6.251 -15.176
   77    HZ   PHE   8           HZ       PHE   8  -0.381  -4.433 -16.606
   78    H    ARG   9           HN       ARG   9   6.392  -3.771 -16.865
   79    HA   ARG   9           HA       ARG   9   7.243  -3.964 -19.424
   80    HB2  ARG   9           HB2      ARG   9   6.885  -2.084 -17.643
   81    HB3  ARG   9           HB1      ARG   9   8.580  -2.324 -17.207
   82    HG2  ARG   9           HG2      ARG   9   9.237  -1.625 -19.532
   83    HG3  ARG   9           HG1      ARG   9   7.489  -1.365 -19.907
   84    HD2  ARG   9           HD2      ARG   9   7.336   0.388 -18.040
   85    HD3  ARG   9           HD1      ARG   9   9.103   0.131 -17.683
   86    HE   ARG   9           HE       ARG   9   8.827   0.739 -20.500
   87   HH11  ARG   9          HH11      ARG   9   8.473   2.351 -17.288
   88   HH12  ARG   9          HH12      ARG   9   8.866   3.927 -17.890
   89   HH21  ARG   9          HH21      ARG   9   9.357   2.889 -21.256
   90   HH22  ARG   9          HH22      ARG   9   9.372   4.232 -20.163
   91    H    ASP  10           HN       ASP  10   8.946  -4.537 -16.371
   92    HA   ASP  10           HA       ASP  10  11.324  -5.287 -17.695
   93    HB2  ASP  10           HB2      ASP  10  10.603  -5.321 -14.686
   94    HB3  ASP  10           HB1      ASP  10  12.238  -5.710 -15.337
   95    H    ALA  11           HN       ALA  11   8.352  -6.874 -17.100
   96    HA   ALA  11           HA       ALA  11   9.665  -9.428 -16.471
   97    HB1  ALA  11           HB1      ALA  11   6.668  -9.018 -16.803
   98    HB2  ALA  11           HB2      ALA  11   7.501  -8.518 -15.283
   99    HB3  ALA  11           HB3      ALA  11   7.539 -10.249 -15.803
  100    H    ILE  12           HN       ILE  12   7.582  -7.938 -18.935
  101    HA   ILE  12           HA       ILE  12   7.603 -10.357 -20.542
  102    HB   ILE  12           HB       ILE  12   6.352  -7.604 -21.007
  103   HG12  ILE  12          HG12      ILE  12   5.144 -10.079 -19.631
  104   HG13  ILE  12          HG11      ILE  12   5.578  -8.480 -18.909
  105   HG21  ILE  12          HG21      ILE  12   4.766  -8.950 -22.602
  106   HG22  ILE  12          HG22      ILE  12   5.822 -10.387 -22.360
  107   HG23  ILE  12          HG23      ILE  12   6.474  -8.906 -23.153
  108   HD11  ILE  12          HD11      ILE  12   3.839  -7.345 -20.339
  109   HD12  ILE  12          HD12      ILE  12   3.121  -8.592 -19.248
  110   HD13  ILE  12          HD13      ILE  12   3.326  -8.951 -21.003
  111    H    LEU  13           HN       LEU  13   8.827  -7.006 -20.479
  112    HA   LEU  13           HA       LEU  13   9.602  -7.192 -23.245
  113    HB2  LEU  13           HB2      LEU  13  10.000  -4.905 -21.249
  114    HB3  LEU  13           HB1      LEU  13  10.106  -4.778 -23.058
  115    HG   LEU  13           HG       LEU  13   7.645  -5.237 -21.266
  116   HD11  LEU  13          HD11      LEU  13   8.640  -2.880 -21.566
  117   HD12  LEU  13          HD12      LEU  13   6.868  -3.074 -21.861
  118   HD13  LEU  13          HD13      LEU  13   8.010  -2.918 -23.258
  119   HD21  LEU  13          HD21      LEU  13   6.948  -6.574 -23.139
  120   HD22  LEU  13          HD22      LEU  13   7.743  -5.503 -24.353
  121   HD23  LEU  13          HD23      LEU  13   6.238  -4.964 -23.512
  122    H    GLN  14           HN       GLN  14  11.044  -8.169 -20.332
  123    HA   GLN  14           HA       GLN  14  13.697  -7.368 -21.372
  124    HB2  GLN  14           HB2      GLN  14  12.776  -8.596 -18.762
  125    HB3  GLN  14           HB1      GLN  14  14.510  -8.735 -19.264
  126    HG2  GLN  14           HG2      GLN  14  14.244  -6.088 -19.687
  127    HG3  GLN  14           HG1      GLN  14  12.857  -6.286 -18.576
  128   HE21  GLN  14          HE21      GLN  14  13.407  -7.486 -16.371
  129   HE22  GLN  14          HE22      GLN  14  14.956  -7.161 -15.667
  130    H    ARG  15           HN       ARG  15  11.315  -9.745 -21.680
  131    HA   ARG  15           HA       ARG  15  13.088 -11.969 -22.098
  132    HB2  ARG  15           HB2      ARG  15  10.259 -11.563 -23.215
  133    HB3  ARG  15           HB1      ARG  15  11.116 -13.135 -22.983
  134    HG2  ARG  15           HG2      ARG  15  11.148 -12.673 -20.476
  135    HG3  ARG  15           HG1      ARG  15  10.217 -11.162 -20.806
  136    HD2  ARG  15           HD2      ARG  15   8.632 -12.833 -20.068
  137    HD3  ARG  15           HD1      ARG  15   8.375 -12.611 -21.849
  138    HE   ARG  15           HE       ARG  15  10.249 -14.793 -21.417
  139   HH11  ARG  15          HH11      ARG  15   6.740 -14.041 -21.010
  140   HH12  ARG  15          HH12      ARG  15   6.233 -15.685 -21.211
  141   HH21  ARG  15          HH21      ARG  15   9.503 -16.994 -21.685
  142   HH22  ARG  15          HH22      ARG  15   7.816 -17.374 -21.598
  143    H    LYS  16           HN       LYS  16  11.451  -9.495 -24.109
  144    HA   LYS  16           HA       LYS  16  13.086 -10.304 -26.421
  145    HB2  LYS  16           HB2      LYS  16  10.531  -8.629 -25.998
  146    HB3  LYS  16           HB1      LYS  16  11.497  -8.445 -27.502
  147    HG2  LYS  16           HG2      LYS  16   9.621  -9.940 -27.895
  148    HG3  LYS  16           HG1      LYS  16  11.151 -10.860 -28.043
  149    HD2  LYS  16           HD2      LYS  16  10.758 -12.051 -25.936
  150    HD3  LYS  16           HD1      LYS  16   9.489 -10.889 -25.434
  151    HE2  LYS  16           HE2      LYS  16   8.350 -12.945 -26.106
  152    HE3  LYS  16           HE1      LYS  16   8.040 -11.743 -27.422
  153    HZ1  LYS  16           HZ1      LYS  16   8.696 -13.461 -28.665
  154    HZ2  LYS  16           HZ2      LYS  16   9.602 -14.204 -27.436
  155    HZ3  LYS  16           HZ3      LYS  16  10.262 -12.905 -28.310
  156    H    LYS  17           HN       LYS  17  15.144  -9.339 -26.080
  157    HA   LYS  17           HA       LYS  17  15.231  -6.453 -26.076
  158    HB2  LYS  17           HB2      LYS  17  15.665  -7.972 -23.512
  159    HB3  LYS  17           HB1      LYS  17  17.111  -7.017 -23.964
  160    HG2  LYS  17           HG2      LYS  17  14.319  -5.691 -23.876
  161    HG3  LYS  17           HG1      LYS  17  15.246  -5.960 -22.366
  162    HD2  LYS  17           HD2      LYS  17  17.188  -4.649 -23.371
  163    HD3  LYS  17           HD1      LYS  17  16.184  -4.325 -24.829
  164    HE2  LYS  17           HE2      LYS  17  14.497  -3.097 -23.400
  165    HE3  LYS  17           HE1      LYS  17  15.506  -3.429 -21.932
  166    HZ1  LYS  17           HZ1      LYS  17  17.161  -2.037 -22.688
  167    HZ2  LYS  17           HZ2      LYS  17  15.743  -1.214 -23.130
  168    HZ3  LYS  17           HZ3      LYS  17  16.634  -2.057 -24.302
  Start of MODEL    2
    1    H1   GLU   1           HT1      GLU   1   0.205   6.500 -16.709
    2    H2   GLU   1           HT2      GLU   1   1.265   7.807 -16.941
    3    H3   GLU   1           HT3      GLU   1   0.218   7.791 -15.605
    4    HA   GLU   1           HA       GLU   1   2.517   6.017 -16.118
    5    HB2  GLU   1           HB2      GLU   1   1.905   8.176 -13.987
    6    HB3  GLU   1           HB1      GLU   1   3.210   6.953 -13.747
    7    HG2  GLU   1           HG2      GLU   1   4.381   7.760 -15.837
    8    HG3  GLU   1           HG1      GLU   1   3.080   8.985 -16.099
    9    H    MET   2           HN       MET   2   2.239   3.913 -15.491
   10    HA   MET   2           HA       MET   2   0.487   3.385 -13.171
   11    HB2  MET   2           HB2      MET   2   0.711   1.729 -15.764
   12    HB3  MET   2           HB1      MET   2  -0.146   1.181 -14.278
   13    HG2  MET   2           HG2      MET   2  -1.750   3.101 -14.498
   14    HG3  MET   2           HG1      MET   2  -0.900   3.649 -15.981
   15    HE1  MET   2           HE1      MET   2  -3.982   3.190 -15.773
   16    HE2  MET   2           HE2      MET   2  -4.316   2.389 -17.347
   17    HE3  MET   2           HE3      MET   2  -3.120   3.727 -17.257
   18    H    ARG   3           HN       ARG   3   1.168   1.639 -11.824
   19    HA   ARG   3           HA       ARG   3   4.017   1.105 -11.993
   20    HB2  ARG   3           HB2      ARG   3   1.964   0.305  -9.831
   21    HB3  ARG   3           HB1      ARG   3   3.747   0.101  -9.688
   22    HG2  ARG   3           HG2      ARG   3   2.257   2.792  -9.944
   23    HG3  ARG   3           HG1      ARG   3   2.860   2.063  -8.417
   24    HD2  ARG   3           HD2      ARG   3   5.250   2.104  -9.461
   25    HD3  ARG   3           HD1      ARG   3   4.548   3.098 -10.813
   26    HE   ARG   3           HE       ARG   3   3.754   4.318  -8.320
   27   HH11  ARG   3          HH11      ARG   3   6.784   3.752 -10.206
   28   HH12  ARG   3          HH12      ARG   3   7.589   5.150  -9.575
   29   HH21  ARG   3          HH21      ARG   3   4.894   6.188  -7.501
   30   HH22  ARG   3          HH22      ARG   3   6.507   6.543  -8.027
   31    H    LEU   4           HN       LEU   4   1.200  -0.413 -13.041
   32    HA   LEU   4           HA       LEU   4   2.294  -3.089 -12.754
   33    HB2  LEU   4           HB2      LEU   4  -0.238  -2.004 -14.087
   34    HB3  LEU   4           HB1      LEU   4   0.213  -3.750 -13.946
   35    HG   LEU   4           HG       LEU   4   0.540  -2.897 -11.339
   36   HD11  LEU   4          HD11      LEU   4  -0.319  -0.698 -11.425
   37   HD12  LEU   4          HD12      LEU   4  -1.682  -1.675 -10.736
   38   HD13  LEU   4          HD13      LEU   4  -1.725  -1.172 -12.470
   39   HD21  LEU   4          HD21      LEU   4  -2.050  -4.072 -12.544
   40   HD22  LEU   4          HD22      LEU   4  -1.490  -4.228 -10.833
   41   HD23  LEU   4          HD23      LEU   4  -0.543  -5.002 -12.171
   42    H    SER   5           HN       SER   5   1.969  -0.446 -15.069
   43    HA   SER   5           HA       SER   5   2.816  -2.064 -17.236
   44    HB2  SER   5           HB2      SER   5   2.783   1.004 -17.084
   45    HB3  SER   5           HB1      SER   5   3.074  -0.007 -18.561
   46    HG   SER   5           HG       SER   5   0.994  -0.864 -18.272
   47    H    LYS   6           HN       LYS   6   4.273  -0.581 -14.433
   48    HA   LYS   6           HA       LYS   6   6.810  -0.300 -15.667
   49    HB2  LYS   6           HB2      LYS   6   6.089   1.335 -13.946
   50    HB3  LYS   6           HB1      LYS   6   5.870   0.004 -12.779
   51    HG2  LYS   6           HG2      LYS   6   8.663   0.136 -13.880
   52    HG3  LYS   6           HG1      LYS   6   8.153   1.646 -13.046
   53    HD2  LYS   6           HD2      LYS   6   7.508   0.334 -11.021
   54    HD3  LYS   6           HD1      LYS   6   7.950  -1.197 -11.854
   55    HE2  LYS   6           HE2      LYS   6  10.365  -0.454 -11.968
   56    HE3  LYS   6           HE1      LYS   6   9.929   1.118 -11.181
   57    HZ1  LYS   6           HZ1      LYS   6   8.927  -0.907  -9.568
   58    HZ2  LYS   6           HZ2      LYS   6  10.247   0.120  -9.274
   59    HZ3  LYS   6           HZ3      LYS   6  10.494  -1.390 -10.011
   60    H    PHE   7           HN       PHE   7   4.957  -2.555 -13.629
   61    HA   PHE   7           HA       PHE   7   7.003  -4.269 -12.801
   62    HB2  PHE   7           HB2      PHE   7   4.087  -4.245 -12.640
   63    HB3  PHE   7           HB1      PHE   7   4.596  -5.877 -13.157
   64    HD1  PHE   7           HD1      PHE   7   4.180  -3.660 -10.314
   65    HD2  PHE   7           HD2      PHE   7   6.264  -7.035 -11.878
   66    HE1  PHE   7           HE1      PHE   7   4.708  -4.430  -8.041
   67    HE2  PHE   7           HE2      PHE   7   6.777  -7.781  -9.685
   68    HZ   PHE   7           HZ       PHE   7   6.010  -6.498  -7.695
   69    H    PHE   8           HN       PHE   8   4.586  -4.653 -15.355
   70    HA   PHE   8           HA       PHE   8   5.711  -7.096 -16.152
   71    HB2  PHE   8           HB2      PHE   8   4.527  -5.501 -18.275
   72    HB3  PHE   8           HB1      PHE   8   4.206  -7.184 -17.781
   73    HD1  PHE   8           HD1      PHE   8   3.169  -4.325 -18.611
   74    HD2  PHE   8           HD2      PHE   8   2.621  -7.131 -15.473
   75    HE1  PHE   8           HE1      PHE   8   1.102  -3.489 -18.307
   76    HE2  PHE   8           HE2      PHE   8   0.412  -6.246 -15.136
   77    HZ   PHE   8           HZ       PHE   8  -0.393  -4.426 -16.565
   78    H    ARG   9           HN       ARG   9   6.395  -3.747 -16.827
   79    HA   ARG   9           HA       ARG   9   7.234  -3.940 -19.401
   80    HB2  ARG   9           HB2      ARG   9   6.938  -2.072 -17.519
   81    HB3  ARG   9           HB1      ARG   9   8.680  -2.261 -17.287
   82    HG2  ARG   9           HG2      ARG   9   9.055  -1.547 -19.663
   83    HG3  ARG   9           HG1      ARG   9   7.269  -1.381 -19.871
   84    HD2  ARG   9           HD2      ARG   9   7.216   0.410 -18.021
   85    HD3  ARG   9           HD1      ARG   9   9.028   0.261 -17.872
   86    HE   ARG   9           HE       ARG   9   8.410   0.758 -20.651
   87   HH11  ARG   9          HH11      ARG   9   8.270   2.481 -17.478
   88   HH12  ARG   9          HH12      ARG   9   8.471   4.052 -18.179
   89   HH21  ARG   9          HH21      ARG   9   8.679   2.906 -21.536
   90   HH22  ARG   9          HH22      ARG   9   8.704   4.294 -20.500
   91    H    ASP  10           HN       ASP  10   8.958  -4.523 -16.349
   92    HA   ASP  10           HA       ASP  10  11.324  -5.303 -17.701
   93    HB2  ASP  10           HB2      ASP  10  10.628  -5.298 -14.683
   94    HB3  ASP  10           HB1      ASP  10  12.243  -5.773 -15.337
   95    H    ALA  11           HN       ALA  11   8.340  -6.866 -17.098
   96    HA   ALA  11           HA       ALA  11   9.648  -9.431 -16.493
   97    HB1  ALA  11           HB1      ALA  11   7.515 -10.270 -15.852
   98    HB2  ALA  11           HB2      ALA  11   6.650  -8.996 -16.807
   99    HB3  ALA  11           HB3      ALA  11   7.498  -8.557 -15.276
  100    H    ILE  12           HN       ILE  12   7.559  -7.921 -18.945
  101    HA   ILE  12           HA       ILE  12   7.574 -10.335 -20.565
  102    HB   ILE  12           HB       ILE  12   6.337  -7.574 -21.026
  103   HG12  ILE  12          HG12      ILE  12   5.107 -10.036 -19.641
  104   HG13  ILE  12          HG11      ILE  12   5.565  -8.444 -18.920
  105   HG21  ILE  12          HG21      ILE  12   6.446  -8.927 -23.166
  106   HG22  ILE  12          HG22      ILE  12   4.743  -8.886 -22.621
  107   HG23  ILE  12          HG23      ILE  12   5.734 -10.365 -22.344
  108   HD11  ILE  12          HD11      ILE  12   3.101  -8.531 -19.256
  109   HD12  ILE  12          HD12      ILE  12   3.304  -8.876 -21.012
  110   HD13  ILE  12          HD13      ILE  12   3.835  -7.282 -20.333
  111    H    LEU  13           HN       LEU  13   8.857  -7.017 -20.457
  112    HA   LEU  13           HA       LEU  13   9.645  -7.180 -23.231
  113    HB2  LEU  13           HB2      LEU  13  10.015  -4.897 -21.227
  114    HB3  LEU  13           HB1      LEU  13  10.117  -4.773 -23.038
  115    HG   LEU  13           HG       LEU  13   7.663  -5.252 -21.237
  116   HD11  LEU  13          HD11      LEU  13   7.964  -2.958 -23.265
  117   HD12  LEU  13          HD12      LEU  13   8.622  -2.881 -21.586
  118   HD13  LEU  13          HD13      LEU  13   6.848  -3.116 -21.847
  119   HD21  LEU  13          HD21      LEU  13   7.073  -6.658 -23.145
  120   HD22  LEU  13          HD22      LEU  13   7.709  -5.469 -24.339
  121   HD23  LEU  13          HD23      LEU  13   6.202  -5.105 -23.412
  122    H    GLN  14           HN       GLN  14  11.053  -8.231 -20.328
  123    HA   GLN  14           HA       GLN  14  13.727  -7.405 -21.323
  124    HB2  GLN  14           HB2      GLN  14  12.766  -8.680 -18.745
  125    HB3  GLN  14           HB1      GLN  14  14.501  -8.846 -19.233
  126    HG2  GLN  14           HG2      GLN  14  14.278  -6.176 -19.597
  127    HG3  GLN  14           HG1      GLN  14  12.893  -6.387 -18.484
  128   HE21  GLN  14          HE21      GLN  14  13.420  -7.611 -16.304
  129   HE22  GLN  14          HE22      GLN  14  14.983  -7.351 -15.604
  130    H    ARG  15           HN       ARG  15  11.329  -9.748 -21.718
  131    HA   ARG  15           HA       ARG  15  13.103 -11.973 -22.196
  132    HB2  ARG  15           HB2      ARG  15  10.280 -11.609 -23.327
  133    HB3  ARG  15           HB1      ARG  15  11.128 -13.162 -22.961
  134    HG2  ARG  15           HG2      ARG  15  11.131 -12.444 -20.493
  135    HG3  ARG  15           HG1      ARG  15  10.103 -11.061 -20.973
  136    HD2  ARG  15           HD2      ARG  15   9.385 -14.055 -21.084
  137    HD3  ARG  15           HD1      ARG  15   8.671 -12.743 -20.051
  138    HE   ARG  15           HE       ARG  15   8.166 -11.881 -22.671
  139   HH11  ARG  15          HH11      ARG  15   7.372 -14.877 -20.802
  140   HH12  ARG  15          HH12      ARG  15   5.906 -15.182 -21.673
  141   HH21  ARG  15          HH21      ARG  15   6.175 -12.354 -23.805
  142   HH22  ARG  15          HH22      ARG  15   5.224 -13.740 -23.388
  143    H    LYS  16           HN       LYS  16  11.432  -9.455 -24.129
  144    HA   LYS  16           HA       LYS  16  13.060 -10.209 -26.466
  145    HB2  LYS  16           HB2      LYS  16  10.477  -8.606 -25.986
  146    HB3  LYS  16           HB1      LYS  16  11.451  -8.281 -27.457
  147    HG2  LYS  16           HG2      LYS  16   9.724  -9.787 -28.098
  148    HG3  LYS  16           HG1      LYS  16  11.239 -10.742 -28.083
  149    HD2  LYS  16           HD2      LYS  16  10.492 -11.655 -25.739
  150    HD3  LYS  16           HD1      LYS  16   8.928 -10.809 -26.011
  151    HE2  LYS  16           HE2      LYS  16  10.078 -12.963 -27.937
  152    HE3  LYS  16           HE1      LYS  16   8.917 -13.313 -26.595
  153    HZ1  LYS  16           HZ1      LYS  16   7.515 -11.499 -27.748
  154    HZ2  LYS  16           HZ2      LYS  16   7.581 -13.062 -28.410
  155    HZ3  LYS  16           HZ3      LYS  16   8.496 -11.808 -29.101
  156    H    LYS  17           HN       LYS  17  15.121  -9.248 -26.123
  157    HA   LYS  17           HA       LYS  17  15.212  -6.367 -26.055
  158    HB2  LYS  17           HB2      LYS  17  15.579  -7.905 -23.506
  159    HB3  LYS  17           HB1      LYS  17  17.075  -7.015 -23.927
  160    HG2  LYS  17           HG2      LYS  17  14.351  -5.553 -23.895
  161    HG3  LYS  17           HG1      LYS  17  15.214  -5.885 -22.357
  162    HD2  LYS  17           HD2      LYS  17  17.254  -4.669 -23.278
  163    HD3  LYS  17           HD1      LYS  17  16.335  -4.293 -24.777
  164    HE2  LYS  17           HE2      LYS  17  14.665  -2.963 -23.426
  165    HE3  LYS  17           HE1      LYS  17  15.582  -3.352 -21.913
  166    HZ1  LYS  17           HZ1      LYS  17  17.139  -1.865 -22.411
  167    HZ2  LYS  17           HZ2      LYS  17  15.964  -1.191 -23.435
  168    HZ3  LYS  17           HZ3      LYS  17  17.158  -2.217 -24.072
  Start of MODEL    3
    1    H1   GLU   1           HT1      GLU   1   3.787   5.882 -14.858
    2    H2   GLU   1           HT2      GLU   1   3.481   7.341 -14.044
    3    H3   GLU   1           HT3      GLU   1   3.881   7.360 -15.694
    4    HA   GLU   1           HA       GLU   1   1.460   7.634 -14.944
    5    HB2  GLU   1           HB2      GLU   1   2.474   5.856 -17.255
    6    HB3  GLU   1           HB1      GLU   1   0.713   6.207 -17.067
    7    HG2  GLU   1           HG2      GLU   1   1.182   8.696 -17.213
    8    HG3  GLU   1           HG1      GLU   1   2.942   8.347 -17.426
    9    H    MET   2           HN       MET   2   2.507   4.140 -15.549
   10    HA   MET   2           HA       MET   2   0.603   3.363 -13.424
   11    HB2  MET   2           HB2      MET   2   1.043   1.903 -16.104
   12    HB3  MET   2           HB1      MET   2   0.106   1.241 -14.712
   13    HG2  MET   2           HG2      MET   2  -1.529   3.141 -14.916
   14    HG3  MET   2           HG1      MET   2  -0.604   3.796 -16.307
   15    HE1  MET   2           HE1      MET   2  -3.905   2.550 -17.942
   16    HE2  MET   2           HE2      MET   2  -2.749   3.904 -17.704
   17    HE3  MET   2           HE3      MET   2  -3.676   3.260 -16.304
   18    H    ARG   3           HN       ARG   3   1.244   1.642 -12.122
   19    HA   ARG   3           HA       ARG   3   4.083   1.050 -12.174
   20    HB2  ARG   3           HB2      ARG   3   1.850   0.401 -10.156
   21    HB3  ARG   3           HB1      ARG   3   3.557  -0.122  -9.928
   22    HG2  ARG   3           HG2      ARG   3   2.726   2.823 -10.270
   23    HG3  ARG   3           HG1      ARG   3   2.794   1.984  -8.680
   24    HD2  ARG   3           HD2      ARG   3   5.240   1.422  -9.089
   25    HD3  ARG   3           HD1      ARG   3   5.185   2.358 -10.649
   26    HE   ARG   3           HE       ARG   3   4.217   4.105  -8.595
   27   HH11  ARG   3          HH11      ARG   3   7.294   2.375  -9.369
   28   HH12  ARG   3          HH12      ARG   3   8.303   3.580  -8.641
   29   HH21  ARG   3          HH21      ARG   3   5.624   5.695  -7.636
   30   HH22  ARG   3          HH22      ARG   3   7.342   5.483  -7.647
   31    H    LEU   4           HN       LEU   4   1.255  -0.400 -13.339
   32    HA   LEU   4           HA       LEU   4   2.312  -3.085 -13.023
   33    HB2  LEU   4           HB2      LEU   4  -0.206  -1.940 -14.312
   34    HB3  LEU   4           HB1      LEU   4   0.215  -3.700 -14.264
   35    HG   LEU   4           HG       LEU   4   0.655  -2.935 -11.638
   36   HD11  LEU   4          HD11      LEU   4  -0.197  -0.791 -11.497
   37   HD12  LEU   4          HD12      LEU   4  -1.621  -1.777 -10.956
   38   HD13  LEU   4          HD13      LEU   4  -1.569  -1.119 -12.638
   39   HD21  LEU   4          HD21      LEU   4  -1.324  -4.307 -11.086
   40   HD22  LEU   4          HD22      LEU   4  -0.425  -5.022 -12.487
   41   HD23  LEU   4          HD23      LEU   4  -1.960  -4.107 -12.765
   42    H    SER   5           HN       SER   5   2.107  -0.472 -15.353
   43    HA   SER   5           HA       SER   5   2.961  -2.152 -17.472
   44    HB2  SER   5           HB2      SER   5   2.988   0.912 -17.359
   45    HB3  SER   5           HB1      SER   5   3.301  -0.123 -18.814
   46    HG   SER   5           HG       SER   5   1.164  -1.001 -18.405
   47    H    LYS   6           HN       LYS   6   4.351  -0.628 -14.658
   48    HA   LYS   6           HA       LYS   6   6.940  -0.459 -15.787
   49    HB2  LYS   6           HB2      LYS   6   6.191   1.252 -14.150
   50    HB3  LYS   6           HB1      LYS   6   5.928  -0.034 -12.943
   51    HG2  LYS   6           HG2      LYS   6   8.731   0.016 -14.021
   52    HG3  LYS   6           HG1      LYS   6   8.244   1.543 -13.203
   53    HD2  LYS   6           HD2      LYS   6   7.664   0.367 -11.153
   54    HD3  LYS   6           HD1      LYS   6   7.814  -1.239 -11.950
   55    HE2  LYS   6           HE2      LYS   6  10.320  -0.807 -12.259
   56    HE3  LYS   6           HE1      LYS   6  10.133   0.761 -11.370
   57    HZ1  LYS   6           HZ1      LYS   6   9.272  -0.547  -9.489
   58    HZ2  LYS   6           HZ2      LYS   6  10.877  -0.922  -9.899
   59    HZ3  LYS   6           HZ3      LYS   6   9.621  -1.980 -10.330
   60    H    PHE   7           HN       PHE   7   4.937  -2.615 -13.807
   61    HA   PHE   7           HA       PHE   7   6.898  -4.353 -12.839
   62    HB2  PHE   7           HB2      PHE   7   3.982  -4.266 -12.847
   63    HB3  PHE   7           HB1      PHE   7   4.484  -5.916 -13.293
   64    HD1  PHE   7           HD1      PHE   7   3.948  -3.618 -10.531
   65    HD2  PHE   7           HD2      PHE   7   6.035  -7.077 -11.890
   66    HE1  PHE   7           HE1      PHE   7   4.308  -4.344  -8.217
   67    HE2  PHE   7           HE2      PHE   7   6.388  -7.784  -9.657
   68    HZ   PHE   7           HZ       PHE   7   5.533  -6.435  -7.745
   69    H    PHE   8           HN       PHE   8   4.607  -4.723 -15.507
   70    HA   PHE   8           HA       PHE   8   5.712  -7.205 -16.199
   71    HB2  PHE   8           HB2      PHE   8   4.654  -5.635 -18.406
   72    HB3  PHE   8           HB1      PHE   8   4.283  -7.303 -17.893
   73    HD1  PHE   8           HD1      PHE   8   3.324  -4.423 -18.805
   74    HD2  PHE   8           HD2      PHE   8   2.592  -7.194 -15.673
   75    HE1  PHE   8           HE1      PHE   8   1.263  -3.535 -18.579
   76    HE2  PHE   8           HE2      PHE   8   0.393  -6.259 -15.425
   77    HZ   PHE   8           HZ       PHE   8  -0.315  -4.429 -16.891
   78    H    ARG   9           HN       ARG   9   6.482  -3.885 -16.870
   79    HA   ARG   9           HA       ARG   9   7.453  -4.110 -19.385
   80    HB2  ARG   9           HB2      ARG   9   7.151  -2.237 -17.496
   81    HB3  ARG   9           HB1      ARG   9   8.880  -2.483 -17.229
   82    HG2  ARG   9           HG2      ARG   9   9.344  -1.740 -19.565
   83    HG3  ARG   9           HG1      ARG   9   7.570  -1.558 -19.848
   84    HD2  ARG   9           HD2      ARG   9   7.470   0.185 -17.938
   85    HD3  ARG   9           HD1      ARG   9   9.281   0.053 -17.789
   86    HE   ARG   9           HE       ARG   9   8.763   0.616 -20.536
   87   HH11  ARG   9          HH11      ARG   9   8.158   2.234 -17.360
   88   HH12  ARG   9          HH12      ARG   9   8.268   3.836 -18.010
   89   HH21  ARG   9          HH21      ARG   9   8.902   2.801 -21.351
   90   HH22  ARG   9          HH22      ARG   9   8.695   4.158 -20.296
   91    H    ASP  10           HN       ASP  10   8.946  -4.733 -16.247
   92    HA   ASP  10           HA       ASP  10  11.373  -5.580 -17.444
   93    HB2  ASP  10           HB2      ASP  10  10.522  -5.557 -14.464
   94    HB3  ASP  10           HB1      ASP  10  12.170  -5.998 -15.048
   95    H    ALA  11           HN       ALA  11   8.333  -7.058 -17.023
   96    HA   ALA  11           HA       ALA  11   9.542  -9.653 -16.336
   97    HB1  ALA  11           HB1      ALA  11   7.362 -10.446 -15.805
   98    HB2  ALA  11           HB2      ALA  11   6.574  -9.166 -16.816
   99    HB3  ALA  11           HB3      ALA  11   7.339  -8.729 -15.240
  100    H    ILE  12           HN       ILE  12   7.630  -8.086 -18.883
  101    HA   ILE  12           HA       ILE  12   7.714 -10.481 -20.531
  102    HB   ILE  12           HB       ILE  12   6.532  -7.699 -21.035
  103   HG12  ILE  12          HG12      ILE  12   5.191 -10.154 -19.750
  104   HG13  ILE  12          HG11      ILE  12   5.638  -8.581 -18.982
  105   HG21  ILE  12          HG21      ILE  12   6.743  -8.990 -23.175
  106   HG22  ILE  12          HG22      ILE  12   5.011  -9.027 -22.716
  107   HG23  ILE  12          HG23      ILE  12   6.045 -10.474 -22.424
  108   HD11  ILE  12          HD11      ILE  12   3.205  -8.598 -19.447
  109   HD12  ILE  12          HD12      ILE  12   3.485  -8.955 -21.191
  110   HD13  ILE  12          HD13      ILE  12   4.019  -7.371 -20.491
  111    H    LEU  13           HN       LEU  13   8.926  -7.124 -20.354
  112    HA   LEU  13           HA       LEU  13   9.903  -7.283 -23.052
  113    HB2  LEU  13           HB2      LEU  13  10.161  -4.990 -21.046
  114    HB3  LEU  13           HB1      LEU  13  10.372  -4.879 -22.848
  115    HG   LEU  13           HG       LEU  13   7.824  -5.354 -21.201
  116   HD11  LEU  13          HD11      LEU  13   8.906  -2.973 -21.581
  117   HD12  LEU  13          HD12      LEU  13   7.117  -3.193 -21.707
  118   HD13  LEU  13          HD13      LEU  13   8.122  -3.055 -23.207
  119   HD21  LEU  13          HD21      LEU  13   8.102  -5.620 -24.280
  120   HD22  LEU  13          HD22      LEU  13   6.539  -5.128 -23.520
  121   HD23  LEU  13          HD23      LEU  13   7.272  -6.714 -23.113
  122    H    GLN  14           HN       GLN  14  11.119  -8.278 -20.068
  123    HA   GLN  14           HA       GLN  14  13.844  -7.422 -20.800
  124    HB2  GLN  14           HB2      GLN  14  12.577  -8.853 -18.468
  125    HB3  GLN  14           HB1      GLN  14  14.330  -9.138 -18.776
  126    HG2  GLN  14           HG2      GLN  14  13.204  -6.288 -18.767
  127    HG3  GLN  14           HG1      GLN  14  13.496  -7.133 -17.194
  128   HE21  GLN  14          HE21      GLN  14  15.774  -8.108 -16.869
  129   HE22  GLN  14          HE22      GLN  14  17.130  -7.251 -17.526
  130    H    ARG  15           HN       ARG  15  11.508  -9.745 -21.542
  131    HA   ARG  15           HA       ARG  15  13.453 -11.794 -22.223
  132    HB2  ARG  15           HB2      ARG  15  10.519 -11.735 -23.056
  133    HB3  ARG  15           HB1      ARG  15  11.580 -13.169 -22.785
  134    HG2  ARG  15           HG2      ARG  15  11.640 -12.597 -20.312
  135    HG3  ARG  15           HG1      ARG  15  10.543 -11.204 -20.655
  136    HD2  ARG  15           HD2      ARG  15   9.154 -13.010 -19.824
  137    HD3  ARG  15           HD1      ARG  15   8.835 -12.872 -21.603
  138    HE   ARG  15           HE       ARG  15  10.941 -14.832 -21.132
  139   HH11  ARG  15          HH11      ARG  15   7.375 -14.425 -20.774
  140   HH12  ARG  15          HH12      ARG  15   7.035 -16.118 -20.899
  141   HH21  ARG  15          HH21      ARG  15  10.431 -17.110 -21.303
  142   HH22  ARG  15          HH22      ARG  15   8.791 -17.659 -21.202
  143    H    LYS  16           HN       LYS  16  11.238  -9.416 -23.768
  144    HA   LYS  16           HA       LYS  16  12.633  -9.845 -26.328
  145    HB2  LYS  16           HB2      LYS  16   9.898  -8.747 -25.465
  146    HB3  LYS  16           HB1      LYS  16  10.599  -8.208 -27.026
  147    HG2  LYS  16           HG2      LYS  16   9.127 -10.013 -27.545
  148    HG3  LYS  16           HG1      LYS  16  10.785 -10.661 -27.729
  149    HD2  LYS  16           HD2      LYS  16  10.546 -11.794 -25.423
  150    HD3  LYS  16           HD1      LYS  16   8.870 -11.156 -25.336
  151    HE2  LYS  16           HE2      LYS  16   8.748 -13.495 -26.056
  152    HE3  LYS  16           HE1      LYS  16   8.346 -12.488 -27.503
  153    HZ1  LYS  16           HZ1      LYS  16  10.719 -12.735 -28.149
  154    HZ2  LYS  16           HZ2      LYS  16   9.837 -14.186 -28.134
  155    HZ3  LYS  16           HZ3      LYS  16  10.925 -13.840 -26.876
  156    H    LYS  17           HN       LYS  17  14.526  -8.591 -26.224
  157    HA   LYS  17           HA       LYS  17  14.153  -5.721 -26.077
  158    HB2  LYS  17           HB2      LYS  17  15.118  -7.198 -23.696
  159    HB3  LYS  17           HB1      LYS  17  16.472  -6.223 -24.346
  160    HG2  LYS  17           HG2      LYS  17  13.731  -4.893 -23.903
  161    HG3  LYS  17           HG1      LYS  17  14.773  -5.245 -22.486
  162    HD2  LYS  17           HD2      LYS  17  16.655  -3.928 -23.641
  163    HD3  LYS  17           HD1      LYS  17  15.480  -3.485 -24.932
  164    HE2  LYS  17           HE2      LYS  17  14.020  -2.335 -23.222
  165    HE3  LYS  17           HE1      LYS  17  15.178  -2.807 -21.912
  166    HZ1  LYS  17           HZ1      LYS  17  16.131  -1.298 -24.262
  167    HZ2  LYS  17           HZ2      LYS  17  16.737  -1.350 -22.676
  168    HZ3  LYS  17           HZ3      LYS  17  15.304  -0.501 -23.011
  Start of MODEL    4
    1    H1   GLU   1           HT1      GLU   1   1.535   7.372 -17.247
    2    H2   GLU   1           HT2      GLU   1   1.099   8.212 -15.838
    3    H3   GLU   1           HT3      GLU   1   0.271   6.794 -16.269
    4    HA   GLU   1           HA       GLU   1   2.798   5.941 -16.195
    5    HB2  GLU   1           HB2      GLU   1   2.377   8.041 -13.956
    6    HB3  GLU   1           HB1      GLU   1   3.617   6.734 -13.839
    7    HG2  GLU   1           HG2      GLU   1   4.752   7.605 -15.929
    8    HG3  GLU   1           HG1      GLU   1   3.521   8.923 -16.044
    9    H    MET   2           HN       MET   2   2.431   3.860 -15.548
   10    HA   MET   2           HA       MET   2   0.593   3.414 -13.278
   11    HB2  MET   2           HB2      MET   2   0.837   1.722 -15.847
   12    HB3  MET   2           HB1      MET   2  -0.113   1.246 -14.393
   13    HG2  MET   2           HG2      MET   2  -1.608   3.241 -14.725
   14    HG3  MET   2           HG1      MET   2  -0.661   3.712 -16.177
   15    HE1  MET   2           HE1      MET   2  -3.748   3.449 -16.192
   16    HE2  MET   2           HE2      MET   2  -4.017   2.604 -17.756
   17    HE3  MET   2           HE3      MET   2  -2.740   3.860 -17.624
   18    H    ARG   3           HN       ARG   3   1.183   1.620 -11.920
   19    HA   ARG   3           HA       ARG   3   4.014   1.004 -12.036
   20    HB2  ARG   3           HB2      ARG   3   1.877   0.263  -9.941
   21    HB3  ARG   3           HB1      ARG   3   3.636  -0.067  -9.762
   22    HG2  ARG   3           HG2      ARG   3   2.374   2.735 -10.022
   23    HG3  ARG   3           HG1      ARG   3   2.824   1.934  -8.478
   24    HD2  ARG   3           HD2      ARG   3   5.256   1.759  -9.384
   25    HD3  ARG   3           HD1      ARG   3   4.735   2.824 -10.761
   26    HE   ARG   3           HE       ARG   3   3.939   4.106  -8.299
   27   HH11  ARG   3          HH11      ARG   3   6.963   3.248 -10.078
   28   HH12  ARG   3          HH12      ARG   3   7.893   4.531  -9.381
   29   HH21  ARG   3          HH21      ARG   3   5.241   5.822  -7.385
   30   HH22  ARG   3          HH22      ARG   3   6.904   6.007  -7.835
   31    H    LEU   4           HN       LEU   4   1.186  -0.418 -13.170
   32    HA   LEU   4           HA       LEU   4   2.198  -3.125 -12.899
   33    HB2  LEU   4           HB2      LEU   4  -0.280  -1.913 -14.224
   34    HB3  LEU   4           HB1      LEU   4   0.106  -3.679 -14.167
   35    HG   LEU   4           HG       LEU   4   0.468  -2.944 -11.523
   36   HD11  LEU   4          HD11      LEU   4  -1.746  -1.113 -12.578
   37   HD12  LEU   4          HD12      LEU   4  -0.336  -0.731 -11.501
   38   HD13  LEU   4          HD13      LEU   4  -1.730  -1.699 -10.867
   39   HD21  LEU   4          HD21      LEU   4  -1.578  -4.256 -11.063
   40   HD22  LEU   4          HD22      LEU   4  -0.655  -4.988 -12.442
   41   HD23  LEU   4          HD23      LEU   4  -2.147  -4.014 -12.761
   42    H    SER   5           HN       SER   5   1.987  -0.455 -15.195
   43    HA   SER   5           HA       SER   5   2.850  -2.077 -17.356
   44    HB2  SER   5           HB2      SER   5   2.871   0.992 -17.185
   45    HB3  SER   5           HB1      SER   5   3.163  -0.017 -18.662
   46    HG   SER   5           HG       SER   5   0.976  -0.929 -17.946
   47    H    LYS   6           HN       LYS   6   4.266  -0.630 -14.511
   48    HA   LYS   6           HA       LYS   6   6.833  -0.390 -15.697
   49    HB2  LYS   6           HB2      LYS   6   6.115   1.277 -14.013
   50    HB3  LYS   6           HB1      LYS   6   5.837  -0.034 -12.838
   51    HG2  LYS   6           HG2      LYS   6   8.656   0.027 -13.874
   52    HG3  LYS   6           HG1      LYS   6   8.158   1.549 -13.053
   53    HD2  LYS   6           HD2      LYS   6   7.478   0.298 -11.032
   54    HD3  LYS   6           HD1      LYS   6   7.801  -1.272 -11.849
   55    HE2  LYS   6           HE2      LYS   6  10.266  -0.698 -11.981
   56    HE3  LYS   6           HE1      LYS   6   9.941   0.894 -11.179
   57    HZ1  LYS   6           HZ1      LYS   6   8.972  -0.474  -9.320
   58    HZ2  LYS   6           HZ2      LYS   6  10.655  -0.554  -9.532
   59    HZ3  LYS   6           HZ3      LYS   6   9.671  -1.837 -10.052
   60    H    PHE   7           HN       PHE   7   4.892  -2.605 -13.700
   61    HA   PHE   7           HA       PHE   7   6.886  -4.346 -12.808
   62    HB2  PHE   7           HB2      PHE   7   3.962  -4.304 -12.774
   63    HB3  PHE   7           HB1      PHE   7   4.488  -5.938 -13.261
   64    HD1  PHE   7           HD1      PHE   7   3.931  -3.721 -10.449
   65    HD2  PHE   7           HD2      PHE   7   6.104  -7.088 -11.904
   66    HE1  PHE   7           HE1      PHE   7   4.347  -4.485  -8.155
   67    HE2  PHE   7           HE2      PHE   7   6.506  -7.828  -9.685
   68    HZ   PHE   7           HZ       PHE   7   5.638  -6.544  -7.742
   69    H    PHE   8           HN       PHE   8   4.544  -4.712 -15.429
   70    HA   PHE   8           HA       PHE   8   5.661  -7.154 -16.212
   71    HB2  PHE   8           HB2      PHE   8   4.570  -5.496 -18.349
   72    HB3  PHE   8           HB1      PHE   8   4.227  -7.189 -17.917
   73    HD1  PHE   8           HD1      PHE   8   3.203  -4.318 -18.711
   74    HD2  PHE   8           HD2      PHE   8   2.588  -7.183 -15.639
   75    HE1  PHE   8           HE1      PHE   8   1.119  -3.500 -18.440
   76    HE2  PHE   8           HE2      PHE   8   0.372  -6.314 -15.340
   77    HZ   PHE   8           HZ       PHE   8  -0.409  -4.476 -16.754
   78    H    ARG   9           HN       ARG   9   6.376  -3.807 -16.868
   79    HA   ARG   9           HA       ARG   9   7.294  -4.004 -19.401
   80    HB2  ARG   9           HB2      ARG   9   6.916  -2.120 -17.600
   81    HB3  ARG   9           HB1      ARG   9   8.619  -2.341 -17.194
   82    HG2  ARG   9           HG2      ARG   9   9.241  -1.635 -19.520
   83    HG3  ARG   9           HG1      ARG   9   7.488  -1.432 -19.899
   84    HD2  ARG   9           HD2      ARG   9   7.298   0.341 -18.033
   85    HD3  ARG   9           HD1      ARG   9   9.087   0.168 -17.739
   86    HE   ARG   9           HE       ARG   9   8.759   0.686 -20.544
   87   HH11  ARG   9          HH11      ARG   9   8.205   2.394 -17.410
   88   HH12  ARG   9          HH12      ARG   9   8.418   3.974 -18.087
   89   HH21  ARG   9          HH21      ARG   9   9.041   2.848 -21.398
   90   HH22  ARG   9          HH22      ARG   9   8.895   4.232 -20.367
   91    H    ASP  10           HN       ASP  10   8.916  -4.580 -16.307
   92    HA   ASP  10           HA       ASP  10  11.325  -5.329 -17.590
   93    HB2  ASP  10           HB2      ASP  10  10.572  -5.318 -14.587
   94    HB3  ASP  10           HB1      ASP  10  12.214  -5.722 -15.219
   95    H    ALA  11           HN       ALA  11   8.347  -6.908 -17.043
   96    HA   ALA  11           HA       ALA  11   9.646  -9.458 -16.366
   97    HB1  ALA  11           HB1      ALA  11   7.503 -10.279 -15.746
   98    HB2  ALA  11           HB2      ALA  11   6.656  -9.055 -16.778
   99    HB3  ALA  11           HB3      ALA  11   7.447  -8.547 -15.238
  100    H    ILE  12           HN       ILE  12   7.599  -7.994 -18.875
  101    HA   ILE  12           HA       ILE  12   7.682 -10.416 -20.472
  102    HB   ILE  12           HB       ILE  12   6.426  -7.675 -20.992
  103   HG12  ILE  12          HG12      ILE  12   5.196 -10.138 -19.610
  104   HG13  ILE  12          HG11      ILE  12   5.610  -8.529 -18.899
  105   HG21  ILE  12          HG21      ILE  12   4.889  -9.039 -22.610
  106   HG22  ILE  12          HG22      ILE  12   5.924 -10.481 -22.311
  107   HG23  ILE  12          HG23      ILE  12   6.611  -9.022 -23.114
  108   HD11  ILE  12          HD11      ILE  12   3.901  -7.417 -20.388
  109   HD12  ILE  12          HD12      ILE  12   3.165  -8.643 -19.285
  110   HD13  ILE  12          HD13      ILE  12   3.402  -9.038 -21.026
  111    H    LEU  13           HN       LEU  13   8.884  -7.058 -20.379
  112    HA   LEU  13           HA       LEU  13   9.729  -7.256 -23.123
  113    HB2  LEU  13           HB2      LEU  13  10.062  -4.940 -21.148
  114    HB3  LEU  13           HB1      LEU  13  10.207  -4.840 -22.956
  115    HG   LEU  13           HG       LEU  13   7.711  -5.295 -21.214
  116   HD11  LEU  13          HD11      LEU  13   8.085  -2.992 -23.223
  117   HD12  LEU  13          HD12      LEU  13   8.698  -2.930 -21.527
  118   HD13  LEU  13          HD13      LEU  13   6.931  -3.145 -21.837
  119   HD21  LEU  13          HD21      LEU  13   7.876  -5.590 -24.298
  120   HD22  LEU  13          HD22      LEU  13   6.346  -5.063 -23.493
  121   HD23  LEU  13          HD23      LEU  13   7.065  -6.659 -23.091
  122    H    GLN  14           HN       GLN  14  11.110  -8.207 -20.164
  123    HA   GLN  14           HA       GLN  14  13.775  -7.371 -21.148
  124    HB2  GLN  14           HB2      GLN  14  12.810  -8.683 -18.594
  125    HB3  GLN  14           HB1      GLN  14  14.552  -8.822 -19.069
  126    HG2  GLN  14           HG2      GLN  14  14.302  -6.158 -19.427
  127    HG3  GLN  14           HG1      GLN  14  12.903  -6.385 -18.337
  128   HE21  GLN  14          HE21      GLN  14  13.396  -7.564 -16.142
  129   HE22  GLN  14          HE22      GLN  14  14.948  -7.299 -15.418
  130    H    ARG  15           HN       ARG  15  11.419  -9.743 -21.584
  131    HA   ARG  15           HA       ARG  15  13.264 -11.897 -22.146
  132    HB2  ARG  15           HB2      ARG  15  10.366 -11.609 -23.107
  133    HB3  ARG  15           HB1      ARG  15  11.303 -13.135 -22.899
  134    HG2  ARG  15           HG2      ARG  15  11.367 -12.726 -20.409
  135    HG3  ARG  15           HG1      ARG  15  10.437 -11.201 -20.673
  136    HD2  ARG  15           HD2      ARG  15   8.861 -12.876 -19.924
  137    HD3  ARG  15           HD1      ARG  15   8.550 -12.608 -21.690
  138    HE   ARG  15           HE       ARG  15  10.408 -14.823 -21.364
  139   HH11  ARG  15          HH11      ARG  15   6.920 -14.022 -20.868
  140   HH12  ARG  15          HH12      ARG  15   6.383 -15.657 -21.065
  141   HH21  ARG  15          HH21      ARG  15   9.624 -17.010 -21.624
  142   HH22  ARG  15          HH22      ARG  15   7.933 -17.367 -21.498
  143    H    LYS  16           HN       LYS  16  11.348  -9.438 -23.932
  144    HA   LYS  16           HA       LYS  16  12.898 -10.054 -26.360
  145    HB2  LYS  16           HB2      LYS  16  10.185  -8.746 -25.759
  146    HB3  LYS  16           HB1      LYS  16  11.037  -8.350 -27.291
  147    HG2  LYS  16           HG2      LYS  16   9.540 -10.079 -27.871
  148    HG3  LYS  16           HG1      LYS  16  11.132 -10.891 -27.774
  149    HD2  LYS  16           HD2      LYS  16  10.524 -11.863 -25.522
  150    HD3  LYS  16           HD1      LYS  16   8.975 -10.949 -25.545
  151    HE2  LYS  16           HE2      LYS  16   8.408 -13.222 -26.183
  152    HE3  LYS  16           HE1      LYS  16   8.369 -12.284 -27.729
  153    HZ1  LYS  16           HZ1      LYS  16  10.841 -13.664 -26.872
  154    HZ2  LYS  16           HZ2      LYS  16  10.310 -13.248 -28.431
  155    HZ3  LYS  16           HZ3      LYS  16   9.575 -14.533 -27.598
  156    H    LYS  17           HN       LYS  17  14.850  -8.893 -26.173
  157    HA   LYS  17           HA       LYS  17  14.627  -6.000 -26.165
  158    HB2  LYS  17           HB2      LYS  17  15.488  -7.476 -23.692
  159    HB3  LYS  17           HB1      LYS  17  16.777  -6.382 -24.280
  160    HG2  LYS  17           HG2      LYS  17  13.935  -5.253 -23.999
  161    HG3  LYS  17           HG1      LYS  17  14.864  -5.583 -22.500
  162    HD2  LYS  17           HD2      LYS  17  16.746  -4.116 -23.405
  163    HD3  LYS  17           HD1      LYS  17  15.728  -3.747 -24.842
  164    HE2  LYS  17           HE2      LYS  17  13.995  -2.674 -23.373
  165    HE3  LYS  17           HE1      LYS  17  14.958  -3.099 -21.899
  166    HZ1  LYS  17           HZ1      LYS  17  16.493  -1.692 -23.874
  167    HZ2  LYS  17           HZ2      LYS  17  16.256  -1.369 -22.223
  168    HZ3  LYS  17           HZ3      LYS  17  15.130  -0.816 -23.366
  Start of MODEL    5
    1    H1   GLU   1           HT1      GLU   1   1.229   7.028 -17.252
    2    H2   GLU   1           HT2      GLU   1   1.496   8.339 -16.207
    3    H3   GLU   1           HT3      GLU   1   0.258   7.226 -15.872
    4    HA   GLU   1           HA       GLU   1   2.827   6.017 -16.173
    5    HB2  GLU   1           HB2      GLU   1   2.320   8.054 -13.895
    6    HB3  GLU   1           HB1      GLU   1   3.556   6.746 -13.763
    7    HG2  GLU   1           HG2      GLU   1   4.770   7.669 -15.785
    8    HG3  GLU   1           HG1      GLU   1   3.541   8.985 -15.919
    9    H    MET   2           HN       MET   2   2.466   3.917 -15.590
   10    HA   MET   2           HA       MET   2   0.552   3.392 -13.401
   11    HB2  MET   2           HB2      MET   2   0.904   1.769 -16.003
   12    HB3  MET   2           HB1      MET   2  -0.085   1.243 -14.591
   13    HG2  MET   2           HG2      MET   2  -1.597   3.226 -14.916
   14    HG3  MET   2           HG1      MET   2  -0.613   3.753 -16.322
   15    HE1  MET   2           HE1      MET   2  -3.722   3.405 -16.382
   16    HE2  MET   2           HE2      MET   2  -3.940   2.631 -17.989
   17    HE3  MET   2           HE3      MET   2  -2.709   3.924 -17.775
   18    H    ARG   3           HN       ARG   3   1.107   1.590 -12.060
   19    HA   ARG   3           HA       ARG   3   3.944   0.981 -12.082
   20    HB2  ARG   3           HB2      ARG   3   1.732   0.231 -10.069
   21    HB3  ARG   3           HB1      ARG   3   3.482  -0.125  -9.835
   22    HG2  ARG   3           HG2      ARG   3   2.283   2.703 -10.130
   23    HG3  ARG   3           HG1      ARG   3   2.623   1.882  -8.567
   24    HD2  ARG   3           HD2      ARG   3   5.098   1.661  -9.318
   25    HD3  ARG   3           HD1      ARG   3   4.689   2.723 -10.735
   26    HE   ARG   3           HE       ARG   3   3.760   4.044  -8.345
   27   HH11  ARG   3          HH11      ARG   3   6.880   3.092  -9.888
   28   HH12  ARG   3          HH12      ARG   3   7.783   4.373  -9.153
   29   HH21  ARG   3          HH21      ARG   3   5.032   5.750  -7.374
   30   HH22  ARG   3          HH22      ARG   3   6.725   5.892  -7.714
   31    H    LEU   4           HN       LEU   4   1.157  -0.439 -13.321
   32    HA   LEU   4           HA       LEU   4   2.185  -3.140 -13.039
   33    HB2  LEU   4           HB2      LEU   4  -0.273  -1.948 -14.410
   34    HB3  LEU   4           HB1      LEU   4   0.135  -3.711 -14.366
   35    HG   LEU   4           HG       LEU   4   0.435  -3.007 -11.708
   36   HD11  LEU   4          HD11      LEU   4  -1.788  -1.196 -12.772
   37   HD12  LEU   4          HD12      LEU   4  -0.381  -0.795 -11.697
   38   HD13  LEU   4          HD13      LEU   4  -1.760  -1.784 -11.062
   39   HD21  LEU   4          HD21      LEU   4  -2.156  -4.075 -12.995
   40   HD22  LEU   4          HD22      LEU   4  -1.601  -4.343 -11.297
   41   HD23  LEU   4          HD23      LEU   4  -0.664  -5.048 -12.679
   42    H    SER   5           HN       SER   5   2.029  -0.456 -15.313
   43    HA   SER   5           HA       SER   5   2.945  -2.063 -17.459
   44    HB2  SER   5           HB2      SER   5   2.987   0.998 -17.251
   45    HB3  SER   5           HB1      SER   5   3.322   0.004 -18.730
   46    HG   SER   5           HG       SER   5   1.070  -0.874 -17.947
   47    H    LYS   6           HN       LYS   6   4.279  -0.628 -14.568
   48    HA   LYS   6           HA       LYS   6   6.888  -0.401 -15.655
   49    HB2  LYS   6           HB2      LYS   6   6.108   1.252 -13.981
   50    HB3  LYS   6           HB1      LYS   6   5.789  -0.072 -12.829
   51    HG2  LYS   6           HG2      LYS   6   8.641  -0.003 -13.771
   52    HG3  LYS   6           HG1      LYS   6   8.121   1.511 -12.951
   53    HD2  LYS   6           HD2      LYS   6   7.386   0.251 -10.961
   54    HD3  LYS   6           HD1      LYS   6   7.704  -1.316 -11.784
   55    HE2  LYS   6           HE2      LYS   6  10.182  -0.775 -11.854
   56    HE3  LYS   6           HE1      LYS   6   9.859   0.808 -11.032
   57    HZ1  LYS   6           HZ1      LYS   6   9.968  -1.875  -9.961
   58    HZ2  LYS   6           HZ2      LYS   6   8.656  -0.954  -9.399
   59    HZ3  LYS   6           HZ3      LYS   6  10.241  -0.373  -9.218
   60    H    PHE   7           HN       PHE   7   4.865  -2.630 -13.760
   61    HA   PHE   7           HA       PHE   7   6.817  -4.383 -12.799
   62    HB2  PHE   7           HB2      PHE   7   3.900  -4.316 -12.866
   63    HB3  PHE   7           HB1      PHE   7   4.422  -5.950 -13.351
   64    HD1  PHE   7           HD1      PHE   7   3.802  -3.750 -10.533
   65    HD2  PHE   7           HD2      PHE   7   5.972  -7.134 -11.954
   66    HE1  PHE   7           HE1      PHE   7   4.129  -4.546  -8.235
   67    HE2  PHE   7           HE2      PHE   7   6.291  -7.904  -9.732
   68    HZ   PHE   7           HZ       PHE   7   5.376  -6.628  -7.802
   69    H    PHE   8           HN       PHE   8   4.582  -4.710 -15.517
   70    HA   PHE   8           HA       PHE   8   5.717  -7.161 -16.266
   71    HB2  PHE   8           HB2      PHE   8   4.697  -5.508 -18.435
   72    HB3  PHE   8           HB1      PHE   8   4.324  -7.196 -17.998
   73    HD1  PHE   8           HD1      PHE   8   3.373  -4.320 -18.843
   74    HD2  PHE   8           HD2      PHE   8   2.604  -7.156 -15.779
   75    HE1  PHE   8           HE1      PHE   8   1.301  -3.457 -18.647
   76    HE2  PHE   8           HE2      PHE   8   0.390  -6.245 -15.559
   77    HZ   PHE   8           HZ       PHE   8  -0.303  -4.394 -17.008
   78    H    ARG   9           HN       ARG   9   6.500  -3.823 -16.835
   79    HA   ARG   9           HA       ARG   9   7.490  -3.992 -19.357
   80    HB2  ARG   9           HB2      ARG   9   7.081  -2.143 -17.501
   81    HB3  ARG   9           HB1      ARG   9   8.790  -2.365 -17.112
   82    HG2  ARG   9           HG2      ARG   9   9.405  -1.603 -19.407
   83    HG3  ARG   9           HG1      ARG   9   7.651  -1.437 -19.808
   84    HD2  ARG   9           HD2      ARG   9   7.407   0.291 -17.891
   85    HD3  ARG   9           HD1      ARG   9   9.208   0.179 -17.635
   86    HE   ARG   9           HE       ARG   9   8.823   0.726 -20.417
   87   HH11  ARG   9          HH11      ARG   9   8.157   2.354 -17.265
   88   HH12  ARG   9          HH12      ARG   9   8.295   3.954 -17.914
   89   HH21  ARG   9          HH21      ARG   9   9.001   2.907 -21.241
   90   HH22  ARG   9          HH22      ARG   9   8.779   4.269 -20.194
   91    H    ASP  10           HN       ASP  10   8.972  -4.622 -16.215
   92    HA   ASP  10           HA       ASP  10  11.445  -5.406 -17.375
   93    HB2  ASP  10           HB2      ASP  10  10.511  -5.410 -14.420
   94    HB3  ASP  10           HB1      ASP  10  12.181  -5.820 -14.953
   95    H    ALA  11           HN       ALA  11   8.402  -6.927 -17.024
   96    HA   ALA  11           HA       ALA  11   9.633  -9.511 -16.346
   97    HB1  ALA  11           HB1      ALA  11   7.400  -8.621 -15.272
   98    HB2  ALA  11           HB2      ALA  11   7.465 -10.336 -15.842
   99    HB3  ALA  11           HB3      ALA  11   6.666  -9.071 -16.859
  100    H    ILE  12           HN       ILE  12   7.643  -7.992 -18.878
  101    HA   ILE  12           HA       ILE  12   7.798 -10.374 -20.517
  102    HB   ILE  12           HB       ILE  12   6.615  -7.606 -21.078
  103   HG12  ILE  12          HG12      ILE  12   5.246 -10.057 -19.808
  104   HG13  ILE  12          HG11      ILE  12   5.687  -8.484 -19.032
  105   HG21  ILE  12          HG21      ILE  12   6.866  -8.894 -23.209
  106   HG22  ILE  12          HG22      ILE  12   5.130  -8.998 -22.772
  107   HG23  ILE  12          HG23      ILE  12   6.218 -10.402 -22.460
  108   HD11  ILE  12          HD11      ILE  12   4.107  -7.259 -20.557
  109   HD12  ILE  12          HD12      ILE  12   3.258  -8.501 -19.559
  110   HD13  ILE  12          HD13      ILE  12   3.590  -8.829 -21.300
  111    H    LEU  13           HN       LEU  13   9.043  -7.033 -20.321
  112    HA   LEU  13           HA       LEU  13  10.012  -7.208 -23.008
  113    HB2  LEU  13           HB2      LEU  13  10.362  -4.945 -20.994
  114    HB3  LEU  13           HB1      LEU  13  10.588  -4.826 -22.793
  115    HG   LEU  13           HG       LEU  13   8.011  -5.204 -21.162
  116   HD11  LEU  13          HD11      LEU  13   8.546  -2.904 -23.137
  117   HD12  LEU  13          HD12      LEU  13   9.112  -2.875 -21.424
  118   HD13  LEU  13          HD13      LEU  13   7.346  -3.018 -21.785
  119   HD21  LEU  13          HD21      LEU  13   8.276  -5.453 -24.243
  120   HD22  LEU  13          HD22      LEU  13   6.736  -4.908 -23.471
  121   HD23  LEU  13          HD23      LEU  13   7.404  -6.529 -23.085
  122    H    GLN  14           HN       GLN  14  11.152  -8.317 -20.077
  123    HA   GLN  14           HA       GLN  14  13.917  -7.582 -20.778
  124    HB2  GLN  14           HB2      GLN  14  12.547  -8.857 -18.420
  125    HB3  GLN  14           HB1      GLN  14  14.257  -9.352 -18.735
  126    HG2  GLN  14           HG2      GLN  14  14.636  -6.691 -18.979
  127    HG3  GLN  14           HG1      GLN  14  13.077  -6.616 -18.090
  128   HE21  GLN  14          HE21      GLN  14  16.373  -8.243 -17.906
  129   HE22  GLN  14          HE22      GLN  14  16.490  -8.205 -16.179
  130    H    ARG  15           HN       ARG  15  11.472  -9.774 -21.584
  131    HA   ARG  15           HA       ARG  15  13.345 -11.910 -22.296
  132    HB2  ARG  15           HB2      ARG  15  10.372 -11.704 -23.016
  133    HB3  ARG  15           HB1      ARG  15  11.379 -13.195 -22.889
  134    HG2  ARG  15           HG2      ARG  15  11.540 -12.919 -20.431
  135    HG3  ARG  15           HG1      ARG  15  10.679 -11.330 -20.545
  136    HD2  ARG  15           HD2      ARG  15   8.600 -12.342 -21.177
  137    HD3  ARG  15           HD1      ARG  15   9.359 -13.968 -21.489
  138    HE   ARG  15           HE       ARG  15   9.884 -13.307 -18.753
  139   HH11  ARG  15          HH11      ARG  15   6.999 -13.967 -20.825
  140   HH12  ARG  15          HH12      ARG  15   6.027 -14.541 -19.511
  141   HH21  ARG  15          HH21      ARG  15   8.515 -14.086 -17.016
  142   HH22  ARG  15          HH22      ARG  15   6.894 -14.607 -17.334
  143    H    LYS  16           HN       LYS  16  11.137  -9.475 -23.862
  144    HA   LYS  16           HA       LYS  16  12.690  -9.927 -26.325
  145    HB2  LYS  16           HB2      LYS  16  10.102  -8.277 -26.200
  146    HB3  LYS  16           HB1      LYS  16  10.878  -9.052 -27.622
  147    HG2  LYS  16           HG2      LYS  16   9.367 -10.441 -25.328
  148    HG3  LYS  16           HG1      LYS  16   8.810 -10.220 -27.012
  149    HD2  LYS  16           HD2      LYS  16  10.910 -11.707 -27.675
  150    HD3  LYS  16           HD1      LYS  16  10.994 -12.116 -25.914
  151    HE2  LYS  16           HE2      LYS  16   8.644 -13.024 -26.006
  152    HE3  LYS  16           HE1      LYS  16   8.546 -12.618 -27.770
  153    HZ1  LYS  16           HZ1      LYS  16   9.552 -14.913 -26.579
  154    HZ2  LYS  16           HZ2      LYS  16  10.892 -14.107 -27.240
  155    HZ3  LYS  16           HZ3      LYS  16   9.562 -14.490 -28.224
  156    H    LYS  17           HN       LYS  17  14.455  -8.651 -26.305
  157    HA   LYS  17           HA       LYS  17  14.065  -5.777 -26.179
  158    HB2  LYS  17           HB2      LYS  17  15.141  -7.223 -23.817
  159    HB3  LYS  17           HB1      LYS  17  16.437  -6.206 -24.518
  160    HG2  LYS  17           HG2      LYS  17  13.674  -4.950 -23.990
  161    HG3  LYS  17           HG1      LYS  17  14.752  -5.289 -22.597
  162    HD2  LYS  17           HD2      LYS  17  16.577  -3.915 -23.751
  163    HD3  LYS  17           HD1      LYS  17  15.394  -3.506 -25.045
  164    HE2  LYS  17           HE2      LYS  17  13.897  -2.393 -23.339
  165    HE3  LYS  17           HE1      LYS  17  15.072  -2.825 -22.027
  166    HZ1  LYS  17           HZ1      LYS  17  15.714  -0.743 -22.532
  167    HZ2  LYS  17           HZ2      LYS  17  15.274  -0.832 -24.170
  168    HZ3  LYS  17           HZ3      LYS  17  16.703  -1.577 -23.632
  Start of MODEL    6
    1    H1   GLU   1           HT1      GLU   1   3.352   7.874 -14.585
    2    H2   GLU   1           HT2      GLU   1   3.767   6.426 -15.370
    3    H3   GLU   1           HT3      GLU   1   3.264   6.398 -13.748
    4    HA   GLU   1           HA       GLU   1   1.187   7.588 -14.807
    5    HB2  GLU   1           HB2      GLU   1   2.384   5.767 -16.999
    6    HB3  GLU   1           HB1      GLU   1   0.616   6.120 -16.937
    7    HG2  GLU   1           HG2      GLU   1   1.074   8.592 -17.159
    8    HG3  GLU   1           HG1      GLU   1   2.851   8.266 -17.206
    9    H    MET   2           HN       MET   2   2.285   4.124 -15.409
   10    HA   MET   2           HA       MET   2   0.390   3.290 -13.299
   11    HB2  MET   2           HB2      MET   2   0.885   1.895 -16.007
   12    HB3  MET   2           HB1      MET   2  -0.049   1.179 -14.641
   13    HG2  MET   2           HG2      MET   2  -1.729   3.039 -14.808
   14    HG3  MET   2           HG1      MET   2  -0.805   3.759 -16.170
   15    HE1  MET   2           HE1      MET   2  -3.882   3.122 -16.219
   16    HE2  MET   2           HE2      MET   2  -4.052   2.486 -17.891
   17    HE3  MET   2           HE3      MET   2  -2.946   3.865 -17.563
   18    H    ARG   3           HN       ARG   3   1.093   1.584 -11.988
   19    HA   ARG   3           HA       ARG   3   3.952   1.069 -12.088
   20    HB2  ARG   3           HB2      ARG   3   1.870   0.201  -9.982
   21    HB3  ARG   3           HB1      ARG   3   3.658   0.063  -9.808
   22    HG2  ARG   3           HG2      ARG   3   2.034   2.675 -10.025
   23    HG3  ARG   3           HG1      ARG   3   2.741   1.976  -8.528
   24    HD2  ARG   3           HD2      ARG   3   5.083   2.175  -9.674
   25    HD3  ARG   3           HD1      ARG   3   4.258   3.138 -10.975
   26    HE   ARG   3           HE       ARG   3   3.523   4.257  -8.409
   27   HH11  ARG   3          HH11      ARG   3   6.418   3.961 -10.546
   28   HH12  ARG   3          HH12      ARG   3   7.152   5.421  -9.971
   29   HH21  ARG   3          HH21      ARG   3   4.563   6.221  -7.670
   30   HH22  ARG   3          HH22      ARG   3   6.089   6.712  -8.325
   31    H    LEU   4           HN       LEU   4   1.182  -0.409 -13.265
   32    HA   LEU   4           HA       LEU   4   2.236  -3.099 -12.981
   33    HB2  LEU   4           HB2      LEU   4  -0.221  -1.965 -14.409
   34    HB3  LEU   4           HB1      LEU   4   0.203  -3.717 -14.271
   35    HG   LEU   4           HG       LEU   4   0.424  -2.885 -11.639
   36   HD11  LEU   4          HD11      LEU   4  -1.811  -1.175 -12.857
   37   HD12  LEU   4          HD12      LEU   4  -0.436  -0.679 -11.783
   38   HD13  LEU   4          HD13      LEU   4  -1.802  -1.663 -11.116
   39   HD21  LEU   4          HD21      LEU   4  -1.619  -4.222 -11.232
   40   HD22  LEU   4          HD22      LEU   4  -0.620  -4.984 -12.537
   41   HD23  LEU   4          HD23      LEU   4  -2.109  -4.051 -12.963
   42    H    SER   5           HN       SER   5   2.054  -0.411 -15.263
   43    HA   SER   5           HA       SER   5   2.980  -2.002 -17.422
   44    HB2  SER   5           HB2      SER   5   2.992   1.062 -17.203
   45    HB3  SER   5           HB1      SER   5   3.321   0.077 -18.688
   46    HG   SER   5           HG       SER   5   0.982  -0.573 -17.443
   47    H    LYS   6           HN       LYS   6   4.314  -0.594 -14.524
   48    HA   LYS   6           HA       LYS   6   6.915  -0.337 -15.630
   49    HB2  LYS   6           HB2      LYS   6   6.161   1.311 -13.954
   50    HB3  LYS   6           HB1      LYS   6   5.814  -0.008 -12.807
   51    HG2  LYS   6           HG2      LYS   6   8.679   0.029 -13.710
   52    HG3  LYS   6           HG1      LYS   6   8.161   1.549 -12.903
   53    HD2  LYS   6           HD2      LYS   6   7.346   0.267 -10.933
   54    HD3  LYS   6           HD1      LYS   6   7.755  -1.284 -11.744
   55    HE2  LYS   6           HE2      LYS   6  10.206  -0.675 -11.705
   56    HE3  LYS   6           HE1      LYS   6   9.808   0.918 -10.940
   57    HZ1  LYS   6           HZ1      LYS   6   8.999  -1.657  -9.712
   58    HZ2  LYS   6           HZ2      LYS   6   9.155  -0.123  -8.997
   59    HZ3  LYS   6           HZ3      LYS   6  10.541  -0.984  -9.468
   60    H    PHE   7           HN       PHE   7   4.916  -2.587 -13.731
   61    HA   PHE   7           HA       PHE   7   6.889  -4.340 -12.808
   62    HB2  PHE   7           HB2      PHE   7   3.971  -4.279 -12.826
   63    HB3  PHE   7           HB1      PHE   7   4.494  -5.910 -13.323
   64    HD1  PHE   7           HD1      PHE   7   3.955  -3.693 -10.495
   65    HD2  PHE   7           HD2      PHE   7   6.042  -7.108 -11.960
   66    HE1  PHE   7           HE1      PHE   7   4.339  -4.481  -8.203
   67    HE2  PHE   7           HE2      PHE   7   6.415  -7.873  -9.746
   68    HZ   PHE   7           HZ       PHE   7   5.571  -6.578  -7.796
   69    H    PHE   8           HN       PHE   8   4.604  -4.664 -15.481
   70    HA   PHE   8           HA       PHE   8   5.711  -7.116 -16.262
   71    HB2  PHE   8           HB2      PHE   8   4.676  -5.428 -18.402
   72    HB3  PHE   8           HB1      PHE   8   4.307  -7.124 -17.992
   73    HD1  PHE   8           HD1      PHE   8   3.324  -4.247 -18.790
   74    HD2  PHE   8           HD2      PHE   8   2.629  -7.109 -15.732
   75    HE1  PHE   8           HE1      PHE   8   1.249  -3.400 -18.550
   76    HE2  PHE   8           HE2      PHE   8   0.417  -6.215 -15.466
   77    HZ   PHE   8           HZ       PHE   8  -0.318  -4.361 -16.891
   78    H    ARG   9           HN       ARG   9   6.486  -3.779 -16.847
   79    HA   ARG   9           HA       ARG   9   7.436  -3.942 -19.372
   80    HB2  ARG   9           HB2      ARG   9   7.002  -2.082 -17.612
   81    HB3  ARG   9           HB1      ARG   9   8.653  -2.353 -17.048
   82    HG2  ARG   9           HG2      ARG   9   9.498  -1.638 -19.310
   83    HG3  ARG   9           HG1      ARG   9   7.787  -1.327 -19.801
   84    HD2  ARG   9           HD2      ARG   9   7.537   0.393 -17.923
   85    HD3  ARG   9           HD1      ARG   9   9.263   0.080 -17.429
   86    HE   ARG   9           HE       ARG   9   9.210   0.755 -20.251
   87   HH11  ARG   9          HH11      ARG   9   8.715   2.296 -17.023
   88   HH12  ARG   9          HH12      ARG   9   9.219   3.866 -17.552
   89   HH21  ARG   9          HH21      ARG   9   9.888   2.894 -20.905
   90   HH22  ARG   9          HH22      ARG   9   9.891   4.207 -19.776
   91    H    ASP  10           HN       ASP  10   9.017  -4.548 -16.264
   92    HA   ASP  10           HA       ASP  10  11.442  -5.347 -17.491
   93    HB2  ASP  10           HB2      ASP  10  10.574  -5.289 -14.518
   94    HB3  ASP  10           HB1      ASP  10  12.215  -5.799 -15.059
   95    H    ALA  11           HN       ALA  11   8.414  -6.875 -17.061
   96    HA   ALA  11           HA       ALA  11   9.657  -9.457 -16.404
   97    HB1  ALA  11           HB1      ALA  11   6.684  -9.017 -16.883
   98    HB2  ALA  11           HB2      ALA  11   7.436  -8.564 -15.307
   99    HB3  ALA  11           HB3      ALA  11   7.497 -10.281 -15.873
  100    H    ILE  12           HN       ILE  12   7.623  -7.948 -18.911
  101    HA   ILE  12           HA       ILE  12   7.737 -10.335 -20.539
  102    HB   ILE  12           HB       ILE  12   6.531  -7.575 -21.075
  103   HG12  ILE  12          HG12      ILE  12   5.213 -10.032 -19.762
  104   HG13  ILE  12          HG11      ILE  12   5.657  -8.450 -19.005
  105   HG21  ILE  12          HG21      ILE  12   6.107 -10.375 -22.444
  106   HG22  ILE  12          HG22      ILE  12   6.740  -8.871 -23.212
  107   HG23  ILE  12          HG23      ILE  12   5.014  -8.970 -22.734
  108   HD11  ILE  12          HD11      ILE  12   3.216  -8.498 -19.474
  109   HD12  ILE  12          HD12      ILE  12   3.509  -8.829 -21.220
  110   HD13  ILE  12          HD13      ILE  12   4.027  -7.250 -20.495
  111    H    LEU  13           HN       LEU  13   8.962  -6.993 -20.407
  112    HA   LEU  13           HA       LEU  13   9.846  -7.154 -23.121
  113    HB2  LEU  13           HB2      LEU  13  10.259  -4.914 -21.091
  114    HB3  LEU  13           HB1      LEU  13  10.429  -4.771 -22.895
  115    HG   LEU  13           HG       LEU  13   7.903  -5.171 -21.188
  116   HD11  LEU  13          HD11      LEU  13   7.208  -2.979 -21.782
  117   HD12  LEU  13          HD12      LEU  13   8.392  -2.844 -23.145
  118   HD13  LEU  13          HD13      LEU  13   8.975  -2.840 -21.437
  119   HD21  LEU  13          HD21      LEU  13   6.565  -4.837 -23.469
  120   HD22  LEU  13          HD22      LEU  13   7.218  -6.469 -23.093
  121   HD23  LEU  13          HD23      LEU  13   8.079  -5.409 -24.274
  122    H    GLN  14           HN       GLN  14  11.072  -8.288 -20.249
  123    HA   GLN  14           HA       GLN  14  13.825  -7.557 -21.014
  124    HB2  GLN  14           HB2      GLN  14  12.492  -8.747 -18.593
  125    HB3  GLN  14           HB1      GLN  14  14.187  -9.270 -18.927
  126    HG2  GLN  14           HG2      GLN  14  14.597  -6.622 -19.243
  127    HG3  GLN  14           HG1      GLN  14  13.055  -6.505 -18.328
  128   HE21  GLN  14          HE21      GLN  14  16.309  -8.225 -18.160
  129   HE22  GLN  14          HE22      GLN  14  16.466  -8.130 -16.440
  130    H    ARG  15           HN       ARG  15  11.357  -9.801 -21.668
  131    HA   ARG  15           HA       ARG  15  13.174 -12.012 -22.201
  132    HB2  ARG  15           HB2      ARG  15  10.267 -11.674 -23.128
  133    HB3  ARG  15           HB1      ARG  15  11.187 -13.217 -22.947
  134    HG2  ARG  15           HG2      ARG  15  11.280 -12.886 -20.475
  135    HG3  ARG  15           HG1      ARG  15  10.443 -11.291 -20.668
  136    HD2  ARG  15           HD2      ARG  15   8.383 -12.301 -21.373
  137    HD3  ARG  15           HD1      ARG  15   9.136 -13.947 -21.585
  138    HE   ARG  15           HE       ARG  15   9.544 -13.185 -18.857
  139   HH11  ARG  15          HH11      ARG  15   6.731 -13.878 -21.020
  140   HH12  ARG  15          HH12      ARG  15   5.709 -14.412 -19.728
  141   HH21  ARG  15          HH21      ARG  15   8.112 -13.910 -17.158
  142   HH22  ARG  15          HH22      ARG  15   6.500 -14.429 -17.519
  143    H    LYS  16           HN       LYS  16  11.253  -9.561 -24.079
  144    HA   LYS  16           HA       LYS  16  12.977 -10.241 -26.370
  145    HB2  LYS  16           HB2      LYS  16  10.552  -8.377 -26.589
  146    HB3  LYS  16           HB1      LYS  16  11.351  -9.356 -27.863
  147    HG2  LYS  16           HG2      LYS  16   9.524 -10.366 -25.601
  148    HG3  LYS  16           HG1      LYS  16   9.125 -10.244 -27.339
  149    HD2  LYS  16           HD2      LYS  16  11.195 -11.971 -27.614
  150    HD3  LYS  16           HD1      LYS  16  10.892 -12.280 -25.856
  151    HE2  LYS  16           HE2      LYS  16   8.517 -12.930 -26.369
  152    HE3  LYS  16           HE1      LYS  16   8.782 -12.583 -28.127
  153    HZ1  LYS  16           HZ1      LYS  16   9.078 -14.840 -27.906
  154    HZ2  LYS  16           HZ2      LYS  16   9.941 -14.728 -26.448
  155    HZ3  LYS  16           HZ3      LYS  16  10.673 -14.257 -27.906
  156    H    LYS  17           HN       LYS  17  14.823  -9.101 -26.218
  157    HA   LYS  17           HA       LYS  17  14.689  -6.225 -26.303
  158    HB2  LYS  17           HB2      LYS  17  15.253  -7.532 -23.685
  159    HB3  LYS  17           HB1      LYS  17  16.716  -6.660 -24.240
  160    HG2  LYS  17           HG2      LYS  17  13.962  -5.255 -24.191
  161    HG3  LYS  17           HG1      LYS  17  14.926  -5.427 -22.686
  162    HD2  LYS  17           HD2      LYS  17  16.864  -4.238 -23.835
  163    HD3  LYS  17           HD1      LYS  17  15.843  -4.023 -25.300
  164    HE2  LYS  17           HE2      LYS  17  14.205  -2.641 -23.962
  165    HE3  LYS  17           HE1      LYS  17  15.229  -2.860 -22.484
  166    HZ1  LYS  17           HZ1      LYS  17  17.047  -1.918 -24.101
  167    HZ2  LYS  17           HZ2      LYS  17  15.984  -0.899 -23.256
  168    HZ3  LYS  17           HZ3      LYS  17  15.700  -1.253 -24.893
  Start of MODEL    7
    1    H1   GLU   1           HT1      GLU   1   0.350   6.658 -16.546
    2    H2   GLU   1           HT2      GLU   1   1.616   7.553 -17.242
    3    H3   GLU   1           HT3      GLU   1   0.876   8.098 -15.814
    4    HA   GLU   1           HA       GLU   1   2.821   5.977 -16.235
    5    HB2  GLU   1           HB2      GLU   1   2.301   8.118 -14.060
    6    HB3  GLU   1           HB1      GLU   1   3.553   6.835 -13.856
    7    HG2  GLU   1           HG2      GLU   1   4.756   7.646 -15.925
    8    HG3  GLU   1           HG1      GLU   1   3.503   8.928 -16.157
    9    H    MET   2           HN       MET   2   2.459   3.885 -15.612
   10    HA   MET   2           HA       MET   2   0.610   3.409 -13.355
   11    HB2  MET   2           HB2      MET   2   0.867   1.752 -15.950
   12    HB3  MET   2           HB1      MET   2  -0.076   1.244 -14.500
   13    HG2  MET   2           HG2      MET   2  -1.579   3.242 -14.783
   14    HG3  MET   2           HG1      MET   2  -0.645   3.743 -16.231
   15    HE1  MET   2           HE1      MET   2  -2.778   3.926 -17.625
   16    HE2  MET   2           HE2      MET   2  -3.737   3.463 -16.176
   17    HE3  MET   2           HE3      MET   2  -4.048   2.659 -17.753
   18    H    ARG   3           HN       ARG   3   1.180   1.607 -12.012
   19    HA   ARG   3           HA       ARG   3   4.013   0.996 -12.086
   20    HB2  ARG   3           HB2      ARG   3   1.849   0.236 -10.024
   21    HB3  ARG   3           HB1      ARG   3   3.612  -0.072  -9.820
   22    HG2  ARG   3           HG2      ARG   3   2.300   2.709 -10.085
   23    HG3  ARG   3           HG1      ARG   3   2.773   1.917  -8.544
   24    HD2  ARG   3           HD2      ARG   3   5.208   1.811  -9.450
   25    HD3  ARG   3           HD1      ARG   3   4.657   2.856 -10.831
   26    HE   ARG   3           HE       ARG   3   3.821   4.113  -8.367
   27   HH11  ARG   3          HH11      ARG   3   6.876   3.360 -10.139
   28   HH12  ARG   3          HH12      ARG   3   7.747   4.695  -9.464
   29   HH21  ARG   3          HH21      ARG   3   5.051   5.896  -7.484
   30   HH22  ARG   3          HH22      ARG   3   6.703   6.145  -7.941
   31    H    LEU   4           HN       LEU   4   1.206  -0.434 -13.271
   32    HA   LEU   4           HA       LEU   4   2.239  -3.131 -12.984
   33    HB2  LEU   4           HB2      LEU   4  -0.234  -1.970 -14.354
   34    HB3  LEU   4           HB1      LEU   4   0.178  -3.729 -14.260
   35    HG   LEU   4           HG       LEU   4   0.479  -2.956 -11.621
   36   HD11  LEU   4          HD11      LEU   4  -0.336  -0.744 -11.653
   37   HD12  LEU   4          HD12      LEU   4  -1.731  -1.713 -11.020
   38   HD13  LEU   4          HD13      LEU   4  -1.730  -1.156 -12.739
   39   HD21  LEU   4          HD21      LEU   4  -2.112  -4.052 -12.891
   40   HD22  LEU   4          HD22      LEU   4  -1.572  -4.269 -11.180
   41   HD23  LEU   4          HD23      LEU   4  -0.624  -5.019 -12.531
   42    H    SER   5           HN       SER   5   2.031  -0.466 -15.286
   43    HA   SER   5           HA       SER   5   2.929  -2.081 -17.436
   44    HB2  SER   5           HB2      SER   5   2.951   0.985 -17.248
   45    HB3  SER   5           HB1      SER   5   3.259  -0.019 -18.727
   46    HG   SER   5           HG       SER   5   0.964  -0.758 -17.574
   47    H    LYS   6           HN       LYS   6   4.304  -0.626 -14.579
   48    HA   LYS   6           HA       LYS   6   6.891  -0.390 -15.718
   49    HB2  LYS   6           HB2      LYS   6   6.134   1.279 -14.053
   50    HB3  LYS   6           HB1      LYS   6   5.839  -0.030 -12.880
   51    HG2  LYS   6           HG2      LYS   6   8.675   0.026 -13.859
   52    HG3  LYS   6           HG1      LYS   6   8.163   1.559 -13.068
   53    HD2  LYS   6           HD2      LYS   6   7.420   0.322 -11.052
   54    HD3  LYS   6           HD1      LYS   6   7.793  -1.250 -11.843
   55    HE2  LYS   6           HE2      LYS   6  10.252  -0.638 -11.905
   56    HE3  LYS   6           HE1      LYS   6   9.877   0.955 -11.127
   57    HZ1  LYS   6           HZ1      LYS   6   9.284  -0.091  -9.165
   58    HZ2  LYS   6           HZ2      LYS   6  10.657  -0.947  -9.678
   59    HZ3  LYS   6           HZ3      LYS   6   9.112  -1.623  -9.876
   60    H    PHE   7           HN       PHE   7   4.912  -2.602 -13.760
   61    HA   PHE   7           HA       PHE   7   6.890  -4.337 -12.821
   62    HB2  PHE   7           HB2      PHE   7   3.974  -4.281 -12.815
   63    HB3  PHE   7           HB1      PHE   7   4.492  -5.919 -13.293
   64    HD1  PHE   7           HD1      PHE   7   3.940  -3.684 -10.489
   65    HD2  PHE   7           HD2      PHE   7   6.081  -7.080 -11.921
   66    HE1  PHE   7           HE1      PHE   7   4.333  -4.443  -8.191
   67    HE2  PHE   7           HE2      PHE   7   6.463  -7.817  -9.699
   68    HZ   PHE   7           HZ       PHE   7   5.597  -6.517  -7.762
   69    H    PHE   8           HN       PHE   8   4.592  -4.709 -15.478
   70    HA   PHE   8           HA       PHE   8   5.705  -7.171 -16.219
   71    HB2  PHE   8           HB2      PHE   8   4.649  -5.539 -18.391
   72    HB3  PHE   8           HB1      PHE   8   4.287  -7.224 -17.932
   73    HD1  PHE   8           HD1      PHE   8   3.307  -4.350 -18.778
   74    HD2  PHE   8           HD2      PHE   8   2.612  -7.174 -15.688
   75    HE1  PHE   8           HE1      PHE   8   1.231  -3.500 -18.550
   76    HE2  PHE   8           HE2      PHE   8   0.399  -6.278 -15.433
   77    HZ   PHE   8           HZ       PHE   8  -0.336  -4.441 -16.878
   78    H    ARG   9           HN       ARG   9   6.460  -3.840 -16.871
   79    HA   ARG   9           HA       ARG   9   7.414  -4.044 -19.393
   80    HB2  ARG   9           HB2      ARG   9   7.019  -2.167 -17.589
   81    HB3  ARG   9           HB1      ARG   9   8.713  -2.410 -17.151
   82    HG2  ARG   9           HG2      ARG   9   9.382  -1.701 -19.467
   83    HG3  ARG   9           HG1      ARG   9   7.637  -1.447 -19.857
   84    HD2  ARG   9           HD2      ARG   9   7.464   0.294 -17.970
   85    HD3  ARG   9           HD1      ARG   9   9.238   0.058 -17.630
   86    HE   ARG   9           HE       ARG   9   8.926   0.675 -20.443
   87   HH11  ARG   9          HH11      ARG   9   8.596   2.259 -17.215
   88   HH12  ARG   9          HH12      ARG   9   8.954   3.845 -17.810
   89   HH21  ARG   9          HH21      ARG   9   9.408   2.843 -21.189
   90   HH22  ARG   9          HH22      ARG   9   9.417   4.176 -20.084
   91    H    ASP  10           HN       ASP  10   8.960  -4.624 -16.273
   92    HA   ASP  10           HA       ASP  10  11.403  -5.422 -17.458
   93    HB2  ASP  10           HB2      ASP  10  10.504  -5.429 -14.491
   94    HB3  ASP  10           HB1      ASP  10  12.171  -5.829 -15.042
   95    H    ALA  11           HN       ALA  11   8.378  -6.968 -17.041
   96    HA   ALA  11           HA       ALA  11   9.631  -9.541 -16.359
   97    HB1  ALA  11           HB1      ALA  11   6.656  -9.087 -16.821
   98    HB2  ALA  11           HB2      ALA  11   7.427  -8.640 -15.252
   99    HB3  ALA  11           HB3      ALA  11   7.464 -10.358 -15.816
  100    H    ILE  12           HN       ILE  12   7.640  -8.032 -18.885
  101    HA   ILE  12           HA       ILE  12   7.736 -10.435 -20.514
  102    HB   ILE  12           HB       ILE  12   6.521  -7.669 -21.031
  103   HG12  ILE  12          HG12      ILE  12   5.218 -10.128 -19.707
  104   HG13  ILE  12          HG11      ILE  12   5.654  -8.541 -18.959
  105   HG21  ILE  12          HG21      ILE  12   6.037 -10.462 -22.386
  106   HG22  ILE  12          HG22      ILE  12   6.721  -8.985 -23.162
  107   HG23  ILE  12          HG23      ILE  12   4.996  -9.021 -22.685
  108   HD11  ILE  12          HD11      ILE  12   3.213  -8.596 -19.408
  109   HD12  ILE  12          HD12      ILE  12   3.489  -8.955 -21.151
  110   HD13  ILE  12          HD13      ILE  12   4.007  -7.362 -20.459
  111    H    LEU  13           HN       LEU  13   8.947  -7.078 -20.373
  112    HA   LEU  13           HA       LEU  13   9.894  -7.258 -23.085
  113    HB2  LEU  13           HB2      LEU  13  10.220  -4.968 -21.081
  114    HB3  LEU  13           HB1      LEU  13  10.403  -4.860 -22.885
  115    HG   LEU  13           HG       LEU  13   7.874  -5.279 -21.195
  116   HD11  LEU  13          HD11      LEU  13   8.930  -2.927 -21.517
  117   HD12  LEU  13          HD12      LEU  13   7.155  -3.111 -21.792
  118   HD13  LEU  13          HD13      LEU  13   8.283  -2.985 -23.202
  119   HD21  LEU  13          HD21      LEU  13   8.091  -5.592 -24.270
  120   HD22  LEU  13          HD22      LEU  13   6.562  -5.000 -23.511
  121   HD23  LEU  13          HD23      LEU  13   7.211  -6.616 -23.074
  122    H    GLN  14           HN       GLN  14  11.095  -8.299 -20.119
  123    HA   GLN  14           HA       GLN  14  13.833  -7.515 -20.873
  124    HB2  GLN  14           HB2      GLN  14  12.536  -8.804 -18.489
  125    HB3  GLN  14           HB1      GLN  14  14.246  -9.275 -18.833
  126    HG2  GLN  14           HG2      GLN  14  14.593  -6.618 -19.094
  127    HG3  GLN  14           HG1      GLN  14  13.043  -6.550 -18.190
  128   HE21  GLN  14          HE21      GLN  14  16.353  -8.143 -18.032
  129   HE22  GLN  14          HE22      GLN  14  16.487  -8.103 -16.307
  130    H    ARG  15           HN       ARG  15  11.441  -9.791 -21.600
  131    HA   ARG  15           HA       ARG  15  13.327 -11.908 -22.267
  132    HB2  ARG  15           HB2      ARG  15  10.398 -11.708 -23.132
  133    HB3  ARG  15           HB1      ARG  15  11.391 -13.195 -22.894
  134    HG2  ARG  15           HG2      ARG  15  11.473 -12.714 -20.414
  135    HG3  ARG  15           HG1      ARG  15  10.489 -11.228 -20.706
  136    HD2  ARG  15           HD2      ARG  15   8.969 -12.930 -19.902
  137    HD3  ARG  15           HD1      ARG  15   8.640 -12.725 -21.673
  138    HE   ARG  15           HE       ARG  15  10.575 -14.863 -21.299
  139   HH11  ARG  15          HH11      ARG  15   7.073 -14.174 -20.752
  140   HH12  ARG  15          HH12      ARG  15   6.586 -15.826 -20.933
  141   HH21  ARG  15          HH21      ARG  15   9.854 -17.080 -21.541
  142   HH22  ARG  15          HH22      ARG  15   8.179 -17.486 -21.385
  143    H    LYS  16           HN       LYS  16  11.212  -9.465 -23.857
  144    HA   LYS  16           HA       LYS  16  12.734  -9.868 -26.350
  145    HB2  LYS  16           HB2      LYS  16   9.943  -8.820 -25.635
  146    HB3  LYS  16           HB1      LYS  16  10.732  -8.217 -27.131
  147    HG2  LYS  16           HG2      LYS  16   9.295 -10.015 -27.764
  148    HG3  LYS  16           HG1      LYS  16  10.976 -10.609 -27.931
  149    HD2  LYS  16           HD2      LYS  16  10.735 -11.930 -25.779
  150    HD3  LYS  16           HD1      LYS  16   9.074 -11.264 -25.565
  151    HE2  LYS  16           HE2      LYS  16   8.333 -12.413 -27.700
  152    HE3  LYS  16           HE1      LYS  16  10.007 -13.069 -27.918
  153    HZ1  LYS  16           HZ1      LYS  16   8.568 -14.676 -26.920
  154    HZ2  LYS  16           HZ2      LYS  16   8.159 -13.626 -25.648
  155    HZ3  LYS  16           HZ3      LYS  16   9.749 -14.207 -25.794
  156    H    LYS  17           HN       LYS  17  14.609  -8.572 -26.139
  157    HA   LYS  17           HA       LYS  17  14.125  -5.711 -25.935
  158    HB2  LYS  17           HB2      LYS  17  14.955  -7.106 -23.537
  159    HB3  LYS  17           HB1      LYS  17  16.466  -6.405 -24.195
  160    HG2  LYS  17           HG2      LYS  17  14.825  -4.164 -24.333
  161    HG3  LYS  17           HG1      LYS  17  14.019  -5.031 -22.976
  162    HD2  LYS  17           HD2      LYS  17  16.194  -5.141 -21.740
  163    HD3  LYS  17           HD1      LYS  17  17.025  -4.298 -23.096
  164    HE2  LYS  17           HE2      LYS  17  15.538  -2.268 -22.721
  165    HE3  LYS  17           HE1      LYS  17  14.755  -3.121 -21.329
  166    HZ1  LYS  17           HZ1      LYS  17  16.426  -2.555 -20.047
  167    HZ2  LYS  17           HZ2      LYS  17  17.026  -1.575 -21.296
  168    HZ3  LYS  17           HZ3      LYS  17  17.595  -3.164 -21.117
  Start of MODEL    8
    1    H1   GLU   1           HT1      GLU   1   1.199   8.438 -15.827
    2    H2   GLU   1           HT2      GLU   1   0.199   7.079 -16.014
    3    H3   GLU   1           HT3      GLU   1   1.324   7.477 -17.221
    4    HA   GLU   1           HA       GLU   1   2.757   6.142 -16.298
    5    HB2  GLU   1           HB2      GLU   1   2.471   8.217 -14.026
    6    HB3  GLU   1           HB1      GLU   1   3.623   6.839 -13.866
    7    HG2  GLU   1           HG2      GLU   1   4.860   7.577 -15.926
    8    HG3  GLU   1           HG1      GLU   1   3.691   8.934 -16.166
    9    H    MET   2           HN       MET   2   2.390   4.002 -15.765
   10    HA   MET   2           HA       MET   2   0.593   3.465 -13.470
   11    HB2  MET   2           HB2      MET   2   0.895   1.873 -16.097
   12    HB3  MET   2           HB1      MET   2  -0.025   1.293 -14.654
   13    HG2  MET   2           HG2      MET   2  -1.580   3.262 -14.853
   14    HG3  MET   2           HG1      MET   2  -0.674   3.846 -16.289
   15    HE1  MET   2           HE1      MET   2  -3.820   3.378 -16.101
   16    HE2  MET   2           HE2      MET   2  -4.105   2.743 -17.757
   17    HE3  MET   2           HE3      MET   2  -2.914   4.064 -17.495
   18    H    ARG   3           HN       ARG   3   1.129   1.692 -12.136
   19    HA   ARG   3           HA       ARG   3   3.955   1.065 -12.099
   20    HB2  ARG   3           HB2      ARG   3   1.646   0.401 -10.163
   21    HB3  ARG   3           HB1      ARG   3   3.353  -0.092  -9.870
   22    HG2  ARG   3           HG2      ARG   3   2.463   2.834 -10.241
   23    HG3  ARG   3           HG1      ARG   3   2.524   1.993  -8.650
   24    HD2  ARG   3           HD2      ARG   3   4.986   1.513  -8.994
   25    HD3  ARG   3           HD1      ARG   3   4.941   2.415 -10.576
   26    HE   ARG   3           HE       ARG   3   3.864   4.160  -8.569
   27   HH11  ARG   3          HH11      ARG   3   6.996   2.517  -9.248
   28   HH12  ARG   3          HH12      ARG   3   7.961   3.805  -8.612
   29   HH21  ARG   3          HH21      ARG   3   5.208   5.874  -7.726
   30   HH22  ARG   3          HH22      ARG   3   6.934   5.730  -7.740
   31    H    LEU   4           HN       LEU   4   1.169  -0.402 -13.356
   32    HA   LEU   4           HA       LEU   4   2.267  -3.071 -12.973
   33    HB2  LEU   4           HB2      LEU   4  -0.275  -2.000 -14.270
   34    HB3  LEU   4           HB1      LEU   4   0.191  -3.748 -14.208
   35    HG   LEU   4           HG       LEU   4   0.614  -2.955 -11.589
   36   HD11  LEU   4          HD11      LEU   4  -1.761  -1.289 -12.550
   37   HD12  LEU   4          HD12      LEU   4  -0.296  -0.780 -11.610
   38   HD13  LEU   4          HD13      LEU   4  -1.562  -1.806 -10.827
   39   HD21  LEU   4          HD21      LEU   4  -0.435  -5.065 -12.424
   40   HD22  LEU   4          HD22      LEU   4  -1.985  -4.172 -12.703
   41   HD23  LEU   4          HD23      LEU   4  -1.339  -4.357 -11.026
   42    H    SER   5           HN       SER   5   2.014  -0.503 -15.346
   43    HA   SER   5           HA       SER   5   2.887  -2.153 -17.453
   44    HB2  SER   5           HB2      SER   5   3.070   0.896 -17.189
   45    HB3  SER   5           HB1      SER   5   3.455  -0.074 -18.677
   46    HG   SER   5           HG       SER   5   1.114  -0.871 -17.965
   47    H    LYS   6           HN       LYS   6   4.279  -0.427 -14.687
   48    HA   LYS   6           HA       LYS   6   6.878  -0.412 -15.666
   49    HB2  LYS   6           HB2      LYS   6   5.965   1.214 -13.997
   50    HB3  LYS   6           HB1      LYS   6   5.831  -0.126 -12.823
   51    HG2  LYS   6           HG2      LYS   6   8.589   0.185 -13.976
   52    HG3  LYS   6           HG1      LYS   6   8.003   1.636 -13.082
   53    HD2  LYS   6           HD2      LYS   6   7.555   0.316 -11.079
   54    HD3  LYS   6           HD1      LYS   6   7.864  -1.224 -11.953
   55    HE2  LYS   6           HE2      LYS   6  10.281  -0.642 -12.212
   56    HE3  LYS   6           HE1      LYS   6  10.007   0.979 -11.450
   57    HZ1  LYS   6           HZ1      LYS   6  10.370   0.021  -9.534
   58    HZ2  LYS   6           HZ2      LYS   6  10.501  -1.516 -10.242
   59    HZ3  LYS   6           HZ3      LYS   6   8.988  -0.948  -9.722
   60    H    PHE   7           HN       PHE   7   4.889  -2.631 -13.747
   61    HA   PHE   7           HA       PHE   7   6.888  -4.329 -12.794
   62    HB2  PHE   7           HB2      PHE   7   3.972  -4.289 -12.788
   63    HB3  PHE   7           HB1      PHE   7   4.505  -5.934 -13.225
   64    HD1  PHE   7           HD1      PHE   7   4.042  -3.572 -10.487
   65    HD2  PHE   7           HD2      PHE   7   6.023  -7.089 -11.843
   66    HE1  PHE   7           HE1      PHE   7   4.467  -4.253  -8.176
   67    HE2  PHE   7           HE2      PHE   7   6.439  -7.763  -9.612
   68    HZ   PHE   7           HZ       PHE   7   5.666  -6.360  -7.699
   69    H    PHE   8           HN       PHE   8   4.601  -4.757 -15.460
   70    HA   PHE   8           HA       PHE   8   5.755  -7.227 -16.137
   71    HB2  PHE   8           HB2      PHE   8   4.656  -5.729 -18.365
   72    HB3  PHE   8           HB1      PHE   8   4.285  -7.380 -17.786
   73    HD1  PHE   8           HD1      PHE   8   3.381  -4.488 -18.748
   74    HD2  PHE   8           HD2      PHE   8   2.595  -7.228 -15.606
   75    HE1  PHE   8           HE1      PHE   8   1.331  -3.578 -18.552
   76    HE2  PHE   8           HE2      PHE   8   0.399  -6.272 -15.381
   77    HZ   PHE   8           HZ       PHE   8  -0.279  -4.443 -16.872
   78    H    ARG   9           HN       ARG   9   6.528  -3.925 -16.763
   79    HA   ARG   9           HA       ARG   9   7.471  -4.099 -19.322
   80    HB2  ARG   9           HB2      ARG   9   7.297  -2.286 -17.240
   81    HB3  ARG   9           HB1      ARG   9   9.056  -2.439 -17.354
   82    HG2  ARG   9           HG2      ARG   9   9.018  -1.611 -19.663
   83    HG3  ARG   9           HG1      ARG   9   7.213  -1.646 -19.677
   84    HD2  ARG   9           HD2      ARG   9   7.131   0.140 -17.883
   85    HD3  ARG   9           HD1      ARG   9   8.954   0.159 -17.818
   86    HE   ARG   9           HE       ARG   9   8.199   0.584 -20.555
   87   HH11  ARG   9          HH11      ARG   9   7.914   2.249 -17.380
   88   HH12  ARG   9          HH12      ARG   9   7.824   3.836 -18.067
   89   HH21  ARG   9          HH21      ARG   9   8.073   2.750 -21.441
   90   HH22  ARG   9          HH22      ARG   9   7.913   4.120 -20.395
   91    H    ASP  10           HN       ASP  10   8.968  -4.709 -16.199
   92    HA   ASP  10           HA       ASP  10  11.396  -5.537 -17.394
   93    HB2  ASP  10           HB2      ASP  10  10.489  -5.543 -14.439
   94    HB3  ASP  10           HB1      ASP  10  12.140  -6.019 -14.982
   95    H    ALA  11           HN       ALA  11   8.358  -7.050 -17.003
   96    HA   ALA  11           HA       ALA  11   9.598  -9.638 -16.362
   97    HB1  ALA  11           HB1      ALA  11   7.405 -10.476 -15.911
   98    HB2  ALA  11           HB2      ALA  11   6.630  -9.145 -16.862
   99    HB3  ALA  11           HB3      ALA  11   7.383  -8.791 -15.257
  100    H    ILE  12           HN       ILE  12   7.655  -8.072 -18.890
  101    HA   ILE  12           HA       ILE  12   7.771 -10.440 -20.562
  102    HB   ILE  12           HB       ILE  12   6.613  -7.644 -21.056
  103   HG12  ILE  12          HG12      ILE  12   5.212 -10.100 -19.834
  104   HG13  ILE  12          HG11      ILE  12   5.686  -8.560 -19.018
  105   HG21  ILE  12          HG21      ILE  12   5.142  -8.858 -22.798
  106   HG22  ILE  12          HG22      ILE  12   5.991 -10.403 -22.431
  107   HG23  ILE  12          HG23      ILE  12   6.885  -9.036 -23.188
  108   HD11  ILE  12          HD11      ILE  12   3.575  -8.793 -21.289
  109   HD12  ILE  12          HD12      ILE  12   4.112  -7.264 -20.482
  110   HD13  ILE  12          HD13      ILE  12   3.250  -8.534 -19.534
  111    H    LEU  13           HN       LEU  13   9.019  -7.112 -20.323
  112    HA   LEU  13           HA       LEU  13  10.001  -7.243 -23.023
  113    HB2  LEU  13           HB2      LEU  13  10.265  -4.973 -20.986
  114    HB3  LEU  13           HB1      LEU  13  10.479  -4.842 -22.786
  115    HG   LEU  13           HG       LEU  13   7.921  -5.312 -21.144
  116   HD11  LEU  13          HD11      LEU  13   9.003  -2.927 -21.513
  117   HD12  LEU  13          HD12      LEU  13   7.218  -3.144 -21.659
  118   HD13  LEU  13          HD13      LEU  13   8.239  -3.011 -23.146
  119   HD21  LEU  13          HD21      LEU  13   7.465  -6.680 -23.128
  120   HD22  LEU  13          HD22      LEU  13   8.143  -5.437 -24.239
  121   HD23  LEU  13          HD23      LEU  13   6.587  -5.129 -23.377
  122    H    GLN  14           HN       GLN  14  11.217  -8.335 -20.067
  123    HA   GLN  14           HA       GLN  14  13.936  -7.501 -20.882
  124    HB2  GLN  14           HB2      GLN  14  12.831  -8.954 -18.460
  125    HB3  GLN  14           HB1      GLN  14  14.589  -9.117 -18.873
  126    HG2  GLN  14           HG2      GLN  14  14.449  -6.437 -19.066
  127    HG3  GLN  14           HG1      GLN  14  12.972  -6.667 -18.086
  128   HE21  GLN  14          HE21      GLN  14  13.227  -7.777 -15.887
  129   HE22  GLN  14          HE22      GLN  14  14.751  -7.695 -15.068
  130    H    ARG  15           HN       ARG  15  11.542  -9.764 -21.573
  131    HA   ARG  15           HA       ARG  15  13.442 -11.828 -22.403
  132    HB2  ARG  15           HB2      ARG  15  10.474 -11.752 -23.130
  133    HB3  ARG  15           HB1      ARG  15  11.542 -13.188 -22.898
  134    HG2  ARG  15           HG2      ARG  15  11.639 -12.738 -20.459
  135    HG3  ARG  15           HG1      ARG  15  10.649 -11.239 -20.694
  136    HD2  ARG  15           HD2      ARG  15   8.673 -12.413 -21.140
  137    HD3  ARG  15           HD1      ARG  15   9.527 -13.951 -21.621
  138    HE   ARG  15           HE       ARG  15  10.108 -13.297 -18.841
  139   HH11  ARG  15          HH11      ARG  15   7.441 -14.552 -20.916
  140   HH12  ARG  15          HH12      ARG  15   6.677 -15.417 -19.626
  141   HH21  ARG  15          HH21      ARG  15   9.033 -14.471 -17.146
  142   HH22  ARG  15          HH22      ARG  15   7.588 -15.369 -17.469
  143    H    LYS  16           HN       LYS  16  11.149  -9.409 -23.800
  144    HA   LYS  16           HA       LYS  16  12.536  -9.759 -26.372
  145    HB2  LYS  16           HB2      LYS  16   9.760  -8.881 -25.483
  146    HB3  LYS  16           HB1      LYS  16  10.434  -8.054 -26.927
  147    HG2  LYS  16           HG2      LYS  16   9.101  -9.900 -27.702
  148    HG3  LYS  16           HG1      LYS  16  10.817 -10.306 -28.018
  149    HD2  LYS  16           HD2      LYS  16  10.781 -11.816 -25.911
  150    HD3  LYS  16           HD1      LYS  16   9.029 -11.423 -25.742
  151    HE2  LYS  16           HE2      LYS  16   8.590 -12.456 -28.027
  152    HE3  LYS  16           HE1      LYS  16  10.349 -12.864 -28.157
  153    HZ1  LYS  16           HZ1      LYS  16   9.837 -13.973 -25.847
  154    HZ2  LYS  16           HZ2      LYS  16   9.535 -14.766 -27.318
  155    HZ3  LYS  16           HZ3      LYS  16   8.258 -14.032 -26.469
  156    H    LYS  17           HN       LYS  17  14.387  -8.523 -26.293
  157    HA   LYS  17           HA       LYS  17  14.036  -5.663 -25.942
  158    HB2  LYS  17           HB2      LYS  17  14.998  -7.265 -23.702
  159    HB3  LYS  17           HB1      LYS  17  16.448  -6.467 -24.385
  160    HG2  LYS  17           HG2      LYS  17  13.906  -4.825 -23.744
  161    HG3  LYS  17           HG1      LYS  17  15.024  -5.309 -22.426
  162    HD2  LYS  17           HD2      LYS  17  16.933  -4.180 -23.657
  163    HD3  LYS  17           HD1      LYS  17  15.783  -3.660 -24.940
  164    HE2  LYS  17           HE2      LYS  17  14.493  -2.301 -23.260
  165    HE3  LYS  17           HE1      LYS  17  15.609  -2.853 -21.944
  166    HZ1  LYS  17           HZ1      LYS  17  16.175  -1.099 -24.263
  167    HZ2  LYS  17           HZ2      LYS  17  17.419  -1.881 -23.412
  168    HZ3  LYS  17           HZ3      LYS  17  16.388  -0.800 -22.605
  Start of MODEL    9
    1    H1   GLU   1           HT1      GLU   1   3.917   5.976 -16.043
    2    H2   GLU   1           HT2      GLU   1   3.738   6.794 -14.566
    3    H3   GLU   1           HT3      GLU   1   3.478   7.617 -16.028
    4    HA   GLU   1           HA       GLU   1   1.508   6.771 -14.613
    5    HB2  GLU   1           HB2      GLU   1   1.788   6.565 -17.687
    6    HB3  GLU   1           HB1      GLU   1   0.203   6.295 -16.867
    7    HG2  GLU   1           HG2      GLU   1   0.285   8.625 -15.891
    8    HG3  GLU   1           HG1      GLU   1   1.875   8.912 -16.701
    9    H    MET   2           HN       MET   2   0.824   4.994 -13.566
   10    HA   MET   2           HA       MET   2   0.210   2.974 -13.056
   11    HB2  MET   2           HB2      MET   2   0.778   1.969 -15.908
   12    HB3  MET   2           HB1      MET   2  -0.066   1.050 -14.608
   13    HG2  MET   2           HG2      MET   2  -1.884   2.808 -14.559
   14    HG3  MET   2           HG1      MET   2  -1.055   3.695 -15.874
   15    HE1  MET   2           HE1      MET   2  -3.372   0.940 -14.736
   16    HE2  MET   2           HE2      MET   2  -2.019  -0.182 -15.112
   17    HE3  MET   2           HE3      MET   2  -3.525  -0.230 -16.091
   18    H    ARG   3           HN       ARG   3   1.161   1.541 -11.770
   19    HA   ARG   3           HA       ARG   3   4.022   1.121 -12.062
   20    HB2  ARG   3           HB2      ARG   3   2.144   0.175  -9.803
   21    HB3  ARG   3           HB1      ARG   3   3.946   0.189  -9.755
   22    HG2  ARG   3           HG2      ARG   3   2.088   2.645  -9.889
   23    HG3  ARG   3           HG1      ARG   3   2.978   2.050  -8.443
   24    HD2  ARG   3           HD2      ARG   3   5.189   2.430  -9.813
   25    HD3  ARG   3           HD1      ARG   3   4.156   3.311 -11.023
   26    HE   ARG   3           HE       ARG   3   3.577   4.366  -8.389
   27   HH11  ARG   3          HH11      ARG   3   6.258   4.339 -10.807
   28   HH12  ARG   3          HH12      ARG   3   6.899   5.867 -10.305
   29   HH21  ARG   3          HH21      ARG   3   4.487   6.425  -7.753
   30   HH22  ARG   3          HH22      ARG   3   5.884   7.060  -8.556
   31    H    LEU   4           HN       LEU   4   1.232  -0.425 -13.057
   32    HA   LEU   4           HA       LEU   4   2.319  -3.101 -12.808
   33    HB2  LEU   4           HB2      LEU   4  -0.182  -1.994 -14.181
   34    HB3  LEU   4           HB1      LEU   4   0.250  -3.741 -14.022
   35    HG   LEU   4           HG       LEU   4   0.527  -2.841 -11.410
   36   HD11  LEU   4          HD11      LEU   4  -1.720  -1.656 -10.878
   37   HD12  LEU   4          HD12      LEU   4  -1.770  -1.216 -12.628
   38   HD13  LEU   4          HD13      LEU   4  -0.386  -0.659 -11.593
   39   HD21  LEU   4          HD21      LEU   4  -0.489  -4.987 -12.230
   40   HD22  LEU   4          HD22      LEU   4  -2.006  -4.097 -12.653
   41   HD23  LEU   4          HD23      LEU   4  -1.481  -4.211 -10.928
   42    H    SER   5           HN       SER   5   2.058  -0.415 -15.078
   43    HA   SER   5           HA       SER   5   2.919  -2.004 -17.271
   44    HB2  SER   5           HB2      SER   5   2.869   1.060 -17.065
   45    HB3  SER   5           HB1      SER   5   3.162   0.075 -18.559
   46    HG   SER   5           HG       SER   5   0.915  -0.717 -17.321
   47    H    LYS   6           HN       LYS   6   4.338  -0.571 -14.430
   48    HA   LYS   6           HA       LYS   6   6.885  -0.284 -15.649
   49    HB2  LYS   6           HB2      LYS   6   6.210   1.373 -13.953
   50    HB3  LYS   6           HB1      LYS   6   5.894   0.065 -12.786
   51    HG2  LYS   6           HG2      LYS   6   8.730   0.095 -13.790
   52    HG3  LYS   6           HG1      LYS   6   8.238   1.609 -12.956
   53    HD2  LYS   6           HD2      LYS   6   7.509   0.328 -10.962
   54    HD3  LYS   6           HD1      LYS   6   7.862  -1.227 -11.795
   55    HE2  LYS   6           HE2      LYS   6  10.324  -0.634 -11.871
   56    HE3  LYS   6           HE1      LYS   6   9.969   0.947 -11.058
   57    HZ1  LYS   6           HZ1      LYS   6  10.516  -1.476  -9.879
   58    HZ2  LYS   6           HZ2      LYS   6   8.857  -1.236  -9.612
   59    HZ3  LYS   6           HZ3      LYS   6   9.975  -0.055  -9.123
   60    H    PHE   7           HN       PHE   7   4.973  -2.536 -13.677
   61    HA   PHE   7           HA       PHE   7   6.988  -4.279 -12.817
   62    HB2  PHE   7           HB2      PHE   7   4.072  -4.221 -12.721
   63    HB3  PHE   7           HB1      PHE   7   4.574  -5.854 -13.231
   64    HD1  PHE   7           HD1      PHE   7   4.130  -3.631 -10.394
   65    HD2  PHE   7           HD2      PHE   7   6.186  -7.038 -11.921
   66    HE1  PHE   7           HE1      PHE   7   4.597  -4.409  -8.115
   67    HE2  PHE   7           HE2      PHE   7   6.639  -7.795  -9.719
   68    HZ   PHE   7           HZ       PHE   7   5.855  -6.498  -7.745
   69    H    PHE   8           HN       PHE   8   4.598  -4.620 -15.403
   70    HA   PHE   8           HA       PHE   8   5.694  -7.071 -16.207
   71    HB2  PHE   8           HB2      PHE   8   4.566  -5.420 -18.327
   72    HB3  PHE   8           HB1      PHE   8   4.224  -7.113 -17.877
   73    HD1  PHE   8           HD1      PHE   8   3.204  -4.241 -18.667
   74    HD2  PHE   8           HD2      PHE   8   2.621  -7.090 -15.574
   75    HE1  PHE   8           HE1      PHE   8   1.135  -3.399 -18.363
   76    HE2  PHE   8           HE2      PHE   8   0.414  -6.198 -15.238
   77    HZ   PHE   8           HZ       PHE   8  -0.371  -4.352 -16.645
   78    H    ARG   9           HN       ARG   9   6.406  -3.725 -16.850
   79    HA   ARG   9           HA       ARG   9   7.279  -3.906 -19.402
   80    HB2  ARG   9           HB2      ARG   9   6.856  -2.009 -17.735
   81    HB3  ARG   9           HB1      ARG   9   8.474  -2.289 -17.086
   82    HG2  ARG   9           HG2      ARG   9   9.428  -1.641 -19.325
   83    HG3  ARG   9           HG1      ARG   9   7.746  -1.312 -19.892
   84    HD2  ARG   9           HD2      ARG   9   7.454   0.466 -18.085
   85    HD3  ARG   9           HD1      ARG   9   9.144   0.128 -17.492
   86    HE   ARG   9           HE       ARG   9   9.247   0.711 -20.338
   87   HH11  ARG   9          HH11      ARG   9   8.664   2.379 -17.188
   88   HH12  ARG   9          HH12      ARG   9   9.251   3.910 -17.746
   89   HH21  ARG   9          HH21      ARG   9  10.035   2.799 -21.030
   90   HH22  ARG   9          HH22      ARG   9  10.036   4.148 -19.945
   91    H    ASP  10           HN       ASP  10   8.971  -4.492 -16.336
   92    HA   ASP  10           HA       ASP  10  11.342  -5.274 -17.661
   93    HB2  ASP  10           HB2      ASP  10  10.614  -5.255 -14.654
   94    HB3  ASP  10           HB1      ASP  10  12.232  -5.748 -15.285
   95    H    ALA  11           HN       ALA  11   8.344  -6.828 -17.107
   96    HA   ALA  11           HA       ALA  11   9.633  -9.401 -16.493
   97    HB1  ALA  11           HB1      ALA  11   6.644  -8.966 -16.877
   98    HB2  ALA  11           HB2      ALA  11   7.448  -8.537 -15.319
   99    HB3  ALA  11           HB3      ALA  11   7.486 -10.245 -15.914
  100    H    ILE  12           HN       ILE  12   7.549  -7.881 -18.945
  101    HA   ILE  12           HA       ILE  12   7.584 -10.266 -20.580
  102    HB   ILE  12           HB       ILE  12   6.368  -7.497 -21.028
  103   HG12  ILE  12          HG12      ILE  12   5.115  -9.990 -19.726
  104   HG13  ILE  12          HG11      ILE  12   5.555  -8.414 -18.960
  105   HG21  ILE  12          HG21      ILE  12   4.791  -8.819 -22.667
  106   HG22  ILE  12          HG22      ILE  12   5.866 -10.247 -22.453
  107   HG23  ILE  12          HG23      ILE  12   6.504  -8.735 -23.198
  108   HD11  ILE  12          HD11      ILE  12   3.104  -8.484 -19.336
  109   HD12  ILE  12          HD12      ILE  12   3.330  -8.818 -21.093
  110   HD13  ILE  12          HD13      ILE  12   3.851  -7.228 -20.398
  111    H    LEU  13           HN       LEU  13   8.855  -6.942 -20.477
  112    HA   LEU  13           HA       LEU  13   9.663  -7.125 -23.233
  113    HB2  LEU  13           HB2      LEU  13  10.083  -4.856 -21.215
  114    HB3  LEU  13           HB1      LEU  13  10.206  -4.719 -23.023
  115    HG   LEU  13           HG       LEU  13   7.717  -5.151 -21.257
  116   HD11  LEU  13          HD11      LEU  13   6.995  -2.966 -21.800
  117   HD12  LEU  13          HD12      LEU  13   8.122  -2.807 -23.210
  118   HD13  LEU  13          HD13      LEU  13   8.773  -2.805 -21.527
  119   HD21  LEU  13          HD21      LEU  13   7.842  -5.358 -24.349
  120   HD22  LEU  13          HD22      LEU  13   6.336  -4.818 -23.507
  121   HD23  LEU  13          HD23      LEU  13   7.021  -6.443 -23.164
  122    H    GLN  14           HN       GLN  14  11.018  -8.199 -20.340
  123    HA   GLN  14           HA       GLN  14  13.714  -7.445 -21.299
  124    HB2  GLN  14           HB2      GLN  14  12.706  -8.657 -18.718
  125    HB3  GLN  14           HB1      GLN  14  14.444  -8.859 -19.190
  126    HG2  GLN  14           HG2      GLN  14  14.271  -6.196 -19.607
  127    HG3  GLN  14           HG1      GLN  14  12.871  -6.356 -18.505
  128   HE21  GLN  14          HE21      GLN  14  13.378  -7.608 -16.310
  129   HE22  GLN  14          HE22      GLN  14  14.930  -7.321 -15.593
  130    H    ARG  15           HN       ARG  15  11.264  -9.730 -21.691
  131    HA   ARG  15           HA       ARG  15  12.994 -11.992 -22.160
  132    HB2  ARG  15           HB2      ARG  15  10.150 -11.479 -23.211
  133    HB3  ARG  15           HB1      ARG  15  10.977 -13.078 -23.101
  134    HG2  ARG  15           HG2      ARG  15  11.033 -12.868 -20.599
  135    HG3  ARG  15           HG1      ARG  15  10.237 -11.246 -20.746
  136    HD2  ARG  15           HD2      ARG  15   8.186 -12.185 -21.575
  137    HD3  ARG  15           HD1      ARG  15   8.912 -13.842 -21.801
  138    HE   ARG  15           HE       ARG  15   9.205 -13.098 -19.031
  139   HH11  ARG  15          HH11      ARG  15   6.558 -13.886 -21.360
  140   HH12  ARG  15          HH12      ARG  15   5.481 -14.471 -20.137
  141   HH21  ARG  15          HH21      ARG  15   7.703 -13.894 -17.422
  142   HH22  ARG  15          HH22      ARG  15   6.137 -14.473 -17.883
  143    H    LYS  16           HN       LYS  16  11.379  -9.434 -24.089
  144    HA   LYS  16           HA       LYS  16  13.006 -10.206 -26.419
  145    HB2  LYS  16           HB2      LYS  16  10.409  -8.645 -25.945
  146    HB3  LYS  16           HB1      LYS  16  11.397  -8.238 -27.387
  147    HG2  LYS  16           HG2      LYS  16   9.644  -9.770 -28.023
  148    HG3  LYS  16           HG1      LYS  16  11.224 -10.598 -28.191
  149    HD2  LYS  16           HD2      LYS  16  10.765 -11.871 -26.022
  150    HD3  LYS  16           HD1      LYS  16   9.195 -11.001 -25.875
  151    HE2  LYS  16           HE2      LYS  16   8.395 -12.051 -28.033
  152    HE3  LYS  16           HE1      LYS  16   9.985 -12.901 -28.207
  153    HZ1  LYS  16           HZ1      LYS  16   9.517 -13.985 -26.071
  154    HZ2  LYS  16           HZ2      LYS  16   8.373 -14.348 -27.273
  155    HZ3  LYS  16           HZ3      LYS  16   7.984 -13.256 -26.031
  156    H    LYS  17           HN       LYS  17  15.065  -9.273 -26.060
  157    HA   LYS  17           HA       LYS  17  15.186  -6.397 -26.032
  158    HB2  LYS  17           HB2      LYS  17  15.501  -7.905 -23.468
  159    HB3  LYS  17           HB1      LYS  17  17.040  -7.098 -23.898
  160    HG2  LYS  17           HG2      LYS  17  14.704  -5.222 -24.163
  161    HG3  LYS  17           HG1      LYS  17  14.772  -5.954 -22.532
  162    HD2  LYS  17           HD2      LYS  17  16.061  -4.010 -22.276
  163    HD3  LYS  17           HD1      LYS  17  17.315  -5.273 -22.515
  164    HE2  LYS  17           HE2      LYS  17  17.543  -4.571 -24.945
  165    HE3  LYS  17           HE1      LYS  17  16.282  -3.296 -24.683
  166    HZ1  LYS  17           HZ1      LYS  17  18.922  -3.505 -23.320
  167    HZ2  LYS  17           HZ2      LYS  17  17.735  -2.337 -22.988
  168    HZ3  LYS  17           HZ3      LYS  17  18.471  -2.390 -24.518
  Start of MODEL   10
    1    H1   GLU   1           HT1      GLU   1   3.411   7.881 -14.654
    2    H2   GLU   1           HT2      GLU   1   3.796   6.311 -15.175
    3    H3   GLU   1           HT3      GLU   1   3.207   6.564 -13.603
    4    HA   GLU   1           HA       GLU   1   1.206   7.591 -14.812
    5    HB2  GLU   1           HB2      GLU   1   2.508   5.767 -16.939
    6    HB3  GLU   1           HB1      GLU   1   0.732   6.082 -16.946
    7    HG2  GLU   1           HG2      GLU   1   1.154   8.565 -17.167
    8    HG3  GLU   1           HG1      GLU   1   2.936   8.264 -17.165
    9    H    MET   2           HN       MET   2   2.330   4.128 -15.359
   10    HA   MET   2           HA       MET   2   0.383   3.298 -13.298
   11    HB2  MET   2           HB2      MET   2   0.933   1.903 -15.995
   12    HB3  MET   2           HB1      MET   2  -0.034   1.189 -14.649
   13    HG2  MET   2           HG2      MET   2  -1.701   3.056 -14.855
   14    HG3  MET   2           HG1      MET   2  -0.746   3.771 -16.195
   15    HE1  MET   2           HE1      MET   2  -2.867   3.885 -17.624
   16    HE2  MET   2           HE2      MET   2  -3.827   3.141 -16.299
   17    HE3  MET   2           HE3      MET   2  -3.968   2.508 -17.975
   18    H    ARG   3           HN       ARG   3   1.051   1.589 -11.975
   19    HA   ARG   3           HA       ARG   3   3.905   1.057 -12.018
   20    HB2  ARG   3           HB2      ARG   3   1.763   0.219  -9.962
   21    HB3  ARG   3           HB1      ARG   3   3.540   0.021  -9.749
   22    HG2  ARG   3           HG2      ARG   3   2.047   2.707 -10.027
   23    HG3  ARG   3           HG1      ARG   3   2.592   1.960  -8.486
   24    HD2  ARG   3           HD2      ARG   3   5.020   2.034  -9.407
   25    HD3  ARG   3           HD1      ARG   3   4.382   3.013 -10.800
   26    HE   ARG   3           HE       ARG   3   3.453   4.250  -8.369
   27   HH11  ARG   3          HH11      ARG   3   6.592   3.651 -10.055
   28   HH12  ARG   3          HH12      ARG   3   7.351   5.073  -9.422
   29   HH21  ARG   3          HH21      ARG   3   4.530   6.158  -7.546
   30   HH22  ARG   3          HH22      ARG   3   6.169   6.507  -7.985
   31    H    LEU   4           HN       LEU   4   1.137  -0.406 -13.229
   32    HA   LEU   4           HA       LEU   4   2.168  -3.104 -12.934
   33    HB2  LEU   4           HB2      LEU   4  -0.254  -1.927 -14.390
   34    HB3  LEU   4           HB1      LEU   4   0.147  -3.686 -14.279
   35    HG   LEU   4           HG       LEU   4   0.352  -2.891 -11.631
   36   HD11  LEU   4          HD11      LEU   4  -1.891  -1.675 -11.126
   37   HD12  LEU   4          HD12      LEU   4  -1.847  -1.145 -12.852
   38   HD13  LEU   4          HD13      LEU   4  -0.494  -0.691 -11.730
   39   HD21  LEU   4          HD21      LEU   4  -2.169  -4.039 -12.990
   40   HD22  LEU   4          HD22      LEU   4  -1.689  -4.236 -11.260
   41   HD23  LEU   4          HD23      LEU   4  -0.680  -4.978 -12.571
   42    H    SER   5           HN       SER   5   2.005  -0.424 -15.250
   43    HA   SER   5           HA       SER   5   2.928  -1.979 -17.388
   44    HB2  SER   5           HB2      SER   5   3.202   1.054 -17.024
   45    HB3  SER   5           HB1      SER   5   3.588   0.111 -18.527
   46    HG   SER   5           HG       SER   5   1.242  -0.652 -18.012
   47    H    LYS   6           HN       LYS   6   4.354  -0.227 -14.600
   48    HA   LYS   6           HA       LYS   6   6.946  -0.279 -15.526
   49    HB2  LYS   6           HB2      LYS   6   6.134   1.282 -13.791
   50    HB3  LYS   6           HB1      LYS   6   5.803  -0.096 -12.710
   51    HG2  LYS   6           HG2      LYS   6   8.674   0.018 -13.599
   52    HG3  LYS   6           HG1      LYS   6   8.134   1.501 -12.736
   53    HD2  LYS   6           HD2      LYS   6   7.303   0.120 -10.832
   54    HD3  LYS   6           HD1      LYS   6   7.777  -1.383 -11.697
   55    HE2  LYS   6           HE2      LYS   6  10.211  -0.681 -11.594
   56    HE3  LYS   6           HE1      LYS   6   9.735   0.845 -10.741
   57    HZ1  LYS   6           HZ1      LYS   6   8.695  -0.681  -9.043
   58    HZ2  LYS   6           HZ2      LYS   6  10.392  -0.651  -9.113
   59    HZ3  LYS   6           HZ3      LYS   6   9.537  -1.957  -9.783
   60    H    PHE   7           HN       PHE   7   4.932  -2.579 -13.691
   61    HA   PHE   7           HA       PHE   7   6.904  -4.346 -12.826
   62    HB2  PHE   7           HB2      PHE   7   3.981  -4.285 -12.831
   63    HB3  PHE   7           HB1      PHE   7   4.517  -5.913 -13.331
   64    HD1  PHE   7           HD1      PHE   7   3.923  -3.726 -10.503
   65    HD2  PHE   7           HD2      PHE   7   6.105  -7.087 -11.957
   66    HE1  PHE   7           HE1      PHE   7   4.301  -4.513  -8.213
   67    HE2  PHE   7           HE2      PHE   7   6.471  -7.850  -9.742
   68    HZ   PHE   7           HZ       PHE   7   5.576  -6.582  -7.798
   69    H    PHE   8           HN       PHE   8   4.642  -4.553 -15.551
   70    HA   PHE   8           HA       PHE   8   5.773  -7.042 -16.248
   71    HB2  PHE   8           HB2      PHE   8   4.613  -5.635 -18.470
   72    HB3  PHE   8           HB1      PHE   8   4.239  -7.237 -17.793
   73    HD1  PHE   8           HD1      PHE   8   3.424  -4.271 -18.773
   74    HD2  PHE   8           HD2      PHE   8   2.534  -7.075 -15.721
   75    HE1  PHE   8           HE1      PHE   8   1.396  -3.327 -18.597
   76    HE2  PHE   8           HE2      PHE   8   0.351  -6.080 -15.515
   77    HZ   PHE   8           HZ       PHE   8  -0.263  -4.205 -16.971
   78    H    ARG   9           HN       ARG   9   6.532  -3.708 -16.965
   79    HA   ARG   9           HA       ARG   9   7.416  -4.028 -19.556
   80    HB2  ARG   9           HB2      ARG   9   7.641  -2.147 -17.324
   81    HB3  ARG   9           HB1      ARG   9   9.179  -2.157 -18.231
   82    HG2  ARG   9           HG2      ARG   9   8.072  -1.353 -20.267
   83    HG3  ARG   9           HG1      ARG   9   6.445  -1.629 -19.564
   84    HD2  ARG   9           HD2      ARG   9   6.772   0.766 -19.385
   85    HD3  ARG   9           HD1      ARG   9   7.149   0.164 -17.708
   86    HE   ARG   9           HE       ARG   9   9.596   0.174 -19.272
   87   HH11  ARG   9          HH11      ARG   9   7.265   2.519 -17.819
   88   HH12  ARG   9          HH12      ARG   9   8.449   3.768 -17.621
   89   HH21  ARG   9          HH21      ARG   9  11.148   1.894 -18.978
   90   HH22  ARG   9          HH22      ARG   9  10.672   3.409 -18.286
   91    H    ASP  10           HN       ASP  10   8.993  -4.421 -16.426
   92    HA   ASP  10           HA       ASP  10  11.419  -5.297 -17.603
   93    HB2  ASP  10           HB2      ASP  10  10.544  -5.200 -14.630
   94    HB3  ASP  10           HB1      ASP  10  12.202  -5.640 -15.179
   95    H    ALA  11           HN       ALA  11   8.394  -6.828 -17.144
   96    HA   ALA  11           HA       ALA  11   9.658  -9.388 -16.418
   97    HB1  ALA  11           HB1      ALA  11   7.501 -10.227 -15.872
   98    HB2  ALA  11           HB2      ALA  11   6.678  -8.967 -16.878
   99    HB3  ALA  11           HB3      ALA  11   7.448  -8.511 -15.310
  100    H    ILE  12           HN       ILE  12   7.631  -7.937 -18.961
  101    HA   ILE  12           HA       ILE  12   7.693 -10.378 -20.519
  102    HB   ILE  12           HB       ILE  12   6.519  -7.609 -21.090
  103   HG12  ILE  12          HG12      ILE  12   5.175 -10.040 -19.756
  104   HG13  ILE  12          HG11      ILE  12   5.645  -8.466 -19.004
  105   HG21  ILE  12          HG21      ILE  12   4.973  -8.950 -22.727
  106   HG22  ILE  12          HG22      ILE  12   5.991 -10.402 -22.421
  107   HG23  ILE  12          HG23      ILE  12   6.703  -8.945 -23.208
  108   HD11  ILE  12          HD11      ILE  12   4.020  -7.248 -20.496
  109   HD12  ILE  12          HD12      ILE  12   3.205  -8.469 -19.446
  110   HD13  ILE  12          HD13      ILE  12   3.469  -8.826 -21.193
  111    H    LEU  13           HN       LEU  13   8.966  -7.051 -20.493
  112    HA   LEU  13           HA       LEU  13   9.904  -7.323 -23.198
  113    HB2  LEU  13           HB2      LEU  13  10.283  -4.991 -21.244
  114    HB3  LEU  13           HB1      LEU  13  10.461  -4.923 -23.053
  115    HG   LEU  13           HG       LEU  13   7.926  -5.266 -21.347
  116   HD11  LEU  13          HD11      LEU  13   7.204  -3.097 -22.122
  117   HD12  LEU  13          HD12      LEU  13   8.542  -2.992 -23.340
  118   HD13  LEU  13          HD13      LEU  13   8.919  -2.951 -21.572
  119   HD21  LEU  13          HD21      LEU  13   8.131  -5.596 -24.424
  120   HD22  LEU  13          HD22      LEU  13   6.608  -5.004 -23.651
  121   HD23  LEU  13          HD23      LEU  13   7.260  -6.622 -23.222
  122    H    GLN  14           HN       GLN  14  11.077  -8.326 -20.229
  123    HA   GLN  14           HA       GLN  14  13.838  -7.594 -20.968
  124    HB2  GLN  14           HB2      GLN  14  12.489  -8.762 -18.551
  125    HB3  GLN  14           HB1      GLN  14  14.185  -9.298 -18.860
  126    HG2  GLN  14           HG2      GLN  14  14.606  -6.654 -19.210
  127    HG3  GLN  14           HG1      GLN  14  13.058  -6.519 -18.310
  128   HE21  GLN  14          HE21      GLN  14  16.310  -8.246 -18.089
  129   HE22  GLN  14          HE22      GLN  14  16.451  -8.131 -16.367
  130    H    ARG  15           HN       ARG  15  11.410  -9.848 -21.640
  131    HA   ARG  15           HA       ARG  15  13.253 -12.036 -22.182
  132    HB2  ARG  15           HB2      ARG  15  10.327 -11.740 -23.064
  133    HB3  ARG  15           HB1      ARG  15  11.271 -13.269 -22.896
  134    HG2  ARG  15           HG2      ARG  15  11.387 -12.951 -20.427
  135    HG3  ARG  15           HG1      ARG  15  10.549 -11.356 -20.597
  136    HD2  ARG  15           HD2      ARG  15   8.474 -12.356 -21.257
  137    HD3  ARG  15           HD1      ARG  15   9.220 -13.998 -21.521
  138    HE   ARG  15           HE       ARG  15   9.683 -13.268 -18.783
  139   HH11  ARG  15          HH11      ARG  15   6.860 -14.001 -20.916
  140   HH12  ARG  15          HH12      ARG  15   5.867 -14.577 -19.620
  141   HH21  ARG  15          HH21      ARG  15   8.291 -14.054 -17.073
  142   HH22  ARG  15          HH22      ARG  15   6.688 -14.607 -17.422
  143    H    LYS  16           HN       LYS  16  11.323  -9.552 -23.949
  144    HA   LYS  16           HA       LYS  16  12.860 -10.195 -26.382
  145    HB2  LYS  16           HB2      LYS  16  10.183  -8.808 -25.793
  146    HB3  LYS  16           HB1      LYS  16  11.055  -8.432 -27.318
  147    HG2  LYS  16           HG2      LYS  16   9.387 -10.116 -27.774
  148    HG3  LYS  16           HG1      LYS  16  11.002 -10.869 -27.946
  149    HD2  LYS  16           HD2      LYS  16  10.739 -12.165 -25.887
  150    HD3  LYS  16           HD1      LYS  16   9.367 -11.149 -25.336
  151    HE2  LYS  16           HE2      LYS  16   8.444 -13.299 -26.085
  152    HE3  LYS  16           HE1      LYS  16   7.972 -12.066 -27.320
  153    HZ1  LYS  16           HZ1      LYS  16   8.723 -13.824 -28.552
  154    HZ2  LYS  16           HZ2      LYS  16   9.980 -14.230 -27.487
  155    HZ3  LYS  16           HZ3      LYS  16  10.118 -12.860 -28.480
  156    H    LYS  17           HN       LYS  17  14.837  -9.082 -26.208
  157    HA   LYS  17           HA       LYS  17  14.707  -6.205 -26.267
  158    HB2  LYS  17           HB2      LYS  17  15.340  -7.539 -23.678
  159    HB3  LYS  17           HB1      LYS  17  16.783  -6.656 -24.264
  160    HG2  LYS  17           HG2      LYS  17  14.029  -5.256 -24.125
  161    HG3  LYS  17           HG1      LYS  17  15.028  -5.450 -22.646
  162    HD2  LYS  17           HD2      LYS  17  16.945  -4.251 -23.830
  163    HD3  LYS  17           HD1      LYS  17  15.877  -4.001 -25.257
  164    HE2  LYS  17           HE2      LYS  17  14.292  -2.635 -23.845
  165    HE3  LYS  17           HE1      LYS  17  15.353  -2.897 -22.400
  166    HZ1  LYS  17           HZ1      LYS  17  15.843  -0.811 -23.348
  167    HZ2  LYS  17           HZ2      LYS  17  16.020  -1.447 -24.912
  168    HZ3  LYS  17           HZ3      LYS  17  17.152  -1.832 -23.707
  Start of MODEL   11
    1    H1   GLU   1           HT1      GLU   1   1.175   8.212 -16.412
    2    H2   GLU   1           HT2      GLU   1  -0.048   7.266 -15.712
    3    H3   GLU   1           HT3      GLU   1   0.733   6.735 -17.122
    4    HA   GLU   1           HA       GLU   1   2.584   6.077 -16.073
    5    HB2  GLU   1           HB2      GLU   1   1.859   8.171 -13.914
    6    HB3  GLU   1           HB1      GLU   1   3.174   6.962 -13.657
    7    HG2  GLU   1           HG2      GLU   1   4.409   7.844 -15.677
    8    HG3  GLU   1           HG1      GLU   1   3.096   9.054 -15.958
    9    H    MET   2           HN       MET   2   2.303   3.952 -15.514
   10    HA   MET   2           HA       MET   2   0.499   3.353 -13.255
   11    HB2  MET   2           HB2      MET   2   0.719   1.869 -15.953
   12    HB3  MET   2           HB1      MET   2  -0.048   1.149 -14.486
   13    HG2  MET   2           HG2      MET   2  -1.731   3.009 -14.436
   14    HG3  MET   2           HG1      MET   2  -0.986   3.744 -15.889
   15    HE1  MET   2           HE1      MET   2  -1.926   1.582 -18.860
   16    HE2  MET   2           HE2      MET   2  -0.415   2.074 -18.029
   17    HE3  MET   2           HE3      MET   2  -1.731   3.269 -18.275
   18    H    ARG   3           HN       ARG   3   1.149   1.613 -11.928
   19    HA   ARG   3           HA       ARG   3   3.996   1.065 -12.040
   20    HB2  ARG   3           HB2      ARG   3   1.898   0.259  -9.925
   21    HB3  ARG   3           HB1      ARG   3   3.678   0.057  -9.747
   22    HG2  ARG   3           HG2      ARG   3   2.181   2.741 -10.015
   23    HG3  ARG   3           HG1      ARG   3   2.778   2.011  -8.485
   24    HD2  ARG   3           HD2      ARG   3   5.175   2.071  -9.513
   25    HD3  ARG   3           HD1      ARG   3   4.475   3.066 -10.864
   26    HE   ARG   3           HE       ARG   3   3.659   4.261  -8.364
   27   HH11  ARG   3          HH11      ARG   3   6.688   3.743 -10.262
   28   HH12  ARG   3          HH12      ARG   3   7.474   5.153  -9.632
   29   HH21  ARG   3          HH21      ARG   3   4.769   6.147  -7.549
   30   HH22  ARG   3          HH22      ARG   3   6.374   6.528  -8.080
   31    H    LEU   4           HN       LEU   4   1.194  -0.432 -13.148
   32    HA   LEU   4           HA       LEU   4   2.266  -3.114 -12.847
   33    HB2  LEU   4           HB2      LEU   4  -0.227  -2.015 -14.239
   34    HB3  LEU   4           HB1      LEU   4   0.206  -3.762 -14.073
   35    HG   LEU   4           HG       LEU   4   0.479  -2.887 -11.465
   36   HD11  LEU   4          HD11      LEU   4  -1.758  -1.654 -10.932
   37   HD12  LEU   4          HD12      LEU   4  -1.745  -1.161 -12.669
   38   HD13  LEU   4          HD13      LEU   4  -0.368  -0.689 -11.583
   39   HD21  LEU   4          HD21      LEU   4  -2.087  -4.061 -12.716
   40   HD22  LEU   4          HD22      LEU   4  -1.562  -4.207 -10.994
   41   HD23  LEU   4          HD23      LEU   4  -0.593  -4.994 -12.308
   42    H    SER   5           HN       SER   5   2.016  -0.455 -15.146
   43    HA   SER   5           HA       SER   5   2.907  -2.062 -17.308
   44    HB2  SER   5           HB2      SER   5   2.855   1.004 -17.116
   45    HB3  SER   5           HB1      SER   5   3.192   0.017 -18.601
   46    HG   SER   5           HG       SER   5   0.957  -0.881 -17.568
   47    H    LYS   6           HN       LYS   6   4.297  -0.604 -14.460
   48    HA   LYS   6           HA       LYS   6   6.861  -0.330 -15.641
   49    HB2  LYS   6           HB2      LYS   6   6.136   1.321 -13.950
   50    HB3  LYS   6           HB1      LYS   6   5.847   0.003 -12.785
   51    HG2  LYS   6           HG2      LYS   6   8.680   0.078 -13.785
   52    HG3  LYS   6           HG1      LYS   6   8.168   1.593 -12.965
   53    HD2  LYS   6           HD2      LYS   6   7.432   0.299 -10.967
   54    HD3  LYS   6           HD1      LYS   6   7.853  -1.245 -11.788
   55    HE2  LYS   6           HE2      LYS   6  10.291  -0.568 -11.829
   56    HE3  LYS   6           HE1      LYS   6   9.873   1.008 -11.039
   57    HZ1  LYS   6           HZ1      LYS   6  10.101  -1.655  -9.921
   58    HZ2  LYS   6           HZ2      LYS   6   8.763  -0.765  -9.370
   59    HZ3  LYS   6           HZ3      LYS   6  10.330  -0.129  -9.210
   60    H    PHE   7           HN       PHE   7   4.939  -2.576 -13.666
   61    HA   PHE   7           HA       PHE   7   6.948  -4.306 -12.785
   62    HB2  PHE   7           HB2      PHE   7   4.034  -4.258 -12.701
   63    HB3  PHE   7           HB1      PHE   7   4.538  -5.891 -13.214
   64    HD1  PHE   7           HD1      PHE   7   4.079  -3.681 -10.372
   65    HD2  PHE   7           HD2      PHE   7   6.159  -7.073 -11.905
   66    HE1  PHE   7           HE1      PHE   7   4.550  -4.464  -8.093
   67    HE2  PHE   7           HE2      PHE   7   6.616  -7.833  -9.703
   68    HZ   PHE   7           HZ       PHE   7   5.822  -6.547  -7.728
   69    H    PHE   8           HN       PHE   8   4.589  -4.677 -15.390
   70    HA   PHE   8           HA       PHE   8   5.704  -7.126 -16.175
   71    HB2  PHE   8           HB2      PHE   8   4.588  -5.480 -18.307
   72    HB3  PHE   8           HB1      PHE   8   4.251  -7.173 -17.861
   73    HD1  PHE   8           HD1      PHE   8   3.222  -4.312 -18.667
   74    HD2  PHE   8           HD2      PHE   8   2.627  -7.149 -15.565
   75    HE1  PHE   8           HE1      PHE   8   1.146  -3.480 -18.383
   76    HE2  PHE   8           HE2      PHE   8   0.415  -6.270 -15.252
   77    HZ   PHE   8           HZ       PHE   8  -0.370  -4.435 -16.674
   78    H    ARG   9           HN       ARG   9   6.423  -3.783 -16.823
   79    HA   ARG   9           HA       ARG   9   7.307  -3.966 -19.372
   80    HB2  ARG   9           HB2      ARG   9   6.911  -2.089 -17.610
   81    HB3  ARG   9           HB1      ARG   9   8.586  -2.336 -17.110
   82    HG2  ARG   9           HG2      ARG   9   9.336  -1.638 -19.407
   83    HG3  ARG   9           HG1      ARG   9   7.605  -1.365 -19.845
   84    HD2  ARG   9           HD2      ARG   9   7.387   0.394 -18.004
   85    HD3  ARG   9           HD1      ARG   9   9.130   0.115 -17.549
   86    HE   ARG   9           HE       ARG   9   9.018   0.720 -20.379
   87   HH11  ARG   9          HH11      ARG   9   8.493   2.352 -17.201
   88   HH12  ARG   9          HH12      ARG   9   8.962   3.915 -17.780
   89   HH21  ARG   9          HH21      ARG   9   9.648   2.853 -21.102
   90   HH22  ARG   9          HH22      ARG   9   9.624   4.200 -20.015
   91    H    ASP  10           HN       ASP  10   8.976  -4.530 -16.302
   92    HA   ASP  10           HA       ASP  10  11.377  -5.298 -17.583
   93    HB2  ASP  10           HB2      ASP  10  10.568  -5.224 -14.596
   94    HB3  ASP  10           HB1      ASP  10  12.199  -5.741 -15.156
   95    H    ALA  11           HN       ALA  11   8.387  -6.872 -17.074
   96    HA   ALA  11           HA       ALA  11   9.682  -9.437 -16.445
   97    HB1  ALA  11           HB1      ALA  11   7.529 -10.291 -15.889
   98    HB2  ALA  11           HB2      ALA  11   6.694  -8.997 -16.842
   99    HB3  ALA  11           HB3      ALA  11   7.497  -8.591 -15.276
  100    H    ILE  12           HN       ILE  12   7.573  -7.953 -18.902
  101    HA   ILE  12           HA       ILE  12   7.640 -10.347 -20.525
  102    HB   ILE  12           HB       ILE  12   6.398  -7.589 -20.994
  103   HG12  ILE  12          HG12      ILE  12   5.165 -10.075 -19.656
  104   HG13  ILE  12          HG11      ILE  12   5.598  -8.484 -18.912
  105   HG21  ILE  12          HG21      ILE  12   6.549  -8.882 -23.149
  106   HG22  ILE  12          HG22      ILE  12   4.837  -8.914 -22.624
  107   HG23  ILE  12          HG23      ILE  12   5.877 -10.364 -22.371
  108   HD11  ILE  12          HD11      ILE  12   3.885  -7.327 -20.355
  109   HD12  ILE  12          HD12      ILE  12   3.146  -8.581 -19.286
  110   HD13  ILE  12          HD13      ILE  12   3.374  -8.924 -21.040
  111    H    LEU  13           HN       LEU  13   8.846  -6.998 -20.453
  112    HA   LEU  13           HA       LEU  13   9.677  -7.175 -23.200
  113    HB2  LEU  13           HB2      LEU  13  10.092  -4.907 -21.182
  114    HB3  LEU  13           HB1      LEU  13  10.203  -4.770 -22.993
  115    HG   LEU  13           HG       LEU  13   7.739  -5.202 -21.205
  116   HD11  LEU  13          HD11      LEU  13   7.000  -3.021 -21.766
  117   HD12  LEU  13          HD12      LEU  13   8.116  -2.874 -23.186
  118   HD13  LEU  13          HD13      LEU  13   8.780  -2.853 -21.508
  119   HD21  LEU  13          HD21      LEU  13   6.328  -4.896 -23.445
  120   HD22  LEU  13          HD22      LEU  13   7.019  -6.516 -23.089
  121   HD23  LEU  13          HD23      LEU  13   7.826  -5.443 -24.296
  122    H    GLN  14           HN       GLN  14  10.990  -8.246 -20.318
  123    HA   GLN  14           HA       GLN  14  13.707  -7.439 -21.145
  124    HB2  GLN  14           HB2      GLN  14  12.469  -8.632 -18.682
  125    HB3  GLN  14           HB1      GLN  14  14.163  -9.128 -19.050
  126    HG2  GLN  14           HG2      GLN  14  14.527  -6.484 -19.405
  127    HG3  GLN  14           HG1      GLN  14  12.996  -6.371 -18.471
  128   HE21  GLN  14          HE21      GLN  14  16.268  -8.068 -18.316
  129   HE22  GLN  14          HE22      GLN  14  16.449  -7.935 -16.600
  130    H    ARG  15           HN       ARG  15  11.308  -9.765 -21.703
  131    HA   ARG  15           HA       ARG  15  13.134 -11.954 -22.217
  132    HB2  ARG  15           HB2      ARG  15  10.243 -11.579 -23.185
  133    HB3  ARG  15           HB1      ARG  15  11.146 -13.137 -23.053
  134    HG2  ARG  15           HG2      ARG  15  11.249 -12.877 -20.568
  135    HG3  ARG  15           HG1      ARG  15  10.414 -11.276 -20.716
  136    HD2  ARG  15           HD2      ARG  15   8.353 -12.266 -21.447
  137    HD3  ARG  15           HD1      ARG  15   9.103 -13.907 -21.702
  138    HE   ARG  15           HE       ARG  15   9.506 -13.203 -18.953
  139   HH11  ARG  15          HH11      ARG  15   6.717 -13.874 -21.148
  140   HH12  ARG  15          HH12      ARG  15   5.690 -14.451 -19.877
  141   HH21  ARG  15          HH21      ARG  15   8.071 -13.990 -17.279
  142   HH22  ARG  15          HH22      ARG  15   6.466 -14.515 -17.664
  143    H    LYS  16           HN       LYS  16  11.356  -9.436 -24.065
  144    HA   LYS  16           HA       LYS  16  12.939 -10.131 -26.452
  145    HB2  LYS  16           HB2      LYS  16  10.346  -8.564 -25.909
  146    HB3  LYS  16           HB1      LYS  16  11.271  -8.264 -27.419
  147    HG2  LYS  16           HG2      LYS  16   9.455  -9.816 -27.858
  148    HG3  LYS  16           HG1      LYS  16  11.019 -10.664 -28.071
  149    HD2  LYS  16           HD2      LYS  16  10.711 -11.968 -26.018
  150    HD3  LYS  16           HD1      LYS  16   9.403 -10.886 -25.441
  151    HE2  LYS  16           HE2      LYS  16   8.342 -12.956 -26.203
  152    HE3  LYS  16           HE1      LYS  16   7.952 -11.698 -27.442
  153    HZ1  LYS  16           HZ1      LYS  16   8.590 -13.544 -28.637
  154    HZ2  LYS  16           HZ2      LYS  16   9.868 -13.954 -27.597
  155    HZ3  LYS  16           HZ3      LYS  16  10.009 -12.610 -28.627
  156    H    LYS  17           HN       LYS  17  14.978  -9.132 -26.168
  157    HA   LYS  17           HA       LYS  17  15.018  -6.254 -26.131
  158    HB2  LYS  17           HB2      LYS  17  15.502  -7.749 -23.573
  159    HB3  LYS  17           HB1      LYS  17  16.957  -6.823 -24.056
  160    HG2  LYS  17           HG2      LYS  17  14.189  -5.452 -23.939
  161    HG3  LYS  17           HG1      LYS  17  15.135  -5.720 -22.438
  162    HD2  LYS  17           HD2      LYS  17  17.079  -4.444 -23.482
  163    HD3  LYS  17           HD1      LYS  17  16.070  -4.134 -24.939
  164    HE2  LYS  17           HE2      LYS  17  14.412  -2.853 -23.530
  165    HE3  LYS  17           HE1      LYS  17  15.420  -3.172 -22.057
  166    HZ1  LYS  17           HZ1      LYS  17  15.943  -1.048 -22.866
  167    HZ2  LYS  17           HZ2      LYS  17  16.140  -1.582 -24.466
  168    HZ3  LYS  17           HZ3      LYS  17  17.260  -2.039 -23.274
  Start of MODEL   12
    1    H1   GLU   1           HT1      GLU   1   3.816   7.756 -15.054
    2    H2   GLU   1           HT2      GLU   1   3.974   6.079 -15.268
    3    H3   GLU   1           HT3      GLU   1   3.508   6.701 -13.759
    4    HA   GLU   1           HA       GLU   1   1.522   7.641 -14.829
    5    HB2  GLU   1           HB2      GLU   1   2.597   5.914 -17.152
    6    HB3  GLU   1           HB1      GLU   1   0.839   6.296 -17.019
    7    HG2  GLU   1           HG2      GLU   1   1.353   8.775 -17.084
    8    HG3  GLU   1           HG1      GLU   1   3.115   8.407 -17.227
    9    H    MET   2           HN       MET   2   2.539   4.158 -15.525
   10    HA   MET   2           HA       MET   2   0.581   3.333 -13.467
   11    HB2  MET   2           HB2      MET   2   1.091   1.941 -16.171
   12    HB3  MET   2           HB1      MET   2   0.104   1.252 -14.825
   13    HG2  MET   2           HG2      MET   2  -1.504   3.175 -15.032
   14    HG3  MET   2           HG1      MET   2  -0.528   3.854 -16.376
   15    HE1  MET   2           HE1      MET   2  -3.779   2.703 -18.161
   16    HE2  MET   2           HE2      MET   2  -2.607   4.030 -17.851
   17    HE3  MET   2           HE3      MET   2  -3.597   3.372 -16.502
   18    H    ARG   3           HN       ARG   3   1.217   1.619 -12.158
   19    HA   ARG   3           HA       ARG   3   4.056   1.021 -12.209
   20    HB2  ARG   3           HB2      ARG   3   1.871   0.277 -10.166
   21    HB3  ARG   3           HB1      ARG   3   3.626  -0.069  -9.952
   22    HG2  ARG   3           HG2      ARG   3   2.425   2.754 -10.267
   23    HG3  ARG   3           HG1      ARG   3   2.751   1.946  -8.693
   24    HD2  ARG   3           HD2      ARG   3   5.223   1.717  -9.384
   25    HD3  ARG   3           HD1      ARG   3   4.852   2.716 -10.859
   26    HE   ARG   3           HE       ARG   3   3.871   4.154  -8.568
   27   HH11  ARG   3          HH11      ARG   3   7.048   3.062  -9.896
   28   HH12  ARG   3          HH12      ARG   3   7.928   4.396  -9.229
   29   HH21  ARG   3          HH21      ARG   3   5.106   5.925  -7.695
   30   HH22  ARG   3          HH22      ARG   3   6.812   6.039  -7.965
   31    H    LEU   4           HN       LEU   4   1.237  -0.406 -13.398
   32    HA   LEU   4           HA       LEU   4   2.262  -3.103 -13.077
   33    HB2  LEU   4           HB2      LEU   4  -0.214  -1.936 -14.428
   34    HB3  LEU   4           HB1      LEU   4   0.186  -3.699 -14.348
   35    HG   LEU   4           HG       LEU   4   0.558  -2.894 -11.715
   36   HD11  LEU   4          HD11      LEU   4  -1.689  -1.142 -12.802
   37   HD12  LEU   4          HD12      LEU   4  -0.304  -0.727 -11.706
   38   HD13  LEU   4          HD13      LEU   4  -1.690  -1.716 -11.088
   39   HD21  LEU   4          HD21      LEU   4  -1.435  -4.258 -11.199
   40   HD22  LEU   4          HD22      LEU   4  -0.498  -4.998 -12.560
   41   HD23  LEU   4          HD23      LEU   4  -2.023  -4.089 -12.899
   42    H    SER   5           HN       SER   5   2.088  -0.480 -15.415
   43    HA   SER   5           HA       SER   5   2.972  -2.160 -17.522
   44    HB2  SER   5           HB2      SER   5   3.005   0.905 -17.420
   45    HB3  SER   5           HB1      SER   5   3.316  -0.141 -18.868
   46    HG   SER   5           HG       SER   5   1.088  -1.007 -18.031
   47    H    LYS   6           HN       LYS   6   4.334  -0.616 -14.699
   48    HA   LYS   6           HA       LYS   6   6.933  -0.450 -15.808
   49    HB2  LYS   6           HB2      LYS   6   6.174   1.271 -14.195
   50    HB3  LYS   6           HB1      LYS   6   5.880  -0.009 -12.988
   51    HG2  LYS   6           HG2      LYS   6   8.707   0.016 -13.995
   52    HG3  LYS   6           HG1      LYS   6   8.209   1.564 -13.223
   53    HD2  LYS   6           HD2      LYS   6   7.518   0.397 -11.171
   54    HD3  LYS   6           HD1      LYS   6   7.785  -1.209 -11.940
   55    HE2  LYS   6           HE2      LYS   6  10.274  -0.694 -12.110
   56    HE3  LYS   6           HE1      LYS   6   9.986   0.900 -11.296
   57    HZ1  LYS   6           HZ1      LYS   6  10.727  -1.078  -9.913
   58    HZ2  LYS   6           HZ2      LYS   6   9.135  -1.651 -10.057
   59    HZ3  LYS   6           HZ3      LYS   6   9.434  -0.145  -9.331
   60    H    PHE   7           HN       PHE   7   4.919  -2.600 -13.829
   61    HA   PHE   7           HA       PHE   7   6.870  -4.336 -12.835
   62    HB2  PHE   7           HB2      PHE   7   3.952  -4.259 -12.889
   63    HB3  PHE   7           HB1      PHE   7   4.468  -5.907 -13.327
   64    HD1  PHE   7           HD1      PHE   7   3.857  -3.623 -10.575
   65    HD2  PHE   7           HD2      PHE   7   6.003  -7.060 -11.895
   66    HE1  PHE   7           HE1      PHE   7   4.158  -4.360  -8.258
   67    HE2  PHE   7           HE2      PHE   7   6.300  -7.775  -9.656
   68    HZ   PHE   7           HZ       PHE   7   5.385  -6.443  -7.762
   69    H    PHE   8           HN       PHE   8   4.601  -4.722 -15.523
   70    HA   PHE   8           HA       PHE   8   5.721  -7.204 -16.199
   71    HB2  PHE   8           HB2      PHE   8   4.673  -5.656 -18.423
   72    HB3  PHE   8           HB1      PHE   8   4.297  -7.318 -17.894
   73    HD1  PHE   8           HD1      PHE   8   3.355  -4.441 -18.838
   74    HD2  PHE   8           HD2      PHE   8   2.591  -7.190 -15.696
   75    HE1  PHE   8           HE1      PHE   8   1.290  -3.553 -18.643
   76    HE2  PHE   8           HE2      PHE   8   0.387  -6.254 -15.478
   77    HZ   PHE   8           HZ       PHE   8  -0.308  -4.437 -16.968
   78    H    ARG   9           HN       ARG   9   6.486  -3.880 -16.883
   79    HA   ARG   9           HA       ARG   9   7.473  -4.116 -19.393
   80    HB2  ARG   9           HB2      ARG   9   7.174  -2.239 -17.495
   81    HB3  ARG   9           HB1      ARG   9   8.908  -2.477 -17.253
   82    HG2  ARG   9           HG2      ARG   9   9.336  -1.731 -19.598
   83    HG3  ARG   9           HG1      ARG   9   7.555  -1.567 -19.859
   84    HD2  ARG   9           HD2      ARG   9   7.457   0.178 -17.956
   85    HD3  ARG   9           HD1      ARG   9   9.271   0.066 -17.821
   86    HE   ARG   9           HE       ARG   9   8.732   0.620 -20.565
   87   HH11  ARG   9          HH11      ARG   9   8.119   2.230 -17.384
   88   HH12  ARG   9          HH12      ARG   9   8.190   3.833 -18.035
   89   HH21  ARG   9          HH21      ARG   9   8.817   2.814 -21.382
   90   HH22  ARG   9          HH22      ARG   9   8.589   4.166 -20.324
   91    H    ASP  10           HN       ASP  10   8.946  -4.724 -16.242
   92    HA   ASP  10           HA       ASP  10  11.384  -5.568 -17.418
   93    HB2  ASP  10           HB2      ASP  10  10.513  -5.544 -14.443
   94    HB3  ASP  10           HB1      ASP  10  12.169  -5.966 -15.019
   95    H    ALA  11           HN       ALA  11   8.346  -7.053 -17.013
   96    HA   ALA  11           HA       ALA  11   9.555  -9.640 -16.304
   97    HB1  ALA  11           HB1      ALA  11   7.337  -8.714 -15.230
   98    HB2  ALA  11           HB2      ALA  11   7.378 -10.436 -15.780
   99    HB3  ALA  11           HB3      ALA  11   6.589  -9.172 -16.809
  100    H    ILE  12           HN       ILE  12   7.646  -8.094 -18.870
  101    HA   ILE  12           HA       ILE  12   7.754 -10.495 -20.505
  102    HB   ILE  12           HB       ILE  12   6.564  -7.721 -21.031
  103   HG12  ILE  12          HG12      ILE  12   5.225 -10.175 -19.739
  104   HG13  ILE  12          HG11      ILE  12   5.664  -8.595 -18.977
  105   HG21  ILE  12          HG21      ILE  12   5.052  -9.077 -22.706
  106   HG22  ILE  12          HG22      ILE  12   6.109 -10.504 -22.412
  107   HG23  ILE  12          HG23      ILE  12   6.787  -9.014 -23.164
  108   HD11  ILE  12          HD11      ILE  12   3.231  -8.625 -19.452
  109   HD12  ILE  12          HD12      ILE  12   3.521  -8.986 -21.194
  110   HD13  ILE  12          HD13      ILE  12   4.046  -7.398 -20.498
  111    H    LEU  13           HN       LEU  13   8.957  -7.132 -20.341
  112    HA   LEU  13           HA       LEU  13   9.942  -7.303 -23.036
  113    HB2  LEU  13           HB2      LEU  13  10.201  -5.008 -21.032
  114    HB3  LEU  13           HB1      LEU  13  10.426  -4.899 -22.835
  115    HG   LEU  13           HG       LEU  13   7.865  -5.350 -21.201
  116   HD11  LEU  13          HD11      LEU  13   7.174  -3.189 -21.733
  117   HD12  LEU  13          HD12      LEU  13   8.194  -3.071 -23.224
  118   HD13  LEU  13          HD13      LEU  13   8.963  -2.978 -21.595
  119   HD21  LEU  13          HD21      LEU  13   6.595  -5.129 -23.532
  120   HD22  LEU  13          HD22      LEU  13   7.302  -6.721 -23.096
  121   HD23  LEU  13          HD23      LEU  13   8.154  -5.655 -24.273
  122    H    GLN  14           HN       GLN  14  11.150  -8.280 -20.035
  123    HA   GLN  14           HA       GLN  14  13.875  -7.436 -20.775
  124    HB2  GLN  14           HB2      GLN  14  12.616  -8.860 -18.431
  125    HB3  GLN  14           HB1      GLN  14  14.375  -9.119 -18.735
  126    HG2  GLN  14           HG2      GLN  14  13.187  -6.290 -18.736
  127    HG3  GLN  14           HG1      GLN  14  13.516  -7.120 -17.163
  128   HE21  GLN  14          HE21      GLN  14  15.826  -8.043 -16.869
  129   HE22  GLN  14          HE22      GLN  14  17.150  -7.150 -17.541
  130    H    ARG  15           HN       ARG  15  11.541  -9.757 -21.514
  131    HA   ARG  15           HA       ARG  15  13.497 -11.793 -22.225
  132    HB2  ARG  15           HB2      ARG  15  10.559 -11.795 -23.035
  133    HB3  ARG  15           HB1      ARG  15  11.644 -13.202 -22.717
  134    HG2  ARG  15           HG2      ARG  15  11.674 -12.576 -20.262
  135    HG3  ARG  15           HG1      ARG  15  10.574 -11.194 -20.641
  136    HD2  ARG  15           HD2      ARG  15   9.184 -12.982 -19.779
  137    HD3  ARG  15           HD1      ARG  15   8.876 -12.891 -21.563
  138    HE   ARG  15           HE       ARG  15  10.983 -14.836 -21.021
  139   HH11  ARG  15          HH11      ARG  15   7.413 -14.420 -20.703
  140   HH12  ARG  15          HH12      ARG  15   7.073 -16.115 -20.800
  141   HH21  ARG  15          HH21      ARG  15  10.468 -17.117 -21.160
  142   HH22  ARG  15          HH22      ARG  15   8.827 -17.661 -21.062
  143    H    LYS  16           HN       LYS  16  11.213  -9.441 -23.730
  144    HA   LYS  16           HA       LYS  16  12.599  -9.845 -26.299
  145    HB2  LYS  16           HB2      LYS  16   9.831  -8.895 -25.418
  146    HB3  LYS  16           HB1      LYS  16  10.494  -8.231 -26.947
  147    HG2  LYS  16           HG2      LYS  16   9.062 -10.119 -27.460
  148    HG3  LYS  16           HG1      LYS  16  10.753 -10.553 -27.858
  149    HD2  LYS  16           HD2      LYS  16  10.892 -11.945 -25.729
  150    HD3  LYS  16           HD1      LYS  16   9.207 -11.461 -25.320
  151    HE2  LYS  16           HE2      LYS  16   8.348 -12.646 -27.366
  152    HE3  LYS  16           HE1      LYS  16  10.044 -13.078 -27.840
  153    HZ1  LYS  16           HZ1      LYS  16   9.708 -13.895 -25.213
  154    HZ2  LYS  16           HZ2      LYS  16   9.804 -14.859 -26.609
  155    HZ3  LYS  16           HZ3      LYS  16   8.290 -14.357 -26.026
  156    H    LYS  17           HN       LYS  17  14.452  -8.551 -26.239
  157    HA   LYS  17           HA       LYS  17  14.014  -5.689 -26.122
  158    HB2  LYS  17           HB2      LYS  17  15.092  -7.113 -23.748
  159    HB3  LYS  17           HB1      LYS  17  16.387  -6.093 -24.448
  160    HG2  LYS  17           HG2      LYS  17  13.608  -4.869 -23.927
  161    HG3  LYS  17           HG1      LYS  17  14.716  -5.157 -22.546
  162    HD2  LYS  17           HD2      LYS  17  16.497  -3.776 -23.789
  163    HD3  LYS  17           HD1      LYS  17  15.255  -3.403 -25.038
  164    HE2  LYS  17           HE2      LYS  17  13.809  -2.297 -23.283
  165    HE3  LYS  17           HE1      LYS  17  15.046  -2.691 -22.019
  166    HZ1  LYS  17           HZ1      LYS  17  15.175  -0.427 -22.896
  167    HZ2  LYS  17           HZ2      LYS  17  15.553  -1.031 -24.437
  168    HZ3  LYS  17           HZ3      LYS  17  16.608  -1.304 -23.136
  Start of MODEL   13
    1    H1   GLU   1           HT1      GLU   1   3.168   7.434 -14.056
    2    H2   GLU   1           HT2      GLU   1   3.626   7.223 -15.677
    3    H3   GLU   1           HT3      GLU   1   3.528   5.881 -14.643
    4    HA   GLU   1           HA       GLU   1   1.159   7.523 -14.982
    5    HB2  GLU   1           HB2      GLU   1   2.264   5.575 -17.117
    6    HB3  GLU   1           HB1      GLU   1   0.504   5.961 -17.012
    7    HG2  GLU   1           HG2      GLU   1   0.997   8.413 -17.379
    8    HG3  GLU   1           HG1      GLU   1   2.764   8.047 -17.479
    9    H    MET   2           HN       MET   2   2.244   4.031 -15.435
   10    HA   MET   2           HA       MET   2   0.441   3.309 -13.210
   11    HB2  MET   2           HB2      MET   2   0.795   1.790 -15.872
   12    HB3  MET   2           HB1      MET   2  -0.068   1.138 -14.430
   13    HG2  MET   2           HG2      MET   2  -1.753   2.989 -14.597
   14    HG3  MET   2           HG1      MET   2  -0.898   3.649 -16.032
   15    HE1  MET   2           HE1      MET   2  -3.104   3.690 -17.341
   16    HE2  MET   2           HE2      MET   2  -3.963   3.034 -15.904
   17    HE3  MET   2           HE3      MET   2  -4.232   2.302 -17.524
   18    H    ARG   3           HN       ARG   3   1.183   1.610 -11.884
   19    HA   ARG   3           HA       ARG   3   4.041   1.119 -12.067
   20    HB2  ARG   3           HB2      ARG   3   2.047   0.270  -9.873
   21    HB3  ARG   3           HB1      ARG   3   3.842   0.169  -9.759
   22    HG2  ARG   3           HG2      ARG   3   2.154   2.740  -9.962
   23    HG3  ARG   3           HG1      ARG   3   2.948   2.091  -8.486
   24    HD2  ARG   3           HD2      ARG   3   5.228   2.324  -9.748
   25    HD3  ARG   3           HD1      ARG   3   4.317   3.243 -11.024
   26    HE   ARG   3           HE       ARG   3   3.673   4.386  -8.443
   27   HH11  ARG   3          HH11      ARG   3   6.477   4.134 -10.706
   28   HH12  ARG   3          HH12      ARG   3   7.191   5.625 -10.191
   29   HH21  ARG   3          HH21      ARG   3   4.682   6.391  -7.790
   30   HH22  ARG   3          HH22      ARG   3   6.161   6.917  -8.521
   31    H    LEU   4           HN       LEU   4   1.243  -0.413 -13.107
   32    HA   LEU   4           HA       LEU   4   2.336  -3.085 -12.811
   33    HB2  LEU   4           HB2      LEU   4  -0.186  -2.006 -14.166
   34    HB3  LEU   4           HB1      LEU   4   0.261  -3.750 -14.007
   35    HG   LEU   4           HG       LEU   4   0.570  -2.857 -11.401
   36   HD11  LEU   4          HD11      LEU   4  -1.657  -1.651 -10.831
   37   HD12  LEU   4          HD12      LEU   4  -1.726  -1.201 -12.578
   38   HD13  LEU   4          HD13      LEU   4  -0.322  -0.666 -11.559
   39   HD21  LEU   4          HD21      LEU   4  -1.992  -4.084 -12.609
   40   HD22  LEU   4          HD22      LEU   4  -1.442  -4.208 -10.893
   41   HD23  LEU   4          HD23      LEU   4  -0.477  -4.989 -12.213
   42    H    SER   5           HN       SER   5   2.044  -0.444 -15.127
   43    HA   SER   5           HA       SER   5   2.904  -2.070 -17.290
   44    HB2  SER   5           HB2      SER   5   2.867   0.998 -17.140
   45    HB3  SER   5           HB1      SER   5   3.157  -0.016 -18.615
   46    HG   SER   5           HG       SER   5   0.932  -0.861 -17.497
   47    H    LYS   6           HN       LYS   6   4.327  -0.589 -14.475
   48    HA   LYS   6           HA       LYS   6   6.876  -0.317 -15.691
   49    HB2  LYS   6           HB2      LYS   6   6.185   1.360 -14.024
   50    HB3  LYS   6           HB1      LYS   6   5.873   0.066 -12.841
   51    HG2  LYS   6           HG2      LYS   6   8.713   0.093 -13.824
   52    HG3  LYS   6           HG1      LYS   6   8.209   1.624 -13.027
   53    HD2  LYS   6           HD2      LYS   6   7.447   0.366 -11.018
   54    HD3  LYS   6           HD1      LYS   6   7.855  -1.194 -11.814
   55    HE2  LYS   6           HE2      LYS   6  10.299  -0.555 -11.843
   56    HE3  LYS   6           HE1      LYS   6   9.899   1.043 -11.090
   57    HZ1  LYS   6           HZ1      LYS   6   8.770  -1.039  -9.562
   58    HZ2  LYS   6           HZ2      LYS   6   9.963   0.093  -9.136
   59    HZ3  LYS   6           HZ3      LYS   6  10.407  -1.386  -9.842
   60    H    PHE   7           HN       PHE   7   4.975  -2.554 -13.688
   61    HA   PHE   7           HA       PHE   7   7.002  -4.271 -12.809
   62    HB2  PHE   7           HB2      PHE   7   4.087  -4.230 -12.703
   63    HB3  PHE   7           HB1      PHE   7   4.596  -5.866 -13.198
   64    HD1  PHE   7           HD1      PHE   7   4.156  -3.616 -10.382
   65    HD2  PHE   7           HD2      PHE   7   6.226  -7.026 -11.886
   66    HE1  PHE   7           HE1      PHE   7   4.647  -4.365  -8.098
   67    HE2  PHE   7           HE2      PHE   7   6.702  -7.755  -9.680
   68    HZ   PHE   7           HZ       PHE   7   5.923  -6.442  -7.714
   69    H    PHE   8           HN       PHE   8   4.611  -4.667 -15.381
   70    HA   PHE   8           HA       PHE   8   5.720  -7.120 -16.161
   71    HB2  PHE   8           HB2      PHE   8   4.572  -5.499 -18.294
   72    HB3  PHE   8           HB1      PHE   8   4.240  -7.186 -17.822
   73    HD1  PHE   8           HD1      PHE   8   3.202  -4.329 -18.642
   74    HD2  PHE   8           HD2      PHE   8   2.650  -7.139 -15.509
   75    HE1  PHE   8           HE1      PHE   8   1.130  -3.491 -18.334
   76    HE2  PHE   8           HE2      PHE   8   0.442  -6.255 -15.171
   77    HZ   PHE   8           HZ       PHE   8  -0.361  -4.432 -16.595
   78    H    ARG   9           HN       ARG   9   6.417  -3.783 -16.841
   79    HA   ARG   9           HA       ARG   9   7.275  -3.970 -19.395
   80    HB2  ARG   9           HB2      ARG   9   6.895  -2.089 -17.647
   81    HB3  ARG   9           HB1      ARG   9   8.564  -2.349 -17.134
   82    HG2  ARG   9           HG2      ARG   9   9.330  -1.659 -19.432
   83    HG3  ARG   9           HG1      ARG   9   7.604  -1.358 -19.868
   84    HD2  ARG   9           HD2      ARG   9   7.410   0.387 -18.010
   85    HD3  ARG   9           HD1      ARG   9   9.148   0.078 -17.556
   86    HE   ARG   9           HE       ARG   9   9.024   0.725 -20.383
   87   HH11  ARG   9          HH11      ARG   9   8.616   2.296 -17.157
   88   HH12  ARG   9          HH12      ARG   9   9.109   3.861 -17.713
   89   HH21  ARG   9          HH21      ARG   9   9.688   2.859 -21.076
   90   HH22  ARG   9          HH22      ARG   9   9.722   4.181 -19.957
   91    H    ASP  10           HN       ASP  10   8.959  -4.541 -16.340
   92    HA   ASP  10           HA       ASP  10  11.362  -5.287 -17.628
   93    HB2  ASP  10           HB2      ASP  10  10.569  -5.301 -14.635
   94    HB3  ASP  10           HB1      ASP  10  12.218  -5.694 -15.234
   95    H    ALA  11           HN       ALA  11   8.380  -6.877 -17.105
   96    HA   ALA  11           HA       ALA  11   9.682  -9.440 -16.487
   97    HB1  ALA  11           HB1      ALA  11   6.688  -9.012 -16.817
   98    HB2  ALA  11           HB2      ALA  11   7.524  -8.544 -15.287
   99    HB3  ALA  11           HB3      ALA  11   7.552 -10.267 -15.839
  100    H    ILE  12           HN       ILE  12   7.576  -7.941 -18.934
  101    HA   ILE  12           HA       ILE  12   7.598 -10.346 -20.559
  102    HB   ILE  12           HB       ILE  12   6.347  -7.590 -20.999
  103   HG12  ILE  12          HG12      ILE  12   5.139 -10.078 -19.643
  104   HG13  ILE  12          HG11      ILE  12   5.579  -8.487 -18.906
  105   HG21  ILE  12          HG21      ILE  12   4.751  -8.934 -22.595
  106   HG22  ILE  12          HG22      ILE  12   5.828 -10.360 -22.381
  107   HG23  ILE  12          HG23      ILE  12   6.454  -8.860 -23.158
  108   HD11  ILE  12          HD11      ILE  12   3.124  -8.583 -19.238
  109   HD12  ILE  12          HD12      ILE  12   3.320  -8.936 -20.994
  110   HD13  ILE  12          HD13      ILE  12   3.842  -7.334 -20.325
  111    H    LEU  13           HN       LEU  13   8.807  -6.995 -20.494
  112    HA   LEU  13           HA       LEU  13   9.604  -7.160 -23.258
  113    HB2  LEU  13           HB2      LEU  13  10.038  -4.904 -21.231
  114    HB3  LEU  13           HB1      LEU  13  10.131  -4.758 -23.041
  115    HG   LEU  13           HG       LEU  13   7.687  -5.199 -21.230
  116   HD11  LEU  13          HD11      LEU  13   8.039  -2.873 -23.214
  117   HD12  LEU  13          HD12      LEU  13   8.718  -2.851 -21.543
  118   HD13  LEU  13          HD13      LEU  13   6.936  -3.022 -21.787
  119   HD21  LEU  13          HD21      LEU  13   6.946  -6.516 -23.101
  120   HD22  LEU  13          HD22      LEU  13   7.737  -5.447 -24.319
  121   HD23  LEU  13          HD23      LEU  13   6.250  -4.894 -23.455
  122    H    GLN  14           HN       GLN  14  10.955  -8.202 -20.360
  123    HA   GLN  14           HA       GLN  14  13.660  -7.419 -21.232
  124    HB2  GLN  14           HB2      GLN  14  12.444  -8.576 -18.746
  125    HB3  GLN  14           HB1      GLN  14  14.136  -9.073 -19.120
  126    HG2  GLN  14           HG2      GLN  14  14.490  -6.434 -19.519
  127    HG3  GLN  14           HG1      GLN  14  12.968  -6.311 -18.571
  128   HE21  GLN  14          HE21      GLN  14  16.242  -8.002 -18.428
  129   HE22  GLN  14          HE22      GLN  14  16.443  -7.846 -16.717
  130    H    ARG  15           HN       ARG  15  11.269  -9.763 -21.738
  131    HA   ARG  15           HA       ARG  15  13.066 -11.973 -22.193
  132    HB2  ARG  15           HB2      ARG  15  10.227 -11.580 -23.277
  133    HB3  ARG  15           HB1      ARG  15  11.097 -13.145 -23.033
  134    HG2  ARG  15           HG2      ARG  15  11.162 -12.641 -20.531
  135    HG3  ARG  15           HG1      ARG  15  10.211 -11.146 -20.871
  136    HD2  ARG  15           HD2      ARG  15   8.645 -12.813 -20.086
  137    HD3  ARG  15           HD1      ARG  15   8.368 -12.636 -21.870
  138    HE   ARG  15           HE       ARG  15  10.270 -14.787 -21.399
  139   HH11  ARG  15          HH11      ARG  15   6.755 -14.059 -20.997
  140   HH12  ARG  15          HH12      ARG  15   6.263 -15.711 -21.154
  141   HH21  ARG  15          HH21      ARG  15   9.543 -17.003 -21.607
  142   HH22  ARG  15          HH22      ARG  15   7.860 -17.395 -21.503
  143    H    LYS  16           HN       LYS  16  11.408  -9.455 -24.129
  144    HA   LYS  16           HA       LYS  16  13.048 -10.204 -26.455
  145    HB2  LYS  16           HB2      LYS  16  10.464  -8.611 -25.977
  146    HB3  LYS  16           HB1      LYS  16  11.444  -8.263 -27.439
  147    HG2  LYS  16           HG2      LYS  16   9.650  -9.778 -28.014
  148    HG3  LYS  16           HG1      LYS  16  11.211 -10.639 -28.181
  149    HD2  LYS  16           HD2      LYS  16  10.767 -11.877 -26.011
  150    HD3  LYS  16           HD1      LYS  16   9.244 -10.940 -25.795
  151    HE2  LYS  16           HE2      LYS  16   8.294 -11.975 -27.896
  152    HE3  LYS  16           HE1      LYS  16   9.837 -12.892 -28.142
  153    HZ1  LYS  16           HZ1      LYS  16   7.758 -13.890 -26.912
  154    HZ2  LYS  16           HZ2      LYS  16   8.482 -13.159 -25.559
  155    HZ3  LYS  16           HZ3      LYS  16   9.349 -14.295 -26.477
  156    H    LYS  17           HN       LYS  17  15.104  -9.263 -26.093
  157    HA   LYS  17           HA       LYS  17  15.220  -6.380 -25.998
  158    HB2  LYS  17           HB2      LYS  17  15.627  -7.985 -23.482
  159    HB3  LYS  17           HB1      LYS  17  17.085  -7.032 -23.896
  160    HG2  LYS  17           HG2      LYS  17  14.318  -5.665 -23.801
  161    HG3  LYS  17           HG1      LYS  17  15.198  -6.017 -22.278
  162    HD2  LYS  17           HD2      LYS  17  17.185  -4.701 -23.165
  163    HD3  LYS  17           HD1      LYS  17  16.244  -4.310 -24.649
  164    HE2  LYS  17           HE2      LYS  17  14.528  -3.096 -23.248
  165    HE3  LYS  17           HE1      LYS  17  15.466  -3.499 -21.750
  166    HZ1  LYS  17           HZ1      LYS  17  17.099  -2.049 -22.301
  167    HZ2  LYS  17           HZ2      LYS  17  15.769  -1.251 -22.991
  168    HZ3  LYS  17           HZ3      LYS  17  16.831  -2.138 -23.975
  Start of MODEL   14
    1    H1   GLU   1           HT1      GLU   1   2.616   8.025 -12.809
    2    H2   GLU   1           HT2      GLU   1   2.997   6.458 -13.340
    3    H3   GLU   1           HT3      GLU   1   2.217   6.682 -11.849
    4    HA   GLU   1           HA       GLU   1   0.268   7.478 -12.883
    5    HB2  GLU   1           HB2      GLU   1   1.960   7.241 -15.454
    6    HB3  GLU   1           HB1      GLU   1   0.158   7.216 -15.536
    7    HG2  GLU   1           HG2      GLU   1   0.063   9.486 -14.417
    8    HG3  GLU   1           HG1      GLU   1   1.868   9.527 -14.350
    9    H    MET   2           HN       MET   2   2.170   4.945 -14.756
   10    HA   MET   2           HA       MET   2   0.104   2.987 -13.939
   11    HB2  MET   2           HB2      MET   2   1.724   3.086 -16.560
   12    HB3  MET   2           HB1      MET   2   0.622   1.749 -16.070
   13    HG2  MET   2           HG2      MET   2  -1.326   3.335 -16.104
   14    HG3  MET   2           HG1      MET   2  -0.234   4.674 -16.592
   15    HE1  MET   2           HE1      MET   2  -2.870   3.979 -18.081
   16    HE2  MET   2           HE2      MET   2  -2.350   4.141 -19.793
   17    HE3  MET   2           HE3      MET   2  -1.729   5.286 -18.555
   18    H    ARG   3           HN       ARG   3   1.006   1.745 -12.368
   19    HA   ARG   3           HA       ARG   3   3.866   1.264 -12.390
   20    HB2  ARG   3           HB2      ARG   3   1.651   0.564 -10.376
   21    HB3  ARG   3           HB1      ARG   3   3.367   0.074 -10.141
   22    HG2  ARG   3           HG2      ARG   3   2.521   2.997 -10.549
   23    HG3  ARG   3           HG1      ARG   3   2.519   2.188  -8.939
   24    HD2  ARG   3           HD2      ARG   3   4.995   1.643  -9.219
   25    HD3  ARG   3           HD1      ARG   3   5.001   2.540 -10.806
   26    HE   ARG   3           HE       ARG   3   3.910   4.282  -8.760
   27   HH11  ARG   3          HH11      ARG   3   7.052   2.771  -9.695
   28   HH12  ARG   3          HH12      ARG   3   8.013   4.029  -8.991
   29   HH21  ARG   3          HH21      ARG   3   5.256   5.949  -7.829
   30   HH22  ARG   3          HH22      ARG   3   6.982   5.849  -7.922
   31    H    LEU   4           HN       LEU   4   1.141  -0.314 -13.640
   32    HA   LEU   4           HA       LEU   4   2.338  -2.936 -13.180
   33    HB2  LEU   4           HB2      LEU   4  -0.068  -2.337 -14.927
   34    HB3  LEU   4           HB1      LEU   4   0.394  -3.879 -14.105
   35    HG   LEU   4           HG       LEU   4  -0.641  -1.299 -12.824
   36   HD11  LEU   4          HD11      LEU   4  -1.858  -4.121 -12.990
   37   HD12  LEU   4          HD12      LEU   4  -2.357  -2.668 -13.940
   38   HD13  LEU   4          HD13      LEU   4  -2.596  -2.700 -12.150
   39   HD21  LEU   4          HD21      LEU   4   0.710  -3.689 -11.442
   40   HD22  LEU   4          HD22      LEU   4  -0.682  -2.886 -10.619
   41   HD23  LEU   4          HD23      LEU   4   0.786  -1.912 -11.044
   42    H    SER   5           HN       SER   5   2.077  -0.366 -15.549
   43    HA   SER   5           HA       SER   5   3.012  -1.920 -17.675
   44    HB2  SER   5           HB2      SER   5   3.281   1.092 -17.265
   45    HB3  SER   5           HB1      SER   5   3.673   0.182 -18.785
   46    HG   SER   5           HG       SER   5   1.322  -0.594 -18.259
   47    H    LYS   6           HN       LYS   6   4.439  -0.124 -14.928
   48    HA   LYS   6           HA       LYS   6   7.058  -0.228 -15.806
   49    HB2  LYS   6           HB2      LYS   6   6.224   1.414 -14.164
   50    HB3  LYS   6           HB1      LYS   6   5.813   0.094 -13.040
   51    HG2  LYS   6           HG2      LYS   6   8.721   0.131 -13.831
   52    HG3  LYS   6           HG1      LYS   6   8.169   1.632 -13.010
   53    HD2  LYS   6           HD2      LYS   6   7.294   0.328 -11.099
   54    HD3  LYS   6           HD1      LYS   6   7.690  -1.217 -11.927
   55    HE2  LYS   6           HE2      LYS   6  10.158  -0.633 -11.824
   56    HE3  LYS   6           HE1      LYS   6   9.749   0.916 -10.978
   57    HZ1  LYS   6           HZ1      LYS   6  10.247  -1.501  -9.830
   58    HZ2  LYS   6           HZ2      LYS   6   8.556  -1.378  -9.741
   59    HZ3  LYS   6           HZ3      LYS   6   9.533  -0.153  -9.084
   60    H    PHE   7           HN       PHE   7   4.967  -2.448 -13.940
   61    HA   PHE   7           HA       PHE   7   6.943  -4.188 -12.998
   62    HB2  PHE   7           HB2      PHE   7   4.038  -4.081 -12.926
   63    HB3  PHE   7           HB1      PHE   7   4.519  -5.734 -13.401
   64    HD1  PHE   7           HD1      PHE   7   4.176  -3.402 -10.619
   65    HD2  PHE   7           HD2      PHE   7   6.066  -6.938 -12.061
   66    HE1  PHE   7           HE1      PHE   7   4.662  -4.112  -8.325
   67    HE2  PHE   7           HE2      PHE   7   6.539  -7.628  -9.843
   68    HZ   PHE   7           HZ       PHE   7   5.848  -6.234  -7.903
   69    H    PHE   8           HN       PHE   8   4.706  -4.443 -15.740
   70    HA   PHE   8           HA       PHE   8   5.782  -6.977 -16.342
   71    HB2  PHE   8           HB2      PHE   8   4.755  -5.600 -18.635
   72    HB3  PHE   8           HB1      PHE   8   4.300  -7.173 -17.936
   73    HD1  PHE   8           HD1      PHE   8   3.608  -4.276 -19.100
   74    HD2  PHE   8           HD2      PHE   8   2.513  -6.815 -15.885
   75    HE1  PHE   8           HE1      PHE   8   1.612  -3.246 -19.059
   76    HE2  PHE   8           HE2      PHE   8   0.361  -5.708 -15.820
   77    HZ   PHE   8           HZ       PHE   8  -0.126  -3.939 -17.448
   78    H    ARG   9           HN       ARG   9   6.647  -3.684 -17.065
   79    HA   ARG   9           HA       ARG   9   7.639  -4.016 -19.607
   80    HB2  ARG   9           HB2      ARG   9   7.744  -2.151 -17.394
   81    HB3  ARG   9           HB1      ARG   9   9.374  -2.217 -18.101
   82    HG2  ARG   9           HG2      ARG   9   8.576  -1.355 -20.227
   83    HG3  ARG   9           HG1      ARG   9   6.852  -1.604 -19.765
   84    HD2  ARG   9           HD2      ARG   9   6.939   0.231 -18.094
   85    HD3  ARG   9           HD1      ARG   9   8.750   0.367 -18.268
   86    HE   ARG   9           HE       ARG   9   7.617   0.760 -20.877
   87   HH11  ARG   9          HH11      ARG   9   7.600   2.397 -17.660
   88   HH12  ARG   9          HH12      ARG   9   7.398   3.983 -18.322
   89   HH21  ARG   9          HH21      ARG   9   7.350   2.926 -21.717
   90   HH22  ARG   9          HH22      ARG   9   7.256   4.285 -20.647
   91    H    ASP  10           HN       ASP  10   9.054  -4.529 -16.425
   92    HA   ASP  10           HA       ASP  10  11.497  -5.490 -17.533
   93    HB2  ASP  10           HB2      ASP  10  10.559  -5.349 -14.587
   94    HB3  ASP  10           HB1      ASP  10  12.202  -5.888 -15.103
   95    H    ALA  11           HN       ALA  11   8.394  -6.876 -17.136
   96    HA   ALA  11           HA       ALA  11   9.526  -9.478 -16.354
   97    HB1  ALA  11           HB1      ALA  11   7.325 -10.210 -15.857
   98    HB2  ALA  11           HB2      ALA  11   6.586  -8.958 -16.937
   99    HB3  ALA  11           HB3      ALA  11   7.312  -8.474 -15.357
  100    H    ILE  12           HN       ILE  12   7.746  -7.929 -19.006
  101    HA   ILE  12           HA       ILE  12   7.779 -10.377 -20.572
  102    HB   ILE  12           HB       ILE  12   6.747  -7.563 -21.194
  103   HG12  ILE  12          HG12      ILE  12   5.230  -9.936 -19.947
  104   HG13  ILE  12          HG11      ILE  12   5.724  -8.387 -19.162
  105   HG21  ILE  12          HG21      ILE  12   7.006  -8.921 -23.298
  106   HG22  ILE  12          HG22      ILE  12   5.256  -8.835 -22.927
  107   HG23  ILE  12          HG23      ILE  12   6.176 -10.337 -22.551
  108   HD11  ILE  12          HD11      ILE  12   3.653  -8.664 -21.458
  109   HD12  ILE  12          HD12      ILE  12   4.245  -7.101 -20.764
  110   HD13  ILE  12          HD13      ILE  12   3.325  -8.258 -19.731
  111    H    LEU  13           HN       LEU  13   9.186  -7.109 -20.407
  112    HA   LEU  13           HA       LEU  13  10.239  -7.372 -23.056
  113    HB2  LEU  13           HB2      LEU  13  10.543  -5.053 -21.103
  114    HB3  LEU  13           HB1      LEU  13  10.850  -5.000 -22.890
  115    HG   LEU  13           HG       LEU  13   8.186  -5.304 -21.385
  116   HD11  LEU  13          HD11      LEU  13   7.564  -3.126 -22.160
  117   HD12  LEU  13          HD12      LEU  13   8.939  -3.040 -23.337
  118   HD13  LEU  13          HD13      LEU  13   9.264  -2.999 -21.560
  119   HD21  LEU  13          HD21      LEU  13   7.065  -5.024 -23.786
  120   HD22  LEU  13          HD22      LEU  13   7.656  -6.650 -23.303
  121   HD23  LEU  13          HD23      LEU  13   8.636  -5.640 -24.432
  122    H    GLN  14           HN       GLN  14  11.272  -8.501 -20.095
  123    HA   GLN  14           HA       GLN  14  14.075  -7.927 -20.853
  124    HB2  GLN  14           HB2      GLN  14  12.782  -9.072 -18.361
  125    HB3  GLN  14           HB1      GLN  14  14.539  -9.376 -18.691
  126    HG2  GLN  14           HG2      GLN  14  14.551  -6.709 -19.127
  127    HG3  GLN  14           HG1      GLN  14  13.056  -6.779 -18.146
  128   HE21  GLN  14          HE21      GLN  14  13.266  -7.881 -15.886
  129   HE22  GLN  14          HE22      GLN  14  14.777  -7.744 -15.052
  130    H    ARG  15           HN       ARG  15  11.513 -10.034 -21.480
  131    HA   ARG  15           HA       ARG  15  13.210 -12.337 -22.024
  132    HB2  ARG  15           HB2      ARG  15  10.345 -12.018 -22.976
  133    HB3  ARG  15           HB1      ARG  15  11.216 -13.547 -22.582
  134    HG2  ARG  15           HG2      ARG  15  11.191 -12.901 -20.149
  135    HG3  ARG  15           HG1      ARG  15  10.347 -11.367 -20.595
  136    HD2  ARG  15           HD2      ARG  15   8.655 -12.892 -19.783
  137    HD3  ARG  15           HD1      ARG  15   8.450 -12.786 -21.581
  138    HE   ARG  15           HE       ARG  15  10.184 -15.029 -20.952
  139   HH11  ARG  15          HH11      ARG  15   6.724 -14.045 -20.657
  140   HH12  ARG  15          HH12      ARG  15   6.120 -15.666 -20.753
  141   HH21  ARG  15          HH21      ARG  15   9.314 -17.195 -21.085
  142   HH22  ARG  15          HH22      ARG  15   7.606 -17.469 -20.999
  143    H    LYS  16           HN       LYS  16  11.520  -9.793 -23.582
  144    HA   LYS  16           HA       LYS  16  12.747 -10.444 -26.127
  145    HB2  LYS  16           HB2      LYS  16  10.404  -8.696 -25.181
  146    HB3  LYS  16           HB1      LYS  16  11.213  -8.307 -26.737
  147    HG2  LYS  16           HG2      LYS  16   9.350  -9.668 -27.337
  148    HG3  LYS  16           HG1      LYS  16  10.774 -10.746 -27.477
  149    HD2  LYS  16           HD2      LYS  16  10.211 -11.858 -25.296
  150    HD3  LYS  16           HD1      LYS  16   8.879 -10.682 -25.022
  151    HE2  LYS  16           HE2      LYS  16   7.846 -12.750 -25.808
  152    HE3  LYS  16           HE1      LYS  16   7.752 -11.588 -27.191
  153    HZ1  LYS  16           HZ1      LYS  16   9.071 -14.109 -26.993
  154    HZ2  LYS  16           HZ2      LYS  16  10.156 -12.898 -27.484
  155    HZ3  LYS  16           HZ3      LYS  16   8.724 -13.161 -28.358
  156    H    LYS  17           HN       LYS  17  13.737  -8.610 -27.167
  157    HA   LYS  17           HA       LYS  17  14.739  -6.574 -27.370
  158    HB2  LYS  17           HB2      LYS  17  15.151  -6.288 -24.299
  159    HB3  LYS  17           HB1      LYS  17  15.600  -5.085 -25.543
  160    HG2  LYS  17           HG2      LYS  17  12.684  -5.905 -24.872
  161    HG3  LYS  17           HG1      LYS  17  13.533  -4.509 -24.144
  162    HD2  LYS  17           HD2      LYS  17  13.804  -3.518 -26.485
  163    HD3  LYS  17           HD1      LYS  17  12.853  -4.892 -27.149
  164    HE2  LYS  17           HE2      LYS  17  10.869  -4.214 -25.743
  165    HE3  LYS  17           HE1      LYS  17  11.824  -2.830 -25.067
  166    HZ1  LYS  17           HZ1      LYS  17  11.141  -3.258 -27.934
  167    HZ2  LYS  17           HZ2      LYS  17  12.023  -1.954 -27.297
  168    HZ3  LYS  17           HZ3      LYS  17  10.393  -2.168 -26.869
  Start of MODEL   15
    1    H1   GLU   1           HT1      GLU   1   0.548   6.437 -16.944
    2    H2   GLU   1           HT2      GLU   1   1.386   7.909 -16.823
    3    H3   GLU   1           HT3      GLU   1   0.149   7.544 -15.720
    4    HA   GLU   1           HA       GLU   1   2.659   6.030 -16.013
    5    HB2  GLU   1           HB2      GLU   1   2.875   8.467 -15.123
    6    HB3  GLU   1           HB1      GLU   1   1.872   7.962 -13.718
    7    HG2  GLU   1           HG2      GLU   1   3.635   6.285 -13.038
    8    HG3  GLU   1           HG1      GLU   1   4.626   6.717 -14.487
    9    H    MET   2           HN       MET   2   2.296   3.915 -15.452
   10    HA   MET   2           HA       MET   2   0.503   3.379 -13.168
   11    HB2  MET   2           HB2      MET   2   0.729   1.755 -15.782
   12    HB3  MET   2           HB1      MET   2  -0.141   1.193 -14.308
   13    HG2  MET   2           HG2      MET   2  -1.725   3.134 -14.506
   14    HG3  MET   2           HG1      MET   2  -0.862   3.696 -15.976
   15    HE1  MET   2           HE1      MET   2  -3.071   3.827 -17.250
   16    HE2  MET   2           HE2      MET   2  -3.957   3.264 -15.791
   17    HE3  MET   2           HE3      MET   2  -4.281   2.504 -17.387
   18    H    ARG   3           HN       ARG   3   1.160   1.611 -11.832
   19    HA   ARG   3           HA       ARG   3   4.007   1.063 -11.991
   20    HB2  ARG   3           HB2      ARG   3   1.954   0.242  -9.838
   21    HB3  ARG   3           HB1      ARG   3   3.741   0.062  -9.697
   22    HG2  ARG   3           HG2      ARG   3   2.190   2.719  -9.914
   23    HG3  ARG   3           HG1      ARG   3   2.868   2.002  -8.412
   24    HD2  ARG   3           HD2      ARG   3   5.218   2.114  -9.546
   25    HD3  ARG   3           HD1      ARG   3   4.436   3.102 -10.858
   26    HE   ARG   3           HE       ARG   3   3.718   4.264  -8.309
   27   HH11  ARG   3          HH11      ARG   3   6.645   3.830 -10.381
   28   HH12  ARG   3          HH12      ARG   3   7.432   5.256  -9.790
   29   HH21  ARG   3          HH21      ARG   3   4.829   6.176  -7.548
   30   HH22  ARG   3          HH22      ARG   3   6.391   6.598  -8.168
   31    H    LEU   4           HN       LEU   4   1.187  -0.432 -13.059
   32    HA   LEU   4           HA       LEU   4   2.269  -3.115 -12.789
   33    HB2  LEU   4           HB2      LEU   4  -0.250  -2.001 -14.120
   34    HB3  LEU   4           HB1      LEU   4   0.187  -3.752 -14.002
   35    HG   LEU   4           HG       LEU   4   0.518  -2.912 -11.381
   36   HD11  LEU   4          HD11      LEU   4  -1.772  -1.219 -12.512
   37   HD12  LEU   4          HD12      LEU   4  -0.366  -0.721 -11.476
   38   HD13  LEU   4          HD13      LEU   4  -1.707  -1.716 -10.774
   39   HD21  LEU   4          HD21      LEU   4  -0.537  -5.026 -12.229
   40   HD22  LEU   4          HD22      LEU   4  -2.055  -4.112 -12.594
   41   HD23  LEU   4          HD23      LEU   4  -1.492  -4.273 -10.885
   42    H    SER   5           HN       SER   5   1.957  -0.457 -15.089
   43    HA   SER   5           HA       SER   5   2.816  -2.063 -17.262
   44    HB2  SER   5           HB2      SER   5   2.788   1.005 -17.093
   45    HB3  SER   5           HB1      SER   5   3.080   0.001 -18.575
   46    HG   SER   5           HG       SER   5   0.805  -0.702 -17.270
   47    H    LYS   6           HN       LYS   6   4.259  -0.595 -14.442
   48    HA   LYS   6           HA       LYS   6   6.803  -0.315 -15.670
   49    HB2  LYS   6           HB2      LYS   6   6.108   1.337 -13.970
   50    HB3  LYS   6           HB1      LYS   6   5.828   0.021 -12.801
   51    HG2  LYS   6           HG2      LYS   6   8.654   0.093 -13.829
   52    HG3  LYS   6           HG1      LYS   6   8.148   1.609 -13.002
   53    HD2  LYS   6           HD2      LYS   6   7.430   0.310 -10.999
   54    HD3  LYS   6           HD1      LYS   6   7.850  -1.231 -11.824
   55    HE2  LYS   6           HE2      LYS   6  10.285  -0.549 -11.882
   56    HE3  LYS   6           HE1      LYS   6   9.869   1.026 -11.089
   57    HZ1  LYS   6           HZ1      LYS   6  10.164  -1.612  -9.964
   58    HZ2  LYS   6           HZ2      LYS   6   8.767  -0.803  -9.436
   59    HZ3  LYS   6           HZ3      LYS   6  10.292  -0.080  -9.243
   60    H    PHE   7           HN       PHE   7   4.928  -2.573 -13.659
   61    HA   PHE   7           HA       PHE   7   6.967  -4.288 -12.805
   62    HB2  PHE   7           HB2      PHE   7   4.048  -4.264 -12.688
   63    HB3  PHE   7           HB1      PHE   7   4.567  -5.896 -13.196
   64    HD1  PHE   7           HD1      PHE   7   4.105  -3.675 -10.362
   65    HD2  PHE   7           HD2      PHE   7   6.214  -7.051 -11.890
   66    HE1  PHE   7           HE1      PHE   7   4.595  -4.443  -8.081
   67    HE2  PHE   7           HE2      PHE   7   6.690  -7.794  -9.689
   68    HZ   PHE   7           HZ       PHE   7   5.891  -6.509  -7.714
   69    H    PHE   8           HN       PHE   8   4.572  -4.671 -15.378
   70    HA   PHE   8           HA       PHE   8   5.698  -7.110 -16.177
   71    HB2  PHE   8           HB2      PHE   8   4.531  -5.488 -18.296
   72    HB3  PHE   8           HB1      PHE   8   4.210  -7.178 -17.828
   73    HD1  PHE   8           HD1      PHE   8   3.159  -4.324 -18.637
   74    HD2  PHE   8           HD2      PHE   8   2.624  -7.148 -15.513
   75    HE1  PHE   8           HE1      PHE   8   1.084  -3.502 -18.330
   76    HE2  PHE   8           HE2      PHE   8   0.410  -6.280 -15.174
   77    HZ   PHE   8           HZ       PHE   8  -0.405  -4.457 -16.595
   78    H    ARG   9           HN       ARG   9   6.372  -3.759 -16.842
   79    HA   ARG   9           HA       ARG   9   7.223  -3.938 -19.407
   80    HB2  ARG   9           HB2      ARG   9   6.874  -2.070 -17.579
   81    HB3  ARG   9           HB1      ARG   9   8.592  -2.280 -17.220
   82    HG2  ARG   9           HG2      ARG   9   9.138  -1.565 -19.566
   83    HG3  ARG   9           HG1      ARG   9   7.373  -1.352 -19.880
   84    HD2  ARG   9           HD2      ARG   9   7.255   0.402 -17.989
   85    HD3  ARG   9           HD1      ARG   9   9.054   0.217 -17.760
   86    HE   ARG   9           HE       ARG   9   8.558   0.779 -20.555
   87   HH11  ARG   9          HH11      ARG   9   8.364   2.428 -17.347
   88   HH12  ARG   9          HH12      ARG   9   8.626   4.010 -18.001
   89   HH21  ARG   9          HH21      ARG   9   8.910   2.937 -21.380
   90   HH22  ARG   9          HH22      ARG   9   8.938   4.300 -20.311
   91    H    ASP  10           HN       ASP  10   8.934  -4.519 -16.354
   92    HA   ASP  10           HA       ASP  10  11.316  -5.252 -17.686
   93    HB2  ASP  10           HB2      ASP  10  10.607  -5.304 -14.674
   94    HB3  ASP  10           HB1      ASP  10  12.242  -5.687 -15.335
   95    H    ALA  11           HN       ALA  11   8.349  -6.853 -17.092
   96    HA   ALA  11           HA       ALA  11   9.677  -9.402 -16.474
   97    HB1  ALA  11           HB1      ALA  11   7.538 -10.263 -15.869
   98    HB2  ALA  11           HB2      ALA  11   6.679  -8.986 -16.823
   99    HB3  ALA  11           HB3      ALA  11   7.508  -8.555 -15.276
  100    H    ILE  12           HN       ILE  12   7.562  -7.927 -18.923
  101    HA   ILE  12           HA       ILE  12   7.604 -10.337 -20.527
  102    HB   ILE  12           HB       ILE  12   6.360  -7.583 -21.006
  103   HG12  ILE  12          HG12      ILE  12   5.135 -10.056 -19.641
  104   HG13  ILE  12          HG11      ILE  12   5.572  -8.461 -18.913
  105   HG21  ILE  12          HG21      ILE  12   6.495  -8.893 -23.151
  106   HG22  ILE  12          HG22      ILE  12   4.787  -8.922 -22.616
  107   HG23  ILE  12          HG23      ILE  12   5.829 -10.369 -22.357
  108   HD11  ILE  12          HD11      ILE  12   3.335  -8.913 -21.027
  109   HD12  ILE  12          HD12      ILE  12   3.845  -7.315 -20.345
  110   HD13  ILE  12          HD13      ILE  12   3.114  -8.565 -19.270
  111    H    LEU  13           HN       LEU  13   8.827  -6.990 -20.474
  112    HA   LEU  13           HA       LEU  13   9.595  -7.187 -23.237
  113    HB2  LEU  13           HB2      LEU  13   9.992  -4.891 -21.247
  114    HB3  LEU  13           HB1      LEU  13  10.092  -4.765 -23.058
  115    HG   LEU  13           HG       LEU  13   7.635  -5.227 -21.255
  116   HD11  LEU  13          HD11      LEU  13   6.857  -3.063 -21.843
  117   HD12  LEU  13          HD12      LEU  13   7.995  -2.901 -23.242
  118   HD13  LEU  13          HD13      LEU  13   8.629  -2.867 -21.552
  119   HD21  LEU  13          HD21      LEU  13   7.715  -5.452 -24.351
  120   HD22  LEU  13          HD22      LEU  13   6.210  -4.961 -23.479
  121   HD23  LEU  13          HD23      LEU  13   6.954  -6.563 -23.150
  122    H    GLN  14           HN       GLN  14  11.051  -8.171 -20.348
  123    HA   GLN  14           HA       GLN  14  13.703  -7.330 -21.386
  124    HB2  GLN  14           HB2      GLN  14  12.794  -8.582 -18.776
  125    HB3  GLN  14           HB1      GLN  14  14.529  -8.698 -19.280
  126    HG2  GLN  14           HG2      GLN  14  14.220  -6.046 -19.681
  127    HG3  GLN  14           HG1      GLN  14  12.848  -6.281 -18.559
  128   HE21  GLN  14          HE21      GLN  14  13.438  -7.498 -16.374
  129   HE22  GLN  14          HE22      GLN  14  14.989  -7.155 -15.681
  130    H    ARG  15           HN       ARG  15  11.325  -9.729 -21.665
  131    HA   ARG  15           HA       ARG  15  13.109 -11.941 -22.108
  132    HB2  ARG  15           HB2      ARG  15  10.244 -11.508 -23.139
  133    HB3  ARG  15           HB1      ARG  15  11.109 -13.088 -23.043
  134    HG2  ARG  15           HG2      ARG  15  11.207 -12.872 -20.541
  135    HG3  ARG  15           HG1      ARG  15  10.366 -11.272 -20.677
  136    HD2  ARG  15           HD2      ARG  15   8.320 -12.253 -21.428
  137    HD3  ARG  15           HD1      ARG  15   9.077 -13.882 -21.731
  138    HE   ARG  15           HE       ARG  15   9.456 -13.234 -18.954
  139   HH11  ARG  15          HH11      ARG  15   6.713 -13.950 -21.195
  140   HH12  ARG  15          HH12      ARG  15   5.704 -14.612 -19.953
  141   HH21  ARG  15          HH21      ARG  15   8.043 -14.141 -17.320
  142   HH22  ARG  15          HH22      ARG  15   6.465 -14.719 -17.738
  143    H    LYS  16           HN       LYS  16  11.435  -9.474 -24.105
  144    HA   LYS  16           HA       LYS  16  13.071 -10.269 -26.423
  145    HB2  LYS  16           HB2      LYS  16  10.493  -8.638 -25.992
  146    HB3  LYS  16           HB1      LYS  16  11.455  -8.415 -27.491
  147    HG2  LYS  16           HG2      LYS  16   9.601  -9.937 -27.896
  148    HG3  LYS  16           HG1      LYS  16  11.150 -10.819 -28.076
  149    HD2  LYS  16           HD2      LYS  16  10.801 -12.060 -25.986
  150    HD3  LYS  16           HD1      LYS  16   9.501 -10.942 -25.459
  151    HE2  LYS  16           HE2      LYS  16   8.436 -13.035 -26.180
  152    HE3  LYS  16           HE1      LYS  16   8.057 -11.793 -27.439
  153    HZ1  LYS  16           HZ1      LYS  16   9.450 -12.787 -28.928
  154    HZ2  LYS  16           HZ2      LYS  16   8.880 -14.145 -28.082
  155    HZ3  LYS  16           HZ3      LYS  16  10.427 -13.527 -27.753
  156    H    LYS  17           HN       LYS  17  15.124  -9.281 -26.085
  157    HA   LYS  17           HA       LYS  17  15.193  -6.402 -26.119
  158    HB2  LYS  17           HB2      LYS  17  15.573  -7.842 -23.506
  159    HB3  LYS  17           HB1      LYS  17  17.038  -6.915 -23.954
  160    HG2  LYS  17           HG2      LYS  17  14.250  -5.574 -23.951
  161    HG3  LYS  17           HG1      LYS  17  15.169  -5.782 -22.424
  162    HD2  LYS  17           HD2      LYS  17  17.113  -4.505 -23.462
  163    HD3  LYS  17           HD1      LYS  17  16.140  -4.262 -24.955
  164    HE2  LYS  17           HE2      LYS  17  14.421  -2.964 -23.622
  165    HE3  LYS  17           HE1      LYS  17  15.417  -3.202 -22.126
  166    HZ1  LYS  17           HZ1      LYS  17  15.704  -1.314 -24.233
  167    HZ2  LYS  17           HZ2      LYS  17  17.139  -2.198 -24.027
  168    HZ3  LYS  17           HZ3      LYS  17  16.452  -1.373 -22.711
  Start of MODEL   16
    1    H1   GLU   1           HT1      GLU   1   1.376   7.490 -17.231
    2    H2   GLU   1           HT2      GLU   1   0.632   8.038 -15.806
    3    H3   GLU   1           HT3      GLU   1   0.148   6.568 -16.506
    4    HA   GLU   1           HA       GLU   1   2.642   5.973 -16.206
    5    HB2  GLU   1           HB2      GLU   1   2.070   8.155 -14.088
    6    HB3  GLU   1           HB1      GLU   1   3.333   6.894 -13.822
    7    HG2  GLU   1           HG2      GLU   1   4.554   7.648 -15.904
    8    HG3  GLU   1           HG1      GLU   1   3.296   8.915 -16.185
    9    H    MET   2           HN       MET   2   2.337   3.879 -15.558
   10    HA   MET   2           HA       MET   2   0.550   3.391 -13.256
   11    HB2  MET   2           HB2      MET   2   0.776   1.721 -15.840
   12    HB3  MET   2           HB1      MET   2  -0.101   1.188 -14.360
   13    HG2  MET   2           HG2      MET   2  -1.680   3.127 -14.598
   14    HG3  MET   2           HG1      MET   2  -0.809   3.662 -16.074
   15    HE1  MET   2           HE1      MET   2  -4.229   2.440 -17.470
   16    HE2  MET   2           HE2      MET   2  -3.020   3.766 -17.366
   17    HE3  MET   2           HE3      MET   2  -3.902   3.236 -15.891
   18    H    ARG   3           HN       ARG   3   1.192   1.627 -11.898
   19    HA   ARG   3           HA       ARG   3   4.037   1.068 -12.033
   20    HB2  ARG   3           HB2      ARG   3   1.956   0.281  -9.895
   21    HB3  ARG   3           HB1      ARG   3   3.737   0.065  -9.736
   22    HG2  ARG   3           HG2      ARG   3   2.253   2.758  -9.990
   23    HG3  ARG   3           HG1      ARG   3   2.875   2.029  -8.470
   24    HD2  ARG   3           HD2      ARG   3   5.253   2.075  -9.537
   25    HD3  ARG   3           HD1      ARG   3   4.535   3.065 -10.883
   26    HE   ARG   3           HE       ARG   3   3.776   4.273  -8.365
   27   HH11  ARG   3          HH11      ARG   3   6.744   3.751 -10.357
   28   HH12  ARG   3          HH12      ARG   3   7.544   5.170  -9.767
   29   HH21  ARG   3          HH21      ARG   3   4.906   6.171  -7.603
   30   HH22  ARG   3          HH22      ARG   3   6.490   6.554  -8.190
   31    H    LEU   4           HN       LEU   4   1.223  -0.424 -13.116
   32    HA   LEU   4           HA       LEU   4   2.297  -3.105 -12.819
   33    HB2  LEU   4           HB2      LEU   4  -0.219  -2.006 -14.168
   34    HB3  LEU   4           HB1      LEU   4   0.220  -3.754 -14.027
   35    HG   LEU   4           HG       LEU   4   0.542  -2.902 -11.416
   36   HD11  LEU   4          HD11      LEU   4  -1.715  -1.175 -12.561
   37   HD12  LEU   4          HD12      LEU   4  -0.311  -0.700 -11.514
   38   HD13  LEU   4          HD13      LEU   4  -1.673  -1.671 -10.823
   39   HD21  LEU   4          HD21      LEU   4  -0.546  -5.003 -12.255
   40   HD22  LEU   4          HD22      LEU   4  -2.047  -4.066 -12.629
   41   HD23  LEU   4          HD23      LEU   4  -1.490  -4.227 -10.918
   42    H    SER   5           HN       SER   5   2.021  -0.458 -15.129
   43    HA   SER   5           HA       SER   5   2.881  -2.078 -17.294
   44    HB2  SER   5           HB2      SER   5   2.866   0.990 -17.124
   45    HB3  SER   5           HB1      SER   5   3.171  -0.012 -18.604
   46    HG   SER   5           HG       SER   5   0.906  -0.799 -17.433
   47    H    LYS   6           HN       LYS   6   4.305  -0.613 -14.467
   48    HA   LYS   6           HA       LYS   6   6.861  -0.355 -15.669
   49    HB2  LYS   6           HB2      LYS   6   6.146   1.308 -13.983
   50    HB3  LYS   6           HB1      LYS   6   5.871  -0.003 -12.807
   51    HG2  LYS   6           HG2      LYS   6   8.692   0.063 -13.838
   52    HG3  LYS   6           HG1      LYS   6   8.189   1.588 -13.028
   53    HD2  LYS   6           HD2      LYS   6   7.476   0.318 -11.009
   54    HD3  LYS   6           HD1      LYS   6   7.878  -1.237 -11.819
   55    HE2  LYS   6           HE2      LYS   6  10.318  -0.584 -11.892
   56    HE3  LYS   6           HE1      LYS   6   9.924   1.011 -11.128
   57    HZ1  LYS   6           HZ1      LYS   6  10.378  -0.089  -9.277
   58    HZ2  LYS   6           HZ2      LYS   6  10.149  -1.627  -9.960
   59    HZ3  LYS   6           HZ3      LYS   6   8.812  -0.730  -9.418
   60    H    PHE   7           HN       PHE   7   4.950  -2.588 -13.670
   61    HA   PHE   7           HA       PHE   7   6.967  -4.319 -12.797
   62    HB2  PHE   7           HB2      PHE   7   4.049  -4.266 -12.699
   63    HB3  PHE   7           HB1      PHE   7   4.555  -5.904 -13.195
   64    HD1  PHE   7           HD1      PHE   7   4.109  -3.657 -10.377
   65    HD2  PHE   7           HD2      PHE   7   6.170  -7.073 -11.876
   66    HE1  PHE   7           HE1      PHE   7   4.581  -4.415  -8.090
   67    HE2  PHE   7           HE2      PHE   7   6.628  -7.809  -9.668
   68    HZ   PHE   7           HZ       PHE   7   5.844  -6.498  -7.704
   69    H    PHE   8           HN       PHE   8   4.579  -4.692 -15.379
   70    HA   PHE   8           HA       PHE   8   5.681  -7.146 -16.163
   71    HB2  PHE   8           HB2      PHE   8   4.551  -5.510 -18.295
   72    HB3  PHE   8           HB1      PHE   8   4.212  -7.200 -17.836
   73    HD1  PHE   8           HD1      PHE   8   3.186  -4.333 -18.643
   74    HD2  PHE   8           HD2      PHE   8   2.610  -7.164 -15.532
   75    HE1  PHE   8           HE1      PHE   8   1.115  -3.494 -18.341
   76    HE2  PHE   8           HE2      PHE   8   0.402  -6.278 -15.201
   77    HZ   PHE   8           HZ       PHE   8  -0.390  -4.445 -16.619
   78    H    ARG   9           HN       ARG   9   6.408  -3.810 -16.823
   79    HA   ARG   9           HA       ARG   9   7.276  -4.000 -19.377
   80    HB2  ARG   9           HB2      ARG   9   6.923  -2.126 -17.581
   81    HB3  ARG   9           HB1      ARG   9   8.616  -2.376 -17.148
   82    HG2  ARG   9           HG2      ARG   9   9.278  -1.667 -19.468
   83    HG3  ARG   9           HG1      ARG   9   7.532  -1.401 -19.844
   84    HD2  ARG   9           HD2      ARG   9   7.381   0.342 -17.964
   85    HD3  ARG   9           HD1      ARG   9   9.151   0.085 -17.617
   86    HE   ARG   9           HE       ARG   9   8.866   0.706 -20.430
   87   HH11  ARG   9          HH11      ARG   9   8.503   2.305 -17.211
   88   HH12  ARG   9          HH12      ARG   9   8.888   3.885 -17.808
   89   HH21  ARG   9          HH21      ARG   9   9.386   2.862 -21.177
   90   HH22  ARG   9          HH22      ARG   9   9.394   4.201 -20.079
   91    H    ASP  10           HN       ASP  10   8.961  -4.571 -16.312
   92    HA   ASP  10           HA       ASP  10  11.333  -5.385 -17.630
   93    HB2  ASP  10           HB2      ASP  10  10.626  -5.354 -14.609
   94    HB3  ASP  10           HB1      ASP  10  12.253  -5.774 -15.267
   95    H    ALA  11           HN       ALA  11   8.338  -6.917 -17.077
   96    HA   ALA  11           HA       ALA  11   9.608  -9.490 -16.420
   97    HB1  ALA  11           HB1      ALA  11   7.424  -8.572 -15.261
   98    HB2  ALA  11           HB2      ALA  11   7.470 -10.302 -15.785
   99    HB3  ALA  11           HB3      ALA  11   6.617  -9.068 -16.799
  100    H    ILE  12           HN       ILE  12   7.570  -7.972 -18.906
  101    HA   ILE  12           HA       ILE  12   7.615 -10.377 -20.537
  102    HB   ILE  12           HB       ILE  12   6.363  -7.620 -20.992
  103   HG12  ILE  12          HG12      ILE  12   5.134 -10.102 -19.643
  104   HG13  ILE  12          HG11      ILE  12   5.570  -8.511 -18.904
  105   HG21  ILE  12          HG21      ILE  12   5.829 -10.399 -22.357
  106   HG22  ILE  12          HG22      ILE  12   6.513  -8.927 -23.142
  107   HG23  ILE  12          HG23      ILE  12   4.802  -8.941 -22.618
  108   HD11  ILE  12          HD11      ILE  12   3.853  -7.354 -20.343
  109   HD12  ILE  12          HD12      ILE  12   3.116  -8.604 -19.269
  110   HD13  ILE  12          HD13      ILE  12   3.338  -8.952 -21.023
  111    H    LEU  13           HN       LEU  13   8.795  -7.007 -20.460
  112    HA   LEU  13           HA       LEU  13   9.628  -7.166 -23.212
  113    HB2  LEU  13           HB2      LEU  13   9.986  -4.887 -21.197
  114    HB3  LEU  13           HB1      LEU  13  10.098  -4.751 -23.007
  115    HG   LEU  13           HG       LEU  13   7.641  -5.245 -21.226
  116   HD11  LEU  13          HD11      LEU  13   7.955  -2.911 -23.207
  117   HD12  LEU  13          HD12      LEU  13   8.631  -2.872 -21.535
  118   HD13  LEU  13          HD13      LEU  13   6.853  -3.084 -21.780
  119   HD21  LEU  13          HD21      LEU  13   7.747  -5.484 -24.317
  120   HD22  LEU  13          HD22      LEU  13   6.231  -4.979 -23.473
  121   HD23  LEU  13          HD23      LEU  13   6.965  -6.579 -23.115
  122    H    GLN  14           HN       GLN  14  10.978  -8.163 -20.308
  123    HA   GLN  14           HA       GLN  14  13.685  -7.297 -21.116
  124    HB2  GLN  14           HB2      GLN  14  12.423  -8.596 -18.712
  125    HB3  GLN  14           HB1      GLN  14  14.147  -8.998 -19.034
  126    HG2  GLN  14           HG2      GLN  14  13.192  -6.083 -19.095
  127    HG3  GLN  14           HG1      GLN  14  13.464  -6.903 -17.507
  128   HE21  GLN  14          HE21      GLN  14  15.692  -8.037 -17.219
  129   HE22  GLN  14          HE22      GLN  14  17.083  -7.264 -17.906
  130    H    ARG  15           HN       ARG  15  11.328  -9.708 -21.658
  131    HA   ARG  15           HA       ARG  15  13.188 -11.855 -22.140
  132    HB2  ARG  15           HB2      ARG  15  10.321 -11.570 -23.184
  133    HB3  ARG  15           HB1      ARG  15  11.250 -13.099 -22.944
  134    HG2  ARG  15           HG2      ARG  15  11.306 -12.602 -20.445
  135    HG3  ARG  15           HG1      ARG  15  10.313 -11.129 -20.776
  136    HD2  ARG  15           HD2      ARG  15   8.800 -12.857 -19.994
  137    HD3  ARG  15           HD1      ARG  15   8.502 -12.649 -21.770
  138    HE   ARG  15           HE       ARG  15  10.456 -14.770 -21.348
  139   HH11  ARG  15          HH11      ARG  15   6.926 -14.120 -20.942
  140   HH12  ARG  15          HH12      ARG  15   6.466 -15.778 -21.143
  141   HH21  ARG  15          HH21      ARG  15   9.771 -16.996 -21.618
  142   HH22  ARG  15          HH22      ARG  15   8.094 -17.421 -21.530
  143    H    LYS  16           HN       LYS  16  11.377  -9.416 -24.055
  144    HA   LYS  16           HA       LYS  16  12.988 -10.116 -26.420
  145    HB2  LYS  16           HB2      LYS  16  10.361  -8.583 -25.918
  146    HB3  LYS  16           HB1      LYS  16  11.280  -8.326 -27.440
  147    HG2  LYS  16           HG2      LYS  16   9.502  -9.918 -27.843
  148    HG3  LYS  16           HG1      LYS  16  11.072 -10.767 -27.986
  149    HD2  LYS  16           HD2      LYS  16  10.731 -11.973 -25.880
  150    HD3  LYS  16           HD1      LYS  16   9.411 -10.869 -25.380
  151    HE2  LYS  16           HE2      LYS  16   8.363 -12.973 -26.051
  152    HE3  LYS  16           HE1      LYS  16   8.002 -11.789 -27.369
  153    HZ1  LYS  16           HZ1      LYS  16   9.992 -13.997 -27.352
  154    HZ2  LYS  16           HZ2      LYS  16  10.021 -12.750 -28.504
  155    HZ3  LYS  16           HZ3      LYS  16   8.664 -13.763 -28.384
  156    H    LYS  17           HN       LYS  17  15.001  -9.065 -26.130
  157    HA   LYS  17           HA       LYS  17  14.978  -6.188 -26.134
  158    HB2  LYS  17           HB2      LYS  17  15.375  -7.604 -23.533
  159    HB3  LYS  17           HB1      LYS  17  16.873  -6.735 -23.986
  160    HG2  LYS  17           HG2      LYS  17  14.177  -5.239 -24.078
  161    HG3  LYS  17           HG1      LYS  17  14.944  -5.561 -22.486
  162    HD2  LYS  17           HD2      LYS  17  17.037  -4.389 -23.245
  163    HD3  LYS  17           HD1      LYS  17  16.312  -4.088 -24.857
  164    HE2  LYS  17           HE2      LYS  17  14.938  -3.036 -22.289
  165    HE3  LYS  17           HE1      LYS  17  16.299  -2.134 -23.068
  166    HZ1  LYS  17           HZ1      LYS  17  14.879  -2.414 -25.180
  167    HZ2  LYS  17           HZ2      LYS  17  14.444  -1.248 -24.024
  168    HZ3  LYS  17           HZ3      LYS  17  13.598  -2.718 -24.107
  Start of MODEL   17
    1    H1   GLU   1           HT1      GLU   1   3.201   6.499 -13.710
    2    H2   GLU   1           HT2      GLU   1   3.364   7.857 -14.716
    3    H3   GLU   1           HT3      GLU   1   3.786   6.319 -15.295
    4    HA   GLU   1           HA       GLU   1   1.183   7.548 -14.936
    5    HB2  GLU   1           HB2      GLU   1   2.526   5.689 -17.001
    6    HB3  GLU   1           HB1      GLU   1   0.738   5.927 -17.015
    7    HG2  GLU   1           HG2      GLU   1   1.057   8.422 -17.311
    8    HG3  GLU   1           HG1      GLU   1   2.850   8.189 -17.319
    9    H    MET   2           HN       MET   2   2.313   4.073 -15.378
   10    HA   MET   2           HA       MET   2   0.371   3.299 -13.289
   11    HB2  MET   2           HB2      MET   2   0.896   1.851 -15.963
   12    HB3  MET   2           HB1      MET   2  -0.057   1.160 -14.597
   13    HG2  MET   2           HG2      MET   2  -1.729   3.022 -14.820
   14    HG3  MET   2           HG1      MET   2  -0.787   3.713 -16.181
   15    HE1  MET   2           HE1      MET   2  -2.921   3.791 -17.609
   16    HE2  MET   2           HE2      MET   2  -3.857   3.091 -16.244
   17    HE3  MET   2           HE3      MET   2  -4.031   2.406 -17.897
   18    H    ARG   3           HN       ARG   3   1.028   1.579 -11.955
   19    HA   ARG   3           HA       ARG   3   3.886   1.059 -11.978
   20    HB2  ARG   3           HB2      ARG   3   1.735   0.200  -9.940
   21    HB3  ARG   3           HB1      ARG   3   3.513   0.029  -9.711
   22    HG2  ARG   3           HG2      ARG   3   1.967   2.685  -9.989
   23    HG3  ARG   3           HG1      ARG   3   2.545   1.952  -8.453
   24    HD2  ARG   3           HD2      ARG   3   4.964   2.078  -9.419
   25    HD3  ARG   3           HD1      ARG   3   4.274   3.065 -10.782
   26    HE   ARG   3           HE       ARG   3   3.369   4.235  -8.304
   27   HH11  ARG   3          HH11      ARG   3   6.470   3.764 -10.098
   28   HH12  ARG   3          HH12      ARG   3   7.207   5.192  -9.452
   29   HH21  ARG   3          HH21      ARG   3   4.419   6.148  -7.466
   30   HH22  ARG   3          HH22      ARG   3   6.033   6.555  -7.946
   31    H    LEU   4           HN       LEU   4   1.132  -0.417 -13.206
   32    HA   LEU   4           HA       LEU   4   2.176  -3.109 -12.919
   33    HB2  LEU   4           HB2      LEU   4  -0.248  -1.936 -14.371
   34    HB3  LEU   4           HB1      LEU   4   0.166  -3.694 -14.281
   35    HG   LEU   4           HG       LEU   4   0.358  -2.926 -11.622
   36   HD11  LEU   4          HD11      LEU   4  -0.512  -0.723 -11.733
   37   HD12  LEU   4          HD12      LEU   4  -1.876  -1.731 -11.095
   38   HD13  LEU   4          HD13      LEU   4  -1.878  -1.209 -12.824
   39   HD21  LEU   4          HD21      LEU   4  -2.146  -4.085 -13.005
   40   HD22  LEU   4          HD22      LEU   4  -1.676  -4.293 -11.273
   41   HD23  LEU   4          HD23      LEU   4  -0.652  -5.014 -12.584
   42    H    SER   5           HN       SER   5   2.026  -0.413 -15.209
   43    HA   SER   5           HA       SER   5   2.957  -1.952 -17.360
   44    HB2  SER   5           HB2      SER   5   3.206   1.079 -16.971
   45    HB3  SER   5           HB1      SER   5   3.619   0.152 -18.477
   46    HG   SER   5           HG       SER   5   1.116  -0.342 -17.453
   47    H    LYS   6           HN       LYS   6   4.362  -0.225 -14.551
   48    HA   LYS   6           HA       LYS   6   6.958  -0.262 -15.466
   49    HB2  LYS   6           HB2      LYS   6   6.149   1.280 -13.717
   50    HB3  LYS   6           HB1      LYS   6   5.791  -0.108 -12.659
   51    HG2  LYS   6           HG2      LYS   6   8.675  -0.006 -13.508
   52    HG3  LYS   6           HG1      LYS   6   8.135   1.469 -12.632
   53    HD2  LYS   6           HD2      LYS   6   7.263   0.062 -10.760
   54    HD3  LYS   6           HD1      LYS   6   7.752  -1.428 -11.638
   55    HE2  LYS   6           HE2      LYS   6  10.180  -0.744 -11.477
   56    HE3  LYS   6           HE1      LYS   6   9.701   0.786 -10.633
   57    HZ1  LYS   6           HZ1      LYS   6   9.600  -2.004  -9.677
   58    HZ2  LYS   6           HZ2      LYS   6   8.562  -0.837  -9.009
   59    HZ3  LYS   6           HZ3      LYS   6  10.245  -0.616  -8.940
   60    H    PHE   7           HN       PHE   7   4.934  -2.581 -13.667
   61    HA   PHE   7           HA       PHE   7   6.903  -4.361 -12.816
   62    HB2  PHE   7           HB2      PHE   7   3.978  -4.293 -12.825
   63    HB3  PHE   7           HB1      PHE   7   4.513  -5.917 -13.338
   64    HD1  PHE   7           HD1      PHE   7   3.929  -3.745 -10.492
   65    HD2  PHE   7           HD2      PHE   7   6.086  -7.110 -11.973
   66    HE1  PHE   7           HE1      PHE   7   4.305  -4.550  -8.208
   67    HE2  PHE   7           HE2      PHE   7   6.451  -7.891  -9.764
   68    HZ   PHE   7           HZ       PHE   7   5.568  -6.632  -7.809
   69    H    PHE   8           HN       PHE   8   4.648  -4.530 -15.554
   70    HA   PHE   8           HA       PHE   8   5.772  -7.019 -16.266
   71    HB2  PHE   8           HB2      PHE   8   4.628  -5.598 -18.484
   72    HB3  PHE   8           HB1      PHE   8   4.245  -7.201 -17.814
   73    HD1  PHE   8           HD1      PHE   8   3.452  -4.216 -18.774
   74    HD2  PHE   8           HD2      PHE   8   2.524  -7.051 -15.764
   75    HE1  PHE   8           HE1      PHE   8   1.427  -3.264 -18.604
   76    HE2  PHE   8           HE2      PHE   8   0.344  -6.046 -15.561
   77    HZ   PHE   8           HZ       PHE   8  -0.248  -4.150 -17.000
   78    H    ARG   9           HN       ARG   9   6.549  -3.682 -16.955
   79    HA   ARG   9           HA       ARG   9   7.439  -3.987 -19.543
   80    HB2  ARG   9           HB2      ARG   9   7.672  -2.127 -17.293
   81    HB3  ARG   9           HB1      ARG   9   9.210  -2.137 -18.201
   82    HG2  ARG   9           HG2      ARG   9   8.111  -1.303 -20.228
   83    HG3  ARG   9           HG1      ARG   9   6.481  -1.587 -19.533
   84    HD2  ARG   9           HD2      ARG   9   6.807   0.806 -19.323
   85    HD3  ARG   9           HD1      ARG   9   7.180   0.183 -17.653
   86    HE   ARG   9           HE       ARG   9   9.635   0.209 -19.197
   87   HH11  ARG   9          HH11      ARG   9   7.283   2.551 -17.771
   88   HH12  ARG   9          HH12      ARG   9   8.462   3.802 -17.561
   89   HH21  ARG   9          HH21      ARG   9  11.181   1.935 -18.889
   90   HH22  ARG   9          HH22      ARG   9  10.695   3.448 -18.203
   91    H    ASP  10           HN       ASP  10   9.017  -4.407 -16.414
   92    HA   ASP  10           HA       ASP  10  11.432  -5.309 -17.602
   93    HB2  ASP  10           HB2      ASP  10  10.553  -5.166 -14.634
   94    HB3  ASP  10           HB1      ASP  10  12.194  -5.691 -15.163
   95    H    ALA  11           HN       ALA  11   8.391  -6.815 -17.149
   96    HA   ALA  11           HA       ALA  11   9.640  -9.388 -16.437
   97    HB1  ALA  11           HB1      ALA  11   7.477 -10.218 -15.897
   98    HB2  ALA  11           HB2      ALA  11   6.662  -8.946 -16.894
   99    HB3  ALA  11           HB3      ALA  11   7.435  -8.504 -15.324
  100    H    ILE  12           HN       ILE  12   7.633  -7.904 -18.977
  101    HA   ILE  12           HA       ILE  12   7.674 -10.340 -20.544
  102    HB   ILE  12           HB       ILE  12   6.536  -7.556 -21.110
  103   HG12  ILE  12          HG12      ILE  12   5.157  -9.984 -19.806
  104   HG13  ILE  12          HG11      ILE  12   5.636  -8.420 -19.038
  105   HG21  ILE  12          HG21      ILE  12   6.719  -8.867 -23.239
  106   HG22  ILE  12          HG22      ILE  12   4.990  -8.879 -22.771
  107   HG23  ILE  12          HG23      ILE  12   6.007 -10.335 -22.470
  108   HD11  ILE  12          HD11      ILE  12   3.469  -8.755 -21.240
  109   HD12  ILE  12          HD12      ILE  12   4.036  -7.180 -20.550
  110   HD13  ILE  12          HD13      ILE  12   3.205  -8.382 -19.494
  111    H    LEU  13           HN       LEU  13   8.976  -7.029 -20.504
  112    HA   LEU  13           HA       LEU  13   9.921  -7.297 -23.206
  113    HB2  LEU  13           HB2      LEU  13  10.321  -4.984 -21.232
  114    HB3  LEU  13           HB1      LEU  13  10.502  -4.903 -23.040
  115    HG   LEU  13           HG       LEU  13   7.958  -5.238 -21.343
  116   HD11  LEU  13          HD11      LEU  13   8.626  -2.942 -23.296
  117   HD12  LEU  13          HD12      LEU  13   8.961  -2.931 -21.519
  118   HD13  LEU  13          HD13      LEU  13   7.257  -3.051 -22.113
  119   HD21  LEU  13          HD21      LEU  13   6.664  -4.919 -23.666
  120   HD22  LEU  13          HD22      LEU  13   7.267  -6.555 -23.230
  121   HD23  LEU  13          HD23      LEU  13   8.180  -5.551 -24.420
  122    H    GLN  14           HN       GLN  14  11.079  -8.326 -20.235
  123    HA   GLN  14           HA       GLN  14  13.847  -7.622 -20.966
  124    HB2  GLN  14           HB2      GLN  14  12.481  -8.790 -18.558
  125    HB3  GLN  14           HB1      GLN  14  14.176  -9.331 -18.863
  126    HG2  GLN  14           HG2      GLN  14  14.606  -6.686 -19.204
  127    HG3  GLN  14           HG1      GLN  14  13.058  -6.553 -18.302
  128   HE21  GLN  14          HE21      GLN  14  16.310  -8.270 -18.096
  129   HE22  GLN  14          HE22      GLN  14  16.450  -8.174 -16.373
  130    H    ARG  15           HN       ARG  15  11.401  -9.849 -21.654
  131    HA   ARG  15           HA       ARG  15  13.221 -12.054 -22.207
  132    HB2  ARG  15           HB2      ARG  15  10.299 -11.725 -23.083
  133    HB3  ARG  15           HB1      ARG  15  11.228 -13.265 -22.917
  134    HG2  ARG  15           HG2      ARG  15  11.348 -12.951 -20.449
  135    HG3  ARG  15           HG1      ARG  15  10.525 -11.346 -20.616
  136    HD2  ARG  15           HD2      ARG  15   8.438 -12.319 -21.260
  137    HD3  ARG  15           HD1      ARG  15   9.162 -13.966 -21.551
  138    HE   ARG  15           HE       ARG  15   9.669 -13.305 -18.814
  139   HH11  ARG  15          HH11      ARG  15   6.768 -13.854 -20.901
  140   HH12  ARG  15          HH12      ARG  15   5.790 -14.451 -19.601
  141   HH21  ARG  15          HH21      ARG  15   8.296 -14.118 -17.103
  142   HH22  ARG  15          HH22      ARG  15   6.665 -14.601 -17.430
  143    H    LYS  16           HN       LYS  16  11.311  -9.544 -23.952
  144    HA   LYS  16           HA       LYS  16  12.840 -10.189 -26.386
  145    HB2  LYS  16           HB2      LYS  16  10.139  -8.912 -25.764
  146    HB3  LYS  16           HB1      LYS  16  11.006  -8.335 -27.225
  147    HG2  LYS  16           HG2      LYS  16   9.430 -10.040 -27.874
  148    HG3  LYS  16           HG1      LYS  16  11.087 -10.674 -28.114
  149    HD2  LYS  16           HD2      LYS  16  10.856 -12.065 -25.989
  150    HD3  LYS  16           HD1      LYS  16   9.209 -11.379 -25.744
  151    HE2  LYS  16           HE2      LYS  16   8.425 -12.437 -27.900
  152    HE3  LYS  16           HE1      LYS  16  10.088 -13.097 -28.183
  153    HZ1  LYS  16           HZ1      LYS  16   8.263 -14.525 -27.088
  154    HZ2  LYS  16           HZ2      LYS  16   8.673 -13.693 -25.665
  155    HZ3  LYS  16           HZ3      LYS  16   9.854 -14.587 -26.497
  156    H    LYS  17           HN       LYS  17  14.823  -9.109 -26.216
  157    HA   LYS  17           HA       LYS  17  14.754  -6.240 -26.301
  158    HB2  LYS  17           HB2      LYS  17  15.333  -7.544 -23.675
  159    HB3  LYS  17           HB1      LYS  17  16.785  -6.669 -24.255
  160    HG2  LYS  17           HG2      LYS  17  14.019  -5.285 -24.151
  161    HG3  LYS  17           HG1      LYS  17  15.036  -5.427 -22.679
  162    HD2  LYS  17           HD2      LYS  17  16.921  -4.230 -23.898
  163    HD3  LYS  17           HD1      LYS  17  15.858  -4.049 -25.339
  164    HE2  LYS  17           HE2      LYS  17  14.240  -2.664 -23.976
  165    HE3  LYS  17           HE1      LYS  17  15.312  -2.847 -22.526
  166    HZ1  LYS  17           HZ1      LYS  17  17.088  -1.874 -24.074
  167    HZ2  LYS  17           HZ2      LYS  17  15.905  -0.842 -23.428
  168    HZ3  LYS  17           HZ3      LYS  17  15.787  -1.364 -25.039
  Start of MODEL   18
    1    H1   GLU   1           HT1      GLU   1   1.728   8.259 -16.509
    2    H2   GLU   1           HT2      GLU   1   0.446   7.627 -15.590
    3    H3   GLU   1           HT3      GLU   1   0.922   6.857 -17.027
    4    HA   GLU   1           HA       GLU   1   2.857   6.051 -16.150
    5    HB2  GLU   1           HB2      GLU   1   2.411   8.096 -13.867
    6    HB3  GLU   1           HB1      GLU   1   3.623   6.764 -13.735
    7    HG2  GLU   1           HG2      GLU   1   4.833   7.644 -15.781
    8    HG3  GLU   1           HG1      GLU   1   3.634   8.992 -15.907
    9    H    MET   2           HN       MET   2   2.489   3.949 -15.580
   10    HA   MET   2           HA       MET   2   0.612   3.421 -13.363
   11    HB2  MET   2           HB2      MET   2   0.853   1.922 -16.052
   12    HB3  MET   2           HB1      MET   2  -0.006   1.255 -14.610
   13    HG2  MET   2           HG2      MET   2  -1.602   3.185 -14.645
   14    HG3  MET   2           HG1      MET   2  -0.753   3.891 -16.056
   15    HE1  MET   2           HE1      MET   2  -0.152   2.195 -18.176
   16    HE2  MET   2           HE2      MET   2  -1.384   3.469 -18.465
   17    HE3  MET   2           HE3      MET   2  -1.650   1.804 -19.086
   18    H    ARG   3           HN       ARG   3   1.159   1.627 -12.045
   19    HA   ARG   3           HA       ARG   3   3.985   0.996 -12.098
   20    HB2  ARG   3           HB2      ARG   3   1.792   0.296 -10.049
   21    HB3  ARG   3           HB1      ARG   3   3.540  -0.077  -9.832
   22    HG2  ARG   3           HG2      ARG   3   2.359   2.757 -10.141
   23    HG3  ARG   3           HG1      ARG   3   2.739   1.953  -8.577
   24    HD2  ARG   3           HD2      ARG   3   5.189   1.703  -9.395
   25    HD3  ARG   3           HD1      ARG   3   4.749   2.755 -10.810
   26    HE   ARG   3           HE       ARG   3   3.904   4.114  -8.413
   27   HH11  ARG   3          HH11      ARG   3   6.972   3.085 -10.019
   28   HH12  ARG   3          HH12      ARG   3   7.917   4.361  -9.328
   29   HH21  ARG   3          HH21      ARG   3   5.232   5.823  -7.506
   30   HH22  ARG   3          HH22      ARG   3   6.917   5.931  -7.887
   31    H    LEU   4           HN       LEU   4   1.173  -0.420 -13.291
   32    HA   LEU   4           HA       LEU   4   2.195  -3.121 -12.970
   33    HB2  LEU   4           HB2      LEU   4  -0.290  -1.937 -14.297
   34    HB3  LEU   4           HB1      LEU   4   0.113  -3.702 -14.248
   35    HG   LEU   4           HG       LEU   4   0.488  -2.969 -11.605
   36   HD11  LEU   4          HD11      LEU   4  -0.329  -0.750 -11.625
   37   HD12  LEU   4          HD12      LEU   4  -1.664  -1.734 -10.897
   38   HD13  LEU   4          HD13      LEU   4  -1.786  -1.187 -12.614
   39   HD21  LEU   4          HD21      LEU   4  -0.634  -5.020 -12.527
   40   HD22  LEU   4          HD22      LEU   4  -2.136  -4.050 -12.812
   41   HD23  LEU   4          HD23      LEU   4  -1.534  -4.302 -11.127
   42    H    SER   5           HN       SER   5   1.996  -0.485 -15.294
   43    HA   SER   5           HA       SER   5   2.877  -2.140 -17.421
   44    HB2  SER   5           HB2      SER   5   2.876   0.925 -17.262
   45    HB3  SER   5           HB1      SER   5   3.223  -0.080 -18.732
   46    HG   SER   5           HG       SER   5   0.990  -0.989 -17.862
   47    H    LYS   6           HN       LYS   6   4.255  -0.637 -14.585
   48    HA   LYS   6           HA       LYS   6   6.838  -0.410 -15.728
   49    HB2  LYS   6           HB2      LYS   6   6.056   1.252 -14.052
   50    HB3  LYS   6           HB1      LYS   6   5.811  -0.066 -12.876
   51    HG2  LYS   6           HG2      LYS   6   8.621   0.059 -13.925
   52    HG3  LYS   6           HG1      LYS   6   8.094   1.565 -13.096
   53    HD2  LYS   6           HD2      LYS   6   7.492   0.335 -11.067
   54    HD3  LYS   6           HD1      LYS   6   7.744  -1.248 -11.883
   55    HE2  LYS   6           HE2      LYS   6  10.223  -0.732 -12.102
   56    HE3  LYS   6           HE1      LYS   6   9.959   0.857 -11.272
   57    HZ1  LYS   6           HZ1      LYS   6   9.141  -0.388  -9.352
   58    HZ2  LYS   6           HZ2      LYS   6  10.744  -0.783  -9.749
   59    HZ3  LYS   6           HZ3      LYS   6   9.485  -1.855 -10.136
   60    H    PHE   7           HN       PHE   7   4.871  -2.616 -13.751
   61    HA   PHE   7           HA       PHE   7   6.849  -4.336 -12.799
   62    HB2  PHE   7           HB2      PHE   7   3.929  -4.298 -12.838
   63    HB3  PHE   7           HB1      PHE   7   4.465  -5.936 -13.296
   64    HD1  PHE   7           HD1      PHE   7   3.862  -3.683 -10.519
   65    HD2  PHE   7           HD2      PHE   7   6.044  -7.072 -11.901
   66    HE1  PHE   7           HE1      PHE   7   4.239  -4.418  -8.213
   67    HE2  PHE   7           HE2      PHE   7   6.411  -7.787  -9.673
   68    HZ   PHE   7           HZ       PHE   7   5.516  -6.479  -7.756
   69    H    PHE   8           HN       PHE   8   4.576  -4.733 -15.468
   70    HA   PHE   8           HA       PHE   8   5.711  -7.190 -16.194
   71    HB2  PHE   8           HB2      PHE   8   4.625  -5.567 -18.357
   72    HB3  PHE   8           HB1      PHE   8   4.287  -7.258 -17.903
   73    HD1  PHE   8           HD1      PHE   8   3.260  -4.414 -18.751
   74    HD2  PHE   8           HD2      PHE   8   2.638  -7.215 -15.623
   75    HE1  PHE   8           HE1      PHE   8   1.180  -3.588 -18.505
   76    HE2  PHE   8           HE2      PHE   8   0.416  -6.345 -15.351
   77    HZ   PHE   8           HZ       PHE   8  -0.359  -4.530 -16.806
   78    H    ARG   9           HN       ARG   9   6.435  -3.858 -16.849
   79    HA   ARG   9           HA       ARG   9   7.373  -4.060 -19.379
   80    HB2  ARG   9           HB2      ARG   9   6.970  -2.183 -17.581
   81    HB3  ARG   9           HB1      ARG   9   8.670  -2.399 -17.156
   82    HG2  ARG   9           HG2      ARG   9   9.328  -1.682 -19.448
   83    HG3  ARG   9           HG1      ARG   9   7.581  -1.515 -19.881
   84    HD2  ARG   9           HD2      ARG   9   7.317   0.235 -17.976
   85    HD3  ARG   9           HD1      ARG   9   9.119   0.131 -17.716
   86    HE   ARG   9           HE       ARG   9   8.722   0.632 -20.509
   87   HH11  ARG   9          HH11      ARG   9   8.101   2.305 -17.373
   88   HH12  ARG   9          HH12      ARG   9   8.237   3.894 -18.047
   89   HH21  ARG   9          HH21      ARG   9   8.893   2.797 -21.363
   90   HH22  ARG   9          HH22      ARG   9   8.690   4.174 -20.333
   91    H    ASP  10           HN       ASP  10   8.940  -4.613 -16.263
   92    HA   ASP  10           HA       ASP  10  11.378  -5.380 -17.488
   93    HB2  ASP  10           HB2      ASP  10  10.513  -5.274 -14.518
   94    HB3  ASP  10           HB1      ASP  10  12.160  -5.777 -15.049
   95    H    ALA  11           HN       ALA  11   8.383  -6.947 -17.028
   96    HA   ALA  11           HA       ALA  11   9.668  -9.501 -16.335
   97    HB1  ALA  11           HB1      ALA  11   7.458  -8.598 -15.225
   98    HB2  ALA  11           HB2      ALA  11   7.523 -10.329 -15.745
   99    HB3  ALA  11           HB3      ALA  11   6.685  -9.100 -16.777
  100    H    ILE  12           HN       ILE  12   7.642  -8.034 -18.861
  101    HA   ILE  12           HA       ILE  12   7.754 -10.448 -20.470
  102    HB   ILE  12           HB       ILE  12   6.508  -7.701 -21.002
  103   HG12  ILE  12          HG12      ILE  12   5.240 -10.162 -19.652
  104   HG13  ILE  12          HG11      ILE  12   5.663  -8.565 -18.918
  105   HG21  ILE  12          HG21      ILE  12   6.713  -9.049 -23.121
  106   HG22  ILE  12          HG22      ILE  12   4.990  -9.080 -22.636
  107   HG23  ILE  12          HG23      ILE  12   6.033 -10.514 -22.320
  108   HD11  ILE  12          HD11      ILE  12   3.494  -9.017 -21.100
  109   HD12  ILE  12          HD12      ILE  12   3.995  -7.415 -20.418
  110   HD13  ILE  12          HD13      ILE  12   3.221  -8.651 -19.355
  111    H    LEU  13           HN       LEU  13   8.930  -7.081 -20.361
  112    HA   LEU  13           HA       LEU  13   9.851  -7.266 -23.079
  113    HB2  LEU  13           HB2      LEU  13  10.172  -4.969 -21.085
  114    HB3  LEU  13           HB1      LEU  13  10.344  -4.864 -22.893
  115    HG   LEU  13           HG       LEU  13   7.829  -5.303 -21.184
  116   HD11  LEU  13          HD11      LEU  13   8.846  -2.945 -21.507
  117   HD12  LEU  13          HD12      LEU  13   7.077  -3.146 -21.815
  118   HD13  LEU  13          HD13      LEU  13   8.232  -3.014 -23.204
  119   HD21  LEU  13          HD21      LEU  13   6.484  -5.081 -23.467
  120   HD22  LEU  13          HD22      LEU  13   7.213  -6.673 -23.074
  121   HD23  LEU  13          HD23      LEU  13   8.021  -5.590 -24.268
  122    H    GLN  14           HN       GLN  14  11.098  -8.255 -20.109
  123    HA   GLN  14           HA       GLN  14  13.817  -7.444 -20.893
  124    HB2  GLN  14           HB2      GLN  14  12.551  -8.751 -18.502
  125    HB3  GLN  14           HB1      GLN  14  14.261  -9.204 -18.857
  126    HG2  GLN  14           HG2      GLN  14  14.587  -6.545 -19.101
  127    HG3  GLN  14           HG1      GLN  14  13.035  -6.492 -18.201
  128   HE21  GLN  14          HE21      GLN  14  16.347  -8.097 -18.031
  129   HE22  GLN  14          HE22      GLN  14  16.475  -8.049 -16.305
  130    H    ARG  15           HN       ARG  15  11.454  -9.766 -21.590
  131    HA   ARG  15           HA       ARG  15  13.357 -11.869 -22.243
  132    HB2  ARG  15           HB2      ARG  15  10.428 -11.697 -23.114
  133    HB3  ARG  15           HB1      ARG  15  11.432 -13.175 -22.860
  134    HG2  ARG  15           HG2      ARG  15  11.508 -12.670 -20.387
  135    HG3  ARG  15           HG1      ARG  15  10.513 -11.194 -20.693
  136    HD2  ARG  15           HD2      ARG  15   9.014 -12.908 -19.870
  137    HD3  ARG  15           HD1      ARG  15   8.674 -12.708 -21.641
  138    HE   ARG  15           HE       ARG  15  10.630 -14.831 -21.260
  139   HH11  ARG  15          HH11      ARG  15   7.122 -14.152 -20.762
  140   HH12  ARG  15          HH12      ARG  15   6.643 -15.808 -20.925
  141   HH21  ARG  15          HH21      ARG  15   9.927 -17.054 -21.480
  142   HH22  ARG  15          HH22      ARG  15   8.253 -17.470 -21.336
  143    H    LYS  16           HN       LYS  16  11.261  -9.436 -23.868
  144    HA   LYS  16           HA       LYS  16  12.737  -9.928 -26.370
  145    HB2  LYS  16           HB2      LYS  16   9.999  -8.767 -25.631
  146    HB3  LYS  16           HB1      LYS  16  10.780  -8.235 -27.157
  147    HG2  LYS  16           HG2      LYS  16   9.225 -10.008 -27.655
  148    HG3  LYS  16           HG1      LYS  16  10.884 -10.615 -27.943
  149    HD2  LYS  16           HD2      LYS  16  10.804 -11.959 -25.823
  150    HD3  LYS  16           HD1      LYS  16   9.208 -11.236 -25.404
  151    HE2  LYS  16           HE2      LYS  16   8.154 -12.341 -27.405
  152    HE3  LYS  16           HE1      LYS  16   9.761 -13.020 -27.890
  153    HZ1  LYS  16           HZ1      LYS  16   9.795 -14.355 -25.978
  154    HZ2  LYS  16           HZ2      LYS  16   8.242 -14.521 -26.642
  155    HZ3  LYS  16           HZ3      LYS  16   8.478 -13.558 -25.263
  156    H    LYS  17           HN       LYS  17  14.649  -8.696 -26.242
  157    HA   LYS  17           HA       LYS  17  14.305  -5.822 -26.143
  158    HB2  LYS  17           HB2      LYS  17  15.279  -7.295 -23.733
  159    HB3  LYS  17           HB1      LYS  17  16.567  -6.221 -24.362
  160    HG2  LYS  17           HG2      LYS  17  13.754  -5.047 -23.982
  161    HG3  LYS  17           HG1      LYS  17  14.723  -5.406 -22.517
  162    HD2  LYS  17           HD2      LYS  17  16.603  -3.963 -23.478
  163    HD3  LYS  17           HD1      LYS  17  15.527  -3.549 -24.862
  164    HE2  LYS  17           HE2      LYS  17  13.876  -2.484 -23.293
  165    HE3  LYS  17           HE1      LYS  17  14.900  -2.954 -21.874
  166    HZ1  LYS  17           HZ1      LYS  17  15.230  -0.819 -23.806
  167    HZ2  LYS  17           HZ2      LYS  17  16.656  -1.648 -23.404
  168    HZ3  LYS  17           HZ3      LYS  17  15.715  -0.933 -22.184
  Start of MODEL   19
    1    H1   GLU   1           HT1      GLU   1   2.990   6.841 -13.447
    2    H2   GLU   1           HT2      GLU   1   3.298   7.890 -14.746
    3    H3   GLU   1           HT3      GLU   1   3.634   6.232 -14.895
    4    HA   GLU   1           HA       GLU   1   1.026   7.577 -14.742
    5    HB2  GLU   1           HB2      GLU   1   2.403   5.753 -16.826
    6    HB3  GLU   1           HB1      GLU   1   0.627   6.068 -16.874
    7    HG2  GLU   1           HG2      GLU   1   1.048   8.547 -17.114
    8    HG3  GLU   1           HG1      GLU   1   2.831   8.255 -17.053
    9    H    MET   2           HN       MET   2   2.235   4.137 -15.269
   10    HA   MET   2           HA       MET   2   0.342   3.276 -13.172
   11    HB2  MET   2           HB2      MET   2   0.846   1.881 -15.880
   12    HB3  MET   2           HB1      MET   2  -0.083   1.166 -14.508
   13    HG2  MET   2           HG2      MET   2  -1.784   3.007 -14.691
   14    HG3  MET   2           HG1      MET   2  -0.858   3.746 -16.033
   15    HE1  MET   2           HE1      MET   2  -2.016  -0.070 -15.107
   16    HE2  MET   2           HE2      MET   2  -3.531  -0.058 -16.072
   17    HE3  MET   2           HE3      MET   2  -3.296   1.145 -14.757
   18    H    ARG   3           HN       ARG   3   1.090   1.599 -11.850
   19    HA   ARG   3           HA       ARG   3   3.952   1.113 -11.999
   20    HB2  ARG   3           HB2      ARG   3   1.934   0.245  -9.835
   21    HB3  ARG   3           HB1      ARG   3   3.728   0.153  -9.699
   22    HG2  ARG   3           HG2      ARG   3   2.034   2.722  -9.920
   23    HG3  ARG   3           HG1      ARG   3   2.795   2.066  -8.429
   24    HD2  ARG   3           HD2      ARG   3   5.104   2.305  -9.640
   25    HD3  ARG   3           HD1      ARG   3   4.220   3.233 -10.930
   26    HE   ARG   3           HE       ARG   3   3.509   4.377  -8.377
   27   HH11  ARG   3          HH11      ARG   3   6.414   4.076 -10.502
   28   HH12  ARG   3          HH12      ARG   3   7.131   5.552  -9.951
   29   HH21  ARG   3          HH21      ARG   3   4.527   6.363  -7.670
   30   HH22  ARG   3          HH22      ARG   3   6.049   6.861  -8.329
   31    H    LEU   4           HN       LEU   4   1.167  -0.407 -13.085
   32    HA   LEU   4           HA       LEU   4   2.245  -3.088 -12.783
   33    HB2  LEU   4           HB2      LEU   4  -0.236  -1.974 -14.186
   34    HB3  LEU   4           HB1      LEU   4   0.195  -3.724 -14.047
   35    HG   LEU   4           HG       LEU   4   0.458  -2.850 -11.423
   36   HD11  LEU   4          HD11      LEU   4  -0.456  -0.670 -11.596
   37   HD12  LEU   4          HD12      LEU   4  -1.785  -1.675 -10.883
   38   HD13  LEU   4          HD13      LEU   4  -1.841  -1.223 -12.630
   39   HD21  LEU   4          HD21      LEU   4  -1.536  -4.240 -10.961
   40   HD22  LEU   4          HD22      LEU   4  -0.535  -4.992 -12.272
   41   HD23  LEU   4          HD23      LEU   4  -2.059  -4.110 -12.687
   42    H    SER   5           HN       SER   5   1.966  -0.443 -15.125
   43    HA   SER   5           HA       SER   5   2.838  -2.016 -17.275
   44    HB2  SER   5           HB2      SER   5   3.068   1.028 -16.968
   45    HB3  SER   5           HB1      SER   5   3.418   0.066 -18.468
   46    HG   SER   5           HG       SER   5   1.137  -0.741 -17.969
   47    H    LYS   6           HN       LYS   6   4.332  -0.214 -14.558
   48    HA   LYS   6           HA       LYS   6   6.888  -0.230 -15.581
   49    HB2  LYS   6           HB2      LYS   6   6.109   1.331 -13.830
   50    HB3  LYS   6           HB1      LYS   6   5.854  -0.044 -12.724
   51    HG2  LYS   6           HG2      LYS   6   8.680   0.123 -13.737
   52    HG3  LYS   6           HG1      LYS   6   8.146   1.603 -12.865
   53    HD2  LYS   6           HD2      LYS   6   7.419   0.212 -10.919
   54    HD3  LYS   6           HD1      LYS   6   7.914  -1.281 -11.790
   55    HE2  LYS   6           HE2      LYS   6  10.321  -0.510 -11.774
   56    HE3  LYS   6           HE1      LYS   6   9.833   1.024 -10.944
   57    HZ1  LYS   6           HZ1      LYS   6   9.833  -0.009  -9.023
   58    HZ2  LYS   6           HZ2      LYS   6  10.549  -1.348  -9.782
   59    HZ3  LYS   6           HZ3      LYS   6   8.865  -1.289  -9.578
   60    H    PHE   7           HN       PHE   7   4.978  -2.537 -13.650
   61    HA   PHE   7           HA       PHE   7   7.006  -4.267 -12.843
   62    HB2  PHE   7           HB2      PHE   7   4.085  -4.241 -12.730
   63    HB3  PHE   7           HB1      PHE   7   4.621  -5.869 -13.235
   64    HD1  PHE   7           HD1      PHE   7   4.132  -3.649 -10.410
   65    HD2  PHE   7           HD2      PHE   7   6.279  -7.007 -11.921
   66    HE1  PHE   7           HE1      PHE   7   4.635  -4.395  -8.130
   67    HE2  PHE   7           HE2      PHE   7   6.766  -7.731  -9.717
   68    HZ   PHE   7           HZ       PHE   7   5.955  -6.444  -7.748
   69    H    PHE   8           HN       PHE   8   4.647  -4.540 -15.480
   70    HA   PHE   8           HA       PHE   8   5.794  -7.020 -16.197
   71    HB2  PHE   8           HB2      PHE   8   4.530  -5.652 -18.387
   72    HB3  PHE   8           HB1      PHE   8   4.205  -7.253 -17.683
   73    HD1  PHE   8           HD1      PHE   8   3.309  -4.310 -18.658
   74    HD2  PHE   8           HD2      PHE   8   2.579  -7.093 -15.547
   75    HE1  PHE   8           HE1      PHE   8   1.276  -3.391 -18.413
   76    HE2  PHE   8           HE2      PHE   8   0.391  -6.126 -15.264
   77    HZ   PHE   8           HZ       PHE   8  -0.305  -4.275 -16.715
   78    H    ARG   9           HN       ARG   9   6.469  -3.681 -16.970
   79    HA   ARG   9           HA       ARG   9   7.268  -4.003 -19.585
   80    HB2  ARG   9           HB2      ARG   9   7.543  -2.108 -17.374
   81    HB3  ARG   9           HB1      ARG   9   9.056  -2.109 -18.320
   82    HG2  ARG   9           HG2      ARG   9   7.891  -1.323 -20.329
   83    HG3  ARG   9           HG1      ARG   9   6.285  -1.612 -19.584
   84    HD2  ARG   9           HD2      ARG   9   6.617   0.793 -19.441
   85    HD3  ARG   9           HD1      ARG   9   6.997   0.197 -17.764
   86    HE   ARG   9           HE       ARG   9   9.439   0.204 -19.338
   87   HH11  ARG   9          HH11      ARG   9   7.118   2.540 -17.854
   88   HH12  ARG   9          HH12      ARG   9   8.301   3.791 -17.665
   89   HH21  ARG   9          HH21      ARG   9  10.991   1.927 -19.056
   90   HH22  ARG   9          HH22      ARG   9  10.519   3.438 -18.355
   91    H    ASP  10           HN       ASP  10   8.960  -4.366 -16.514
   92    HA   ASP  10           HA       ASP  10  11.356  -5.196 -17.766
   93    HB2  ASP  10           HB2      ASP  10  10.560  -5.102 -14.773
   94    HB3  ASP  10           HB1      ASP  10  12.209  -5.520 -15.359
   95    H    ALA  11           HN       ALA  11   8.377  -6.784 -17.196
   96    HA   ALA  11           HA       ALA  11   9.707  -9.321 -16.503
   97    HB1  ALA  11           HB1      ALA  11   6.705  -8.938 -16.831
   98    HB2  ALA  11           HB2      ALA  11   7.544  -8.436 -15.314
   99    HB3  ALA  11           HB3      ALA  11   7.590 -10.165 -15.835
  100    H    ILE  12           HN       ILE  12   7.605  -7.895 -18.995
  101    HA   ILE  12           HA       ILE  12   7.614 -10.355 -20.540
  102    HB   ILE  12           HB       ILE  12   6.379  -7.605 -21.070
  103   HG12  ILE  12          HG12      ILE  12   5.126 -10.048 -19.670
  104   HG13  ILE  12          HG11      ILE  12   5.598  -8.460 -18.948
  105   HG21  ILE  12          HG21      ILE  12   6.487  -8.935 -23.191
  106   HG22  ILE  12          HG22      ILE  12   4.785  -8.987 -22.636
  107   HG23  ILE  12          HG23      ILE  12   5.855 -10.412 -22.372
  108   HD11  ILE  12          HD11      ILE  12   3.893  -7.283 -20.391
  109   HD12  ILE  12          HD12      ILE  12   3.143  -8.503 -19.292
  110   HD13  ILE  12          HD13      ILE  12   3.341  -8.880 -21.043
  111    H    LEU  13           HN       LEU  13   8.834  -7.009 -20.581
  112    HA   LEU  13           HA       LEU  13   9.660  -7.265 -23.329
  113    HB2  LEU  13           HB2      LEU  13  10.072  -4.937 -21.381
  114    HB3  LEU  13           HB1      LEU  13  10.178  -4.858 -23.196
  115    HG   LEU  13           HG       LEU  13   7.719  -5.253 -21.394
  116   HD11  LEU  13          HD11      LEU  13   8.669  -2.922 -21.663
  117   HD12  LEU  13          HD12      LEU  13   6.931  -3.098 -22.125
  118   HD13  LEU  13          HD13      LEU  13   8.202  -2.968 -23.409
  119   HD21  LEU  13          HD21      LEU  13   6.308  -5.010 -23.647
  120   HD22  LEU  13          HD22      LEU  13   6.999  -6.619 -23.239
  121   HD23  LEU  13          HD23      LEU  13   7.809  -5.583 -24.476
  122    H    GLN  14           HN       GLN  14  10.985  -8.211 -20.391
  123    HA   GLN  14           HA       GLN  14  13.700  -7.451 -21.260
  124    HB2  GLN  14           HB2      GLN  14  12.461  -8.543 -18.752
  125    HB3  GLN  14           HB1      GLN  14  14.154  -9.053 -19.097
  126    HG2  GLN  14           HG2      GLN  14  14.520  -6.426 -19.556
  127    HG3  GLN  14           HG1      GLN  14  12.988  -6.275 -18.629
  128   HE21  GLN  14          HE21      GLN  14  16.255  -7.980 -18.402
  129   HE22  GLN  14          HE22      GLN  14  16.435  -7.779 -16.693
  130    H    ARG  15           HN       ARG  15  11.307  -9.805 -21.729
  131    HA   ARG  15           HA       ARG  15  13.106 -12.028 -22.102
  132    HB2  ARG  15           HB2      ARG  15  10.274 -11.665 -23.218
  133    HB3  ARG  15           HB1      ARG  15  11.144 -13.223 -22.932
  134    HG2  ARG  15           HG2      ARG  15  11.193 -12.662 -20.441
  135    HG3  ARG  15           HG1      ARG  15  10.240 -11.178 -20.822
  136    HD2  ARG  15           HD2      ARG  15   8.681 -12.846 -20.003
  137    HD3  ARG  15           HD1      ARG  15   8.401 -12.685 -21.788
  138    HE   ARG  15           HE       ARG  15  10.310 -14.828 -21.293
  139   HH11  ARG  15          HH11      ARG  15   6.790 -14.109 -20.912
  140   HH12  ARG  15          HH12      ARG  15   6.304 -15.764 -21.070
  141   HH21  ARG  15          HH21      ARG  15   9.592 -17.044 -21.506
  142   HH22  ARG  15          HH22      ARG  15   7.910 -17.444 -21.410
  143    H    LYS  16           HN       LYS  16  11.467  -9.564 -24.131
  144    HA   LYS  16           HA       LYS  16  13.118 -10.392 -26.426
  145    HB2  LYS  16           HB2      LYS  16  10.571  -8.698 -26.035
  146    HB3  LYS  16           HB1      LYS  16  11.552  -8.522 -27.529
  147    HG2  LYS  16           HG2      LYS  16   9.664 -10.009 -27.929
  148    HG3  LYS  16           HG1      LYS  16  11.193 -10.928 -28.080
  149    HD2  LYS  16           HD2      LYS  16  10.799 -12.137 -25.988
  150    HD3  LYS  16           HD1      LYS  16   9.542 -10.972 -25.466
  151    HE2  LYS  16           HE2      LYS  16   8.392 -13.024 -26.151
  152    HE3  LYS  16           HE1      LYS  16   8.064 -11.799 -27.441
  153    HZ1  LYS  16           HZ1      LYS  16   9.193 -14.328 -27.690
  154    HZ2  LYS  16           HZ2      LYS  16  10.431 -13.222 -28.045
  155    HZ3  LYS  16           HZ3      LYS  16   8.962 -13.154 -28.894
  156    H    LYS  17           HN       LYS  17  15.179  -9.445 -26.078
  157    HA   LYS  17           HA       LYS  17  15.303  -6.563 -26.058
  158    HB2  LYS  17           HB2      LYS  17  15.644  -8.083 -23.488
  159    HB3  LYS  17           HB1      LYS  17  17.135  -7.184 -23.905
  160    HG2  LYS  17           HG2      LYS  17  14.400  -5.744 -23.907
  161    HG3  LYS  17           HG1      LYS  17  15.248  -6.061 -22.358
  162    HD2  LYS  17           HD2      LYS  17  17.285  -4.832 -23.259
  163    HD3  LYS  17           HD1      LYS  17  16.381  -4.472 -24.773
  164    HE2  LYS  17           HE2      LYS  17  14.676  -3.158 -23.447
  165    HE3  LYS  17           HE1      LYS  17  15.584  -3.526 -21.922
  166    HZ1  LYS  17           HZ1      LYS  17  16.576  -1.992 -24.276
  167    HZ2  LYS  17           HZ2      LYS  17  17.506  -2.404 -22.916
  168    HZ3  LYS  17           HZ3      LYS  17  16.160  -1.383 -22.746
  Start of MODEL   20
    1    H1   GLU   1           HT1      GLU   1   3.383   6.001 -14.503
    2    H2   GLU   1           HT2      GLU   1   2.955   7.485 -13.796
    3    H3   GLU   1           HT3      GLU   1   3.424   7.425 -15.428
    4    HA   GLU   1           HA       GLU   1   0.954   7.581 -14.770
    5    HB2  GLU   1           HB2      GLU   1   2.132   5.732 -16.953
    6    HB3  GLU   1           HB1      GLU   1   0.364   6.083 -16.859
    7    HG2  GLU   1           HG2      GLU   1   0.817   8.553 -17.141
    8    HG3  GLU   1           HG1      GLU   1   2.592   8.221 -17.228
    9    H    MET   2           HN       MET   2   2.175   4.145 -15.304
   10    HA   MET   2           HA       MET   2   0.354   3.290 -13.141
   11    HB2  MET   2           HB2      MET   2   0.805   1.854 -15.837
   12    HB3  MET   2           HB1      MET   2  -0.078   1.151 -14.432
   13    HG2  MET   2           HG2      MET   2  -1.807   2.957 -14.601
   14    HG3  MET   2           HG1      MET   2  -0.931   3.681 -15.991
   15    HE1  MET   2           HE1      MET   2  -3.983   2.980 -15.985
   16    HE2  MET   2           HE2      MET   2  -4.169   2.300 -17.638
   17    HE3  MET   2           HE3      MET   2  -3.086   3.707 -17.363
   18    H    ARG   3           HN       ARG   3   1.138   1.602 -11.842
   19    HA   ARG   3           HA       ARG   3   4.009   1.150 -12.033
   20    HB2  ARG   3           HB2      ARG   3   2.011   0.256  -9.853
   21    HB3  ARG   3           HB1      ARG   3   3.806   0.154  -9.736
   22    HG2  ARG   3           HG2      ARG   3   2.133   2.740  -9.924
   23    HG3  ARG   3           HG1      ARG   3   2.875   2.055  -8.436
   24    HD2  ARG   3           HD2      ARG   3   5.195   2.287  -9.607
   25    HD3  ARG   3           HD1      ARG   3   4.343   3.222 -10.915
   26    HE   ARG   3           HE       ARG   3   3.599   4.366  -8.367
   27   HH11  ARG   3          HH11      ARG   3   6.532   4.063 -10.454
   28   HH12  ARG   3          HH12      ARG   3   7.241   5.539  -9.890
   29   HH21  ARG   3          HH21      ARG   3   4.606   6.349  -7.646
   30   HH22  ARG   3          HH22      ARG   3   6.138   6.846  -8.282
   31    H    LEU   4           HN       LEU   4   1.212  -0.388 -13.089
   32    HA   LEU   4           HA       LEU   4   2.327  -3.053 -12.831
   33    HB2  LEU   4           HB2      LEU   4  -0.214  -1.958 -14.138
   34    HB3  LEU   4           HB1      LEU   4   0.244  -3.704 -14.045
   35    HG   LEU   4           HG       LEU   4   0.589  -2.887 -11.417
   36   HD11  LEU   4          HD11      LEU   4  -1.755  -1.235 -12.495
   37   HD12  LEU   4          HD12      LEU   4  -0.339  -0.710 -11.488
   38   HD13  LEU   4          HD13      LEU   4  -1.640  -1.740 -10.763
   39   HD21  LEU   4          HD21      LEU   4  -1.973  -4.124 -12.614
   40   HD22  LEU   4          HD22      LEU   4  -1.394  -4.284 -10.911
   41   HD23  LEU   4          HD23      LEU   4  -0.437  -5.014 -12.266
   42    H    SER   5           HN       SER   5   2.005  -0.397 -15.150
   43    HA   SER   5           HA       SER   5   2.900  -2.012 -17.289
   44    HB2  SER   5           HB2      SER   5   3.030  -0.046 -18.695
   45    HB3  SER   5           HB1      SER   5   1.490   0.034 -17.771
   46    HG   SER   5           HG       SER   5   3.816   1.253 -16.757
   47    H    LYS   6           HN       LYS   6   4.325  -0.556 -14.479
   48    HA   LYS   6           HA       LYS   6   6.880  -0.275 -15.678
   49    HB2  LYS   6           HB2      LYS   6   6.164   1.371 -13.982
   50    HB3  LYS   6           HB1      LYS   6   5.872   0.054 -12.818
   51    HG2  LYS   6           HG2      LYS   6   8.708   0.121 -13.816
   52    HG3  LYS   6           HG1      LYS   6   8.198   1.641 -13.003
   53    HD2  LYS   6           HD2      LYS   6   7.451   0.346 -11.001
   54    HD3  LYS   6           HD1      LYS   6   7.898  -1.194 -11.814
   55    HE2  LYS   6           HE2      LYS   6  10.326  -0.498 -11.835
   56    HE3  LYS   6           HE1      LYS   6   9.891   1.089 -11.079
   57    HZ1  LYS   6           HZ1      LYS   6   9.893  -1.618  -9.914
   58    HZ2  LYS   6           HZ2      LYS   6   8.850  -0.436  -9.282
   59    HZ3  LYS   6           HZ3      LYS   6  10.527  -0.162  -9.312
   60    H    PHE   7           HN       PHE   7   4.983  -2.533 -13.689
   61    HA   PHE   7           HA       PHE   7   7.012  -4.259 -12.829
   62    HB2  PHE   7           HB2      PHE   7   4.095  -4.209 -12.705
   63    HB3  PHE   7           HB1      PHE   7   4.597  -5.845 -13.214
   64    HD1  PHE   7           HD1      PHE   7   4.174  -3.612 -10.380
   65    HD2  PHE   7           HD2      PHE   7   6.226  -7.021 -11.911
   66    HE1  PHE   7           HE1      PHE   7   4.666  -4.380  -8.101
   67    HE2  PHE   7           HE2      PHE   7   6.703  -7.767  -9.710
   68    HZ   PHE   7           HZ       PHE   7   5.933  -6.466  -7.733
   69    H    PHE   8           HN       PHE   8   4.621  -4.617 -15.417
   70    HA   PHE   8           HA       PHE   8   5.741  -7.083 -16.174
   71    HB2  PHE   8           HB2      PHE   8   4.575  -5.558 -18.345
   72    HB3  PHE   8           HB1      PHE   8   4.220  -7.207 -17.769
   73    HD1  PHE   8           HD1      PHE   8   3.257  -4.297 -18.669
   74    HD2  PHE   8           HD2      PHE   8   2.610  -7.089 -15.538
   75    HE1  PHE   8           HE1      PHE   8   1.194  -3.420 -18.395
   76    HE2  PHE   8           HE2      PHE   8   0.414  -6.163 -15.232
   77    HZ   PHE   8           HZ       PHE   8  -0.335  -4.328 -16.673
   78    H    ARG   9           HN       ARG   9   6.437  -3.745 -16.857
   79    HA   ARG   9           HA       ARG   9   7.290  -3.927 -19.424
   80    HB2  ARG   9           HB2      ARG   9   6.985  -2.070 -17.550
   81    HB3  ARG   9           HB1      ARG   9   8.712  -2.294 -17.256
   82    HG2  ARG   9           HG2      ARG   9   9.179  -1.562 -19.616
   83    HG3  ARG   9           HG1      ARG   9   7.405  -1.337 -19.864
   84    HD2  ARG   9           HD2      ARG   9   7.354   0.410 -17.975
   85    HD3  ARG   9           HD1      ARG   9   9.152   0.196 -17.770
   86    HE   ARG   9           HE       ARG   9   8.648   0.804 -20.550
   87   HH11  ARG   9          HH11      ARG   9   8.444   2.403 -17.318
   88   HH12  ARG   9          HH12      ARG   9   8.716   3.995 -17.944
   89   HH21  ARG   9          HH21      ARG   9   9.019   2.983 -21.337
   90   HH22  ARG   9          HH22      ARG   9   9.045   4.325 -20.244
   91    H    ASP  10           HN       ASP  10   8.998  -4.521 -16.368
   92    HA   ASP  10           HA       ASP  10  11.365  -5.315 -17.702
   93    HB2  ASP  10           HB2      ASP  10  10.654  -5.348 -14.687
   94    HB3  ASP  10           HB1      ASP  10  12.279  -5.768 -15.348
   95    H    ALA  11           HN       ALA  11   8.369  -6.865 -17.117
   96    HA   ALA  11           HA       ALA  11   9.655  -9.437 -16.500
   97    HB1  ALA  11           HB1      ALA  11   6.664  -8.999 -16.871
   98    HB2  ALA  11           HB2      ALA  11   7.478  -8.545 -15.326
   99    HB3  ALA  11           HB3      ALA  11   7.511 -10.264 -15.890
  100    H    ILE  12           HN       ILE  12   7.573  -7.924 -18.956
  101    HA   ILE  12           HA       ILE  12   7.585 -10.330 -20.570
  102    HB   ILE  12           HB       ILE  12   6.389  -7.553 -21.039
  103   HG12  ILE  12          HG12      ILE  12   5.116 -10.015 -19.698
  104   HG13  ILE  12          HG11      ILE  12   5.581  -8.434 -18.956
  105   HG21  ILE  12          HG21      ILE  12   4.798  -8.852 -22.663
  106   HG22  ILE  12          HG22      ILE  12   5.811 -10.319 -22.412
  107   HG23  ILE  12          HG23      ILE  12   6.514  -8.855 -23.193
  108   HD11  ILE  12          HD11      ILE  12   3.124  -8.488 -19.323
  109   HD12  ILE  12          HD12      ILE  12   3.342  -8.829 -21.079
  110   HD13  ILE  12          HD13      ILE  12   3.883  -7.244 -20.388
  111    H    LEU  13           HN       LEU  13   8.866  -7.004 -20.503
  112    HA   LEU  13           HA       LEU  13   9.648  -7.208 -23.266
  113    HB2  LEU  13           HB2      LEU  13  10.085  -4.928 -21.264
  114    HB3  LEU  13           HB1      LEU  13  10.193  -4.799 -23.073
  115    HG   LEU  13           HG       LEU  13   7.721  -5.213 -21.280
  116   HD11  LEU  13          HD11      LEU  13   6.991  -3.030 -21.865
  117   HD12  LEU  13          HD12      LEU  13   8.139  -2.889 -23.258
  118   HD13  LEU  13          HD13      LEU  13   8.765  -2.874 -21.565
  119   HD21  LEU  13          HD21      LEU  13   7.022  -6.531 -23.182
  120   HD22  LEU  13          HD22      LEU  13   7.802  -5.427 -24.376
  121   HD23  LEU  13          HD23      LEU  13   6.306  -4.912 -23.504
  122    H    GLN  14           HN       GLN  14  11.059  -8.244 -20.376
  123    HA   GLN  14           HA       GLN  14  13.739  -7.455 -21.377
  124    HB2  GLN  14           HB2      GLN  14  12.766  -8.698 -18.787
  125    HB3  GLN  14           HB1      GLN  14  14.502  -8.869 -19.272
  126    HG2  GLN  14           HG2      GLN  14  14.286  -6.205 -19.658
  127    HG3  GLN  14           HG1      GLN  14  12.894  -6.401 -18.551
  128   HE21  GLN  14          HE21      GLN  14  13.427  -7.667 -16.371
  129   HE22  GLN  14          HE22      GLN  14  14.980  -7.376 -15.660
  130    H    ARG  15           HN       ARG  15  11.310  -9.796 -21.702
  131    HA   ARG  15           HA       ARG  15  13.044 -12.048 -22.155
  132    HB2  ARG  15           HB2      ARG  15  10.196 -11.537 -23.194
  133    HB3  ARG  15           HB1      ARG  15  11.021 -13.139 -23.099
  134    HG2  ARG  15           HG2      ARG  15  11.122 -12.920 -20.592
  135    HG3  ARG  15           HG1      ARG  15  10.304 -11.309 -20.733
  136    HD2  ARG  15           HD2      ARG  15   8.249 -12.270 -21.502
  137    HD3  ARG  15           HD1      ARG  15   8.988 -13.916 -21.769
  138    HE   ARG  15           HE       ARG  15   9.310 -13.132 -18.986
  139   HH11  ARG  15          HH11      ARG  15   6.746 -14.213 -21.293
  140   HH12  ARG  15          HH12      ARG  15   5.728 -14.867 -20.054
  141   HH21  ARG  15          HH21      ARG  15   7.886 -14.030 -17.357
  142   HH22  ARG  15          HH22      ARG  15   6.379 -14.760 -17.804
  143    H    LYS  16           HN       LYS  16  11.449  -9.524 -24.144
  144    HA   LYS  16           HA       LYS  16  13.101 -10.338 -26.445
  145    HB2  LYS  16           HB2      LYS  16  10.507  -8.756 -26.021
  146    HB3  LYS  16           HB1      LYS  16  11.513  -8.374 -27.457
  147    HG2  LYS  16           HG2      LYS  16   9.734  -9.901 -28.066
  148    HG3  LYS  16           HG1      LYS  16  11.317 -10.717 -28.259
  149    HD2  LYS  16           HD2      LYS  16  10.900 -12.016 -26.105
  150    HD3  LYS  16           HD1      LYS  16   9.338 -11.144 -25.904
  151    HE2  LYS  16           HE2      LYS  16   8.469 -12.168 -28.045
  152    HE3  LYS  16           HE1      LYS  16  10.053 -13.013 -28.285
  153    HZ1  LYS  16           HZ1      LYS  16   8.131 -13.403 -26.044
  154    HZ2  LYS  16           HZ2      LYS  16   9.657 -14.138 -26.160
  155    HZ3  LYS  16           HZ3      LYS  16   8.464 -14.472 -27.321
  156    H    LYS  17           HN       LYS  17  15.163  -9.401 -26.083
  157    HA   LYS  17           HA       LYS  17  15.293  -6.521 -26.075
  158    HB2  LYS  17           HB2      LYS  17  15.619  -8.010 -23.485
  159    HB3  LYS  17           HB1      LYS  17  17.115  -7.121 -23.908
  160    HG2  LYS  17           HG2      LYS  17  14.373  -5.689 -23.922
  161    HG3  LYS  17           HG1      LYS  17  15.252  -5.961 -22.381
  162    HD2  LYS  17           HD2      LYS  17  17.249  -4.721 -23.310
  163    HD3  LYS  17           HD1      LYS  17  16.369  -4.449 -24.855
  164    HE2  LYS  17           HE2      LYS  17  14.622  -3.099 -23.624
  165    HE3  LYS  17           HE1      LYS  17  15.513  -3.371 -22.070
  166    HZ1  LYS  17           HZ1      LYS  17  16.192  -1.315 -22.845
  167    HZ2  LYS  17           HZ2      LYS  17  16.356  -1.825 -24.456
  168    HZ3  LYS  17           HZ3      LYS  17  17.469  -2.344 -23.284