*HEADER    ANTIBIOTIC                              04-JAN-10   2KSG              
*TITLE     SOLUTION STRUCTURE OF DERMCIDIN-1L, A HUMAN ANTIBIOTIC                
*TITLE    2 PEPTIDE                                                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DERMCIDIN;                                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: DCD-1, RESIDUES IN UNP 63-110;                             
*COMPND   5 SYNONYM: PREPROTEOLYSIN, SURVIVAL-PROMOTING PEPTIDE, DCD-1;          
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: DCD, AIDD, DSEP;                                               
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET31.B                                    
*KEYWDS    ANTIBIOTIC PEPTIDE, PEPTIDE-MEMBRANE INTERACTION,                     
*KEYWDS   2 AMPHIPATHIC ALPHA HELIX, ANTIBIOTIC                                  
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    H.JUNG, S.YANG, J.KIM                                                 
*REVDAT   1   02-MAR-10 2KSG    0                                                


! distance restraints file
! No distance corrections applied.
! Trivial distances output.


assign ( resid   24 and name   HA ) ( resid   27 and name   HN ) 4.7 2.9 0.0
assign ( resid   28 and name   HA ) ( resid   31 and name   HN ) 4.4 2.6 0.0
assign ( resid    9 and name   HA ) ( resid   12 and name   HN ) 4.3 2.5 0.0
assign ( resid   29 and name   HA ) ( resid   32 and name   HN ) 4.5 2.7 0.0
assign ( resid    7 and name   HN ) ( resid    7 and name  HA* ) 2.9 1.1 0.0
assign ( resid   19 and name   HN ) ( resid   19 and name  HA* ) 2.8 1.0 0.0
assign ( resid   10 and name   HN ) ( resid   10 and name  HA* ) 2.9 1.1 0.0
assign ( resid   22 and name   HN ) ( resid   22 and name  HA* ) 2.9 1.1 0.0
assign ( resid   35 and name   HN ) ( resid   35 and name  HA* ) 2.8 1.0 0.0
assign ( resid   33 and name   HN ) ( resid   33 and name  HA* ) 2.7 0.9 0.0
assign ( resid   16 and name   HN ) ( resid   16 and name  HA* ) 2.9 1.1 0.0
assign ( resid   16 and name  HA* ) ( resid   17 and name   HN ) 3.0 1.2 0.0
assign ( resid    3 and name   HN ) ( resid    3 and name  HB* ) 3.2 1.4 0.0
assign ( resid    2 and name   HA ) ( resid    3 and name   HN ) 3.2 1.4 0.0
assign ( resid   40 and name   HN ) ( resid   40 and name   HB ) 3.2 1.4 0.0
assign ( resid   14 and name   HN ) ( resid   14 and name  HB* ) 2.9 1.1 0.0
assign ( resid   25 and name   HN ) ( resid   25 and name  HB* ) 3.1 1.3 0.0
assign ( resid   26 and name   HA ) ( resid   29 and name   HN ) 4.0 2.2 0.0
assign ( resid   29 and name   HN ) ( resid   29 and name  HB* ) 3.2 1.4 0.0
assign ( resid   29 and name   HN ) ( resid   29 and name   HG ) 4.1 2.3 0.0
assign ( resid   48 and name   HN ) ( resid   48 and name  HB* ) 3.3 1.5 0.0
assign ( resid   48 and name   HN ) ( resid   48 and name   HG ) 4.4 2.6 0.0
assign ( resid   35 and name  HA* ) ( resid   36 and name   HN ) 3.1 1.3 0.0
assign ( resid   24 and name  HB* ) ( resid   25 and name   HN ) 3.9 2.1 0.0
assign ( resid   13 and name  HB* ) ( resid   14 and name   HN ) 4.1 2.3 0.0
assign ( resid   25 and name   HN ) ( resid   27 and name  HB* ) 5.5 3.7 0.0
assign ( resid   36 and name   HN ) ( resid   36 and name  HB* ) 3.0 1.2 0.0
assign ( resid   10 and name  HA* ) ( resid   11 and name   HN ) 3.4 1.6 0.0
assign ( resid    9 and name   HA ) ( resid   11 and name   HN ) 5.1 3.3 0.0
assign ( resid   11 and name   HN ) ( resid   11 and name  HB* ) 3.0 1.2 0.0
assign ( resid    8 and name   HN ) ( resid    8 and name  HB* ) 3.2 1.4 0.0
assign ( resid    8 and name   HN ) ( resid    8 and name   HG ) 4.9 3.1 0.0
assign ( resid   18 and name   HN ) ( resid   18 and name  HB* ) 3.0 1.2 0.0
assign ( resid   18 and name   HN ) ( resid   18 and name   HG ) 3.7 1.9 0.0
assign ( resid   23 and name   HN ) ( resid   23 and name  HB* ) 3.0 1.2 0.0
assign ( resid   23 and name   HN ) ( resid   23 and name  HG* ) 3.9 2.1 0.0
assign ( resid   23 and name   HN ) ( resid   24 and name  HB* ) 5.3 3.5 0.0
assign ( resid   32 and name   HN ) ( resid   32 and name   HB ) 3.7 1.9 0.0
assign ( resid   32 and name   HN ) ( resid   32 and name HG1* ) 3.8 2.0 0.0
assign ( resid   44 and name   HN ) ( resid   44 and name  HB* ) 2.9 1.1 0.0
assign ( resid   44 and name   HN ) ( resid   44 and name   HG ) 3.8 2.0 0.0
assign ( resid   41 and name   HN ) ( resid   41 and name  HG* ) 4.0 2.2 0.0
assign ( resid   41 and name   HN ) ( resid   41 and name  HB* ) 3.0 1.2 0.0
assign ( resid   36 and name   HA ) ( resid   39 and name   HN ) 4.6 2.8 0.0
assign ( resid   35 and name  HA* ) ( resid   39 and name   HN ) 4.8 3.0 0.0
assign ( resid   37 and name   HA ) ( resid   39 and name   HN ) 5.3 3.5 0.0
assign ( resid   39 and name   HN ) ( resid   39 and name  HB* ) 3.1 1.3 0.0
assign ( resid   38 and name   HN ) ( resid   38 and name  HB1 ) 3.5 1.7 0.0
assign ( resid   38 and name   HN ) ( resid   38 and name  HB2 ) 3.5 1.7 0.0
assign ( resid   41 and name   HA ) ( resid   43 and name   HN ) 5.1 3.3 0.0
assign ( resid   43 and name   HN ) ( resid   43 and name   HB ) 3.2 1.4 0.0
assign ( resid   24 and name   HN ) ( resid   24 and name  HB* ) 3.0 1.2 0.0
assign ( resid   27 and name   HN ) ( resid   27 and name  HG2 ) 4.1 2.3 0.0
assign ( resid   27 and name   HN ) ( resid   27 and name  HG1 ) 4.1 2.3 0.0
assign ( resid   27 and name   HN ) ( resid   27 and name  HB* ) 2.9 1.1 0.0
assign ( resid    8 and name   HG ) ( resid    9 and name   HN ) 4.3 2.5 0.0
assign ( resid    9 and name   HN ) ( resid    9 and name  HB2 ) 3.8 2.0 0.0
assign ( resid    9 and name   HN ) ( resid    9 and name  HB1 ) 3.8 2.0 0.0
assign ( resid    8 and name  HB* ) ( resid    9 and name   HN ) 3.8 2.0 0.0
assign ( resid   21 and name   HN ) ( resid   21 and name  HB* ) 3.2 1.4 0.0
assign ( resid   20 and name   HN ) ( resid   20 and name  HG* ) 3.9 2.1 0.0
assign ( resid   20 and name  HG* ) ( resid   21 and name   HN ) 4.5 2.8 0.0
assign ( resid   19 and name  HA* ) ( resid   20 and name   HN ) 3.2 1.4 0.0
assign ( resid   33 and name  HA* ) ( resid   34 and name   HN ) 3.2 1.4 0.0
assign ( resid    6 and name   HN ) ( resid    6 and name  HB* ) 3.2 1.4 0.0
assign ( resid   34 and name   HN ) ( resid   34 and name  HB* ) 3.5 1.7 0.0
assign ( resid    6 and name   HN ) ( resid    6 and name  HG* ) 4.4 2.6 0.0
assign ( resid   34 and name   HN ) ( resid   34 and name  HG* ) 4.8 3.0 0.0
assign ( resid   10 and name  HA* ) ( resid   13 and name   HN ) 4.2 2.4 0.0
assign ( resid   12 and name  HB* ) ( resid   13 and name   HN ) 3.3 1.5 0.0
assign ( resid   13 and name   HN ) ( resid   13 and name  HB* ) 3.5 1.7 0.0
assign ( resid   12 and name  HD* ) ( resid   13 and name   HN ) 4.9 3.1 0.0
assign ( resid   13 and name   HN ) ( resid   13 and name  HD* ) 4.1 2.3 0.0
assign ( resid   13 and name   HN ) ( resid   13 and name  HG* ) 4.2 2.4 0.0
assign ( resid    5 and name  HG* ) ( resid    6 and name   HN ) 5.0 3.2 0.0
assign ( resid    4 and name  HB* ) ( resid    6 and name   HN ) 4.6 2.8 0.0
assign ( resid   28 and name   HN ) ( resid   28 and name  HB2 ) 3.5 1.7 0.0
assign ( resid   25 and name   HA ) ( resid   28 and name   HN ) 4.0 2.2 0.0
assign ( resid   28 and name   HN ) ( resid   28 and name  HB1 ) 3.5 1.7 0.0
assign ( resid   45 and name   HN ) ( resid   45 and name  HB* ) 3.3 1.5 0.0
assign ( resid   46 and name   HN ) ( resid   46 and name  HB2 ) 3.7 1.9 0.0
assign ( resid   46 and name   HN ) ( resid   46 and name  HB1 ) 3.7 1.9 0.0
assign ( resid   43 and name   HA ) ( resid   46 and name   HN ) 4.5 2.7 0.0
assign ( resid   42 and name   HA ) ( resid   45 and name   HN ) 4.4 2.6 0.0
assign ( resid   43 and name   HA ) ( resid   45 and name   HN ) 5.4 3.6 0.0
assign ( resid   39 and name   HA ) ( resid   42 and name   HN ) 4.5 2.7 0.0
assign ( resid   42 and name   HN ) ( resid   42 and name  HB* ) 3.2 1.4 0.0
assign ( resid   41 and name  HB* ) ( resid   42 and name   HN ) 3.5 1.7 0.0
assign ( resid   26 and name   HN ) ( resid   26 and name   HB ) 3.1 1.3 0.0
assign ( resid   27 and name   HA ) ( resid   31 and name   HN ) 3.8 2.0 0.0
assign ( resid   31 and name   HN ) ( resid   31 and name  HB2 ) 3.9 2.1 0.0
assign ( resid   31 and name   HN ) ( resid   31 and name  HB1 ) 3.9 2.1 0.0
assign ( resid   10 and name  HA* ) ( resid   12 and name   HN ) 4.3 2.5 0.0
assign ( resid   12 and name   HN ) ( resid   12 and name  HB* ) 3.1 1.3 0.0
assign ( resid   12 and name   HN ) ( resid   12 and name  HD* ) 3.7 1.9 0.0
assign ( resid   11 and name  HB* ) ( resid   12 and name   HN ) 3.6 1.8 0.0
assign ( resid   12 and name   HN ) ( resid   12 and name  HG* ) 3.8 2.0 0.0
assign ( resid   15 and name   HN ) ( resid   15 and name   HB ) 3.8 2.0 0.0
assign ( resid   37 and name   HN ) ( resid   37 and name   HB ) 3.3 1.5 0.0
assign ( resid   30 and name   HN ) ( resid   30 and name  HG2 ) 4.0 2.2 0.0
assign ( resid   30 and name   HN ) ( resid   30 and name  HG1 ) 4.0 2.2 0.0
assign ( resid   30 and name   HN ) ( resid   30 and name  HB* ) 3.1 1.3 0.0
assign ( resid   25 and name  HB* ) ( resid   26 and name   HN ) 3.4 1.6 0.0
assign ( resid   18 and name   HA ) ( resid   19 and name   HN ) 3.6 1.8 0.0
assign ( resid   21 and name   HA ) ( resid   22 and name   HN ) 3.4 1.6 0.0
assign ( resid   30 and name   HA ) ( resid   33 and name   HN ) 4.1 2.3 0.0
assign ( resid   17 and name   HN ) ( resid   18 and name   HA ) 4.6 2.8 0.0
assign ( resid   14 and name   HA ) ( resid   16 and name   HN ) 5.1 3.3 0.0
assign ( resid   13 and name   HA ) ( resid   16 and name   HN ) 4.5 2.7 0.0
assign ( resid    7 and name  HA* ) ( resid    8 and name   HN ) 3.5 1.7 0.0
assign ( resid   22 and name  HA* ) ( resid   23 and name   HN ) 3.1 1.3 0.0
assign ( resid   23 and name   HN ) ( resid   24 and name   HA ) 5.2 3.5 0.0
assign ( resid   41 and name   HA ) ( resid   44 and name   HN ) 4.0 2.2 0.0
assign ( resid   35 and name  HA* ) ( resid   38 and name   HN ) 3.8 2.0 0.0
assign ( resid    9 and name   HA ) ( resid   13 and name   HN ) 5.5 3.7 0.0
assign ( resid   41 and name   HA ) ( resid   45 and name   HN ) 5.5 3.7 0.0
assign ( resid   28 and name   HA ) ( resid   30 and name   HN ) 5.0 3.2 0.0
assign ( resid   26 and name   HA ) ( resid   30 and name   HN ) 4.8 3.0 0.0
assign ( resid   38 and name   HA ) ( resid   39 and name   HN ) 3.5 1.7 0.0
assign ( resid   11 and name   HN ) ( resid   12 and name  HB* ) 5.3 3.5 0.0
assign ( resid   11 and name   HN ) ( resid   13 and name  HB* ) 5.5 3.7 0.0
assign ( resid   22 and name  HA* ) ( resid   24 and name   HN ) 4.2 2.4 0.0
assign ( resid   23 and name   HN ) ( resid   23 and name  HD* ) 4.4 2.6 0.0
assign ( resid   41 and name   HN ) ( resid   41 and name  HD* ) 5.4 3.6 0.0
assign ( resid    5 and name   HN ) ( resid    5 and name  HG* ) 3.8 2.0 0.0
assign ( resid    2 and name   HA ) ( resid    4 and name   HN ) 4.7 2.9 0.0
assign ( resid    5 and name   HN ) ( resid    5 and name  HB* ) 3.2 1.4 0.0
assign ( resid    6 and name   HN ) ( resid    7 and name   HN ) 3.6 1.8 0.0
assign ( resid   32 and name   HN ) ( resid   34 and name   HN ) 4.7 2.9 0.0
assign ( resid   34 and name   HN ) ( resid   35 and name   HN ) 3.5 1.7 0.0
assign ( resid   25 and name   HN ) ( resid   26 and name   HN ) 3.4 1.6 0.0
assign ( resid    4 and name   HA ) ( resid    5 and name   HN ) 3.5 1.7 0.0
assign ( resid    3 and name   HN ) ( resid    4 and name   HN ) 3.8 1.9 0.0
assign ( resid    5 and name   HN ) ( resid    6 and name   HN ) 3.6 1.8 0.0
assign ( resid    5 and name   HA ) ( resid    8 and name   HN ) 4.8 3.0 0.0
assign ( resid    6 and name  HB* ) ( resid    7 and name   HN ) 3.9 2.1 0.0
assign ( resid    4 and name  HB* ) ( resid    7 and name   HN ) 5.2 3.5 0.0
assign ( resid    6 and name  HG* ) ( resid    7 and name   HN ) 5.5 3.7 0.0
assign ( resid    7 and name   HN ) ( resid    8 and name  HB* ) 5.4 3.6 0.0
assign ( resid    3 and name  HB* ) ( resid    7 and name   HN ) 5.3 3.5 0.0
assign ( resid    5 and name   HN ) ( resid    7 and name   HN ) 5.5 3.7 0.0
assign ( resid    6 and name   HN ) ( resid    8 and name   HN ) 5.4 3.6 0.0
assign ( resid    3 and name   HN ) ( resid    8 and name   HN ) 5.5 3.7 0.0
assign ( resid    9 and name   HN ) ( resid   10 and name   HN ) 3.4 1.6 0.0
assign ( resid   10 and name   HN ) ( resid   11 and name   HN ) 3.4 1.6 0.0
assign ( resid    8 and name   HA ) ( resid   10 and name   HN ) 4.5 2.7 0.0
assign ( resid    9 and name  HB2 ) ( resid   10 and name   HN ) 4.2 2.4 0.0
assign ( resid    9 and name  HB1 ) ( resid   10 and name   HN ) 4.2 2.4 0.0
assign ( resid   10 and name   HN ) ( resid   11 and name  HB* ) 4.9 3.1 0.0
assign ( resid   11 and name   HN ) ( resid   12 and name  HD* ) 5.2 3.4 0.0
assign ( resid   11 and name   HN ) ( resid   12 and name   HN ) 3.1 1.3 0.0
assign ( resid   14 and name   HN ) ( resid   15 and name   HN ) 3.2 1.4 0.0
assign ( resid   13 and name   HN ) ( resid   14 and name   HN ) 3.3 1.5 0.0
assign ( resid   12 and name   HN ) ( resid   13 and name   HN ) 3.5 1.7 0.0
assign ( resid   17 and name  HA* ) ( resid   18 and name   HN ) 3.4 1.6 0.0
assign ( resid   14 and name  HB* ) ( resid   15 and name   HN ) 3.8 2.0 0.0
assign ( resid   13 and name  HB* ) ( resid   15 and name   HN ) 4.6 2.8 0.0
assign ( resid   24 and name   HN ) ( resid   25 and name   HN ) 3.5 1.7 0.0
assign ( resid   13 and name  HG* ) ( resid   16 and name   HN ) 5.5 3.7 0.0
assign ( resid   14 and name  HB* ) ( resid   16 and name   HN ) 5.5 3.7 0.0
assign ( resid   12 and name  HB* ) ( resid   16 and name   HN ) 5.5 3.7 0.0
assign ( resid   13 and name  HB* ) ( resid   16 and name   HN ) 5.5 3.7 0.0
assign ( resid   15 and name   HB ) ( resid   16 and name   HN ) 4.4 2.6 0.0
assign ( resid   17 and name   HN ) ( resid   20 and name  HG* ) 5.1 3.3 0.0
assign ( resid   17 and name   HN ) ( resid   18 and name  HB* ) 4.9 3.1 0.0
assign ( resid   17 and name   HN ) ( resid   20 and name  HB* ) 5.0 3.2 0.0
assign ( resid   18 and name   HN ) ( resid   19 and name   HN ) 3.6 1.8 0.0
assign ( resid   18 and name   HN ) ( resid   20 and name   HN ) 4.3 2.5 0.0
assign ( resid   17 and name   HN ) ( resid   20 and name   HN ) 5.1 3.3 0.0
assign ( resid   13 and name   HN ) ( resid   16 and name   HN ) 5.5 3.7 0.0
assign ( resid   19 and name   HN ) ( resid   20 and name   HN ) 3.6 1.8 0.0
assign ( resid   18 and name   HG ) ( resid   19 and name   HN ) 4.3 2.5 0.0
assign ( resid   18 and name  HB* ) ( resid   19 and name   HN ) 3.9 2.1 0.0
assign ( resid   19 and name   HN ) ( resid   20 and name  HG* ) 5.5 3.7 0.0
assign ( resid   21 and name  HB* ) ( resid   22 and name   HN ) 4.2 2.4 0.0
assign ( resid   21 and name   HG ) ( resid   22 and name   HN ) 5.0 3.2 0.0
assign ( resid   22 and name   HN ) ( resid   23 and name  HG* ) 4.3 2.5 0.0
assign ( resid   21 and name   HN ) ( resid   24 and name  HB* ) 5.5 3.7 0.0
assign ( resid   22 and name   HN ) ( resid   24 and name  HB* ) 5.5 3.7 0.0
assign ( resid   22 and name   HN ) ( resid   23 and name   HA ) 5.1 3.3 0.0
assign ( resid   21 and name   HN ) ( resid   22 and name   HN ) 3.5 1.7 0.0
assign ( resid   22 and name   HN ) ( resid   24 and name   HN ) 4.9 3.1 0.0
assign ( resid   23 and name  HG* ) ( resid   24 and name   HN ) 4.5 2.7 0.0
assign ( resid   23 and name  HB* ) ( resid   24 and name   HN ) 3.6 1.8 0.0
assign ( resid   23 and name  HD* ) ( resid   24 and name   HN ) 4.9 3.1 0.0
assign ( resid   24 and name   HN ) ( resid   27 and name  HB* ) 5.5 3.7 0.0
assign ( resid   21 and name   HN ) ( resid   23 and name   HN ) 4.6 2.8 0.0
assign ( resid   23 and name   HN ) ( resid   24 and name   HN ) 3.4 1.6 0.0
assign ( resid   21 and name   HN ) ( resid   24 and name   HN ) 5.5 3.7 0.0
assign ( resid   25 and name   HN ) ( resid   26 and name   HA ) 5.5 3.7 0.0
assign ( resid   26 and name   HN ) ( resid   27 and name   HN ) 3.5 1.7 0.0
assign ( resid   25 and name   HN ) ( resid   27 and name   HN ) 4.1 2.3 0.0
assign ( resid   25 and name  HB* ) ( resid   27 and name   HN ) 4.5 2.8 0.0
assign ( resid   24 and name  HB* ) ( resid   27 and name   HN ) 5.5 3.7 0.0
assign ( resid   27 and name   HN ) ( resid   28 and name  HB1 ) 5.5 3.7 0.0
assign ( resid   27 and name   HN ) ( resid   28 and name  HB2 ) 5.5 3.7 0.0
assign ( resid   27 and name   HN ) ( resid   28 and name   HN ) 3.4 1.6 0.0
assign ( resid   25 and name   HN ) ( resid   28 and name   HN ) 5.4 3.6 0.0
assign ( resid   29 and name   HN ) ( resid   30 and name   HN ) 3.5 1.7 0.0
assign ( resid   28 and name   HN ) ( resid   30 and name   HN ) 4.5 2.7 0.0
assign ( resid   26 and name   HA ) ( resid   28 and name   HN ) 5.0 3.2 0.0
assign ( resid   27 and name  HG1 ) ( resid   28 and name   HN ) 5.5 3.7 0.0
assign ( resid   27 and name  HG2 ) ( resid   28 and name   HN ) 5.5 3.7 0.0
assign ( resid   27 and name  HB* ) ( resid   28 and name   HN ) 3.7 1.9 0.0
assign ( resid   28 and name   HN ) ( resid   29 and name  HB* ) 5.1 3.3 0.0
assign ( resid   38 and name   HN ) ( resid   41 and name  HB* ) 5.5 3.7 0.0
assign ( resid   25 and name  HB* ) ( resid   28 and name   HN ) 5.0 3.2 0.0
assign ( resid   28 and name  HB2 ) ( resid   29 and name   HN ) 4.4 2.6 0.0
assign ( resid   28 and name  HB1 ) ( resid   29 and name   HN ) 4.4 2.6 0.0
assign ( resid   29 and name   HN ) ( resid   30 and name  HG2 ) 5.5 3.7 0.0
assign ( resid   29 and name   HN ) ( resid   30 and name  HG1 ) 5.5 3.7 0.0
assign ( resid   27 and name  HB* ) ( resid   29 and name   HN ) 5.2 3.4 0.0
assign ( resid   29 and name   HN ) ( resid   30 and name  HB* ) 5.5 3.7 0.0
assign ( resid   29 and name   HG ) ( resid   30 and name   HN ) 4.0 2.2 0.0
assign ( resid   29 and name  HB* ) ( resid   30 and name   HN ) 3.8 2.0 0.0
assign ( resid   30 and name   HN ) ( resid   31 and name   HA ) 5.5 3.7 0.0
assign ( resid   30 and name   HN ) ( resid   32 and name   HN ) 5.0 3.2 0.0
assign ( resid   27 and name   HN ) ( resid   31 and name   HN ) 5.5 3.7 0.0
assign ( resid   30 and name   HN ) ( resid   31 and name   HN ) 3.5 1.7 0.0
assign ( resid   29 and name   HN ) ( resid   31 and name   HN ) 4.4 2.6 0.0
assign ( resid   31 and name   HN ) ( resid   33 and name   HN ) 4.9 3.1 0.0
assign ( resid   30 and name  HB* ) ( resid   31 and name   HN ) 3.6 1.8 0.0
assign ( resid   30 and name  HG2 ) ( resid   31 and name   HN ) 5.5 3.7 0.0
assign ( resid   30 and name  HG1 ) ( resid   31 and name   HN ) 5.5 3.7 0.0
assign ( resid   29 and name  HB* ) ( resid   31 and name   HN ) 5.4 3.6 0.0
assign ( resid   29 and name   HG ) ( resid   31 and name   HN ) 5.5 3.7 0.0
assign ( resid   32 and name HG2* ) ( resid   33 and name   HN ) 4.1 2.3 0.0
assign ( resid   32 and name HG1* ) ( resid   33 and name   HN ) 4.1 2.3 0.0
assign ( resid   32 and name   HN ) ( resid   32 and name HG2* ) 3.8 2.0 0.0
assign ( resid   32 and name HG1* ) ( resid   34 and name   HN ) 5.3 3.5 0.0
assign ( resid   32 and name HG2* ) ( resid   34 and name   HN ) 5.3 3.5 0.0
assign ( resid   28 and name   HA ) ( resid   32 and name   HN ) 5.1 3.3 0.0
assign ( resid   31 and name   HN ) ( resid   32 and name   HN ) 3.4 1.6 0.0
assign ( resid   33 and name   HN ) ( resid   34 and name   HN ) 3.6 1.8 0.0
assign ( resid   32 and name   HN ) ( resid   33 and name   HN ) 3.6 1.8 0.0
assign ( resid   30 and name   HN ) ( resid   33 and name   HN ) 5.2 3.4 0.0
assign ( resid   31 and name   HA ) ( resid   33 and name   HN ) 5.0 3.2 0.0
assign ( resid   32 and name   HB ) ( resid   33 and name   HN ) 4.1 2.3 0.0
assign ( resid   33 and name   HN ) ( resid   36 and name  HB* ) 5.5 3.7 0.0
assign ( resid   33 and name   HN ) ( resid   34 and name  HB* ) 5.0 3.2 0.0
assign ( resid   34 and name   HN ) ( resid   34 and name  HD* ) 4.6 2.8 0.0
assign ( resid   35 and name   HN ) ( resid   36 and name  HB* ) 4.8 3.0 0.0
assign ( resid   34 and name   HN ) ( resid   36 and name  HB* ) 4.6 2.8 0.0
assign ( resid   34 and name  HB* ) ( resid   35 and name   HN ) 3.8 2.0 0.0
assign ( resid   25 and name   HN ) ( resid   26 and name   HB ) 5.5 3.7 0.0
assign ( resid   36 and name   HN ) ( resid   37 and name   HB ) 5.5 3.7 0.0
assign ( resid   35 and name   HN ) ( resid   36 and name   HN ) 3.4 1.6 0.0
assign ( resid   36 and name   HN ) ( resid   37 and name   HN ) 3.6 1.8 0.0
assign ( resid   37 and name   HN ) ( resid   38 and name   HN ) 3.8 2.0 0.0
assign ( resid   37 and name   HN ) ( resid   40 and name   HN ) 4.8 3.0 0.0
assign ( resid   37 and name   HN ) ( resid   38 and name   HA ) 5.5 3.7 0.0
assign ( resid   36 and name  HB* ) ( resid   37 and name   HN ) 3.6 1.8 0.0
assign ( resid   28 and name   HN ) ( resid   31 and name   HN ) 5.5 3.7 0.0
assign ( resid   36 and name   HN ) ( resid   38 and name   HN ) 5.0 3.2 0.0
assign ( resid   36 and name   HN ) ( resid   39 and name   HN ) 4.8 3.0 0.0
assign ( resid   37 and name   HN ) ( resid   39 and name   HN ) 5.2 3.4 0.0
assign ( resid   36 and name   HA ) ( resid   38 and name   HN ) 4.6 2.8 0.0
assign ( resid   38 and name   HN ) ( resid   39 and name  HB* ) 4.5 2.7 0.0
assign ( resid   37 and name   HB ) ( resid   38 and name   HN ) 4.0 2.2 0.0
assign ( resid   36 and name  HB* ) ( resid   39 and name   HN ) 5.4 3.6 0.0
assign ( resid   37 and name   HB ) ( resid   39 and name   HN ) 5.5 3.7 0.0
assign ( resid   39 and name   HN ) ( resid   40 and name   HB ) 5.5 3.7 0.0
assign ( resid   38 and name  HB2 ) ( resid   39 and name   HN ) 4.1 2.3 0.0
assign ( resid   38 and name  HB1 ) ( resid   39 and name   HN ) 4.1 2.3 0.0
assign ( resid   39 and name   HN ) ( resid   40 and name   HN ) 3.5 1.7 0.0
assign ( resid   40 and name   HN ) ( resid   42 and name   HN ) 4.4 2.6 0.0
assign ( resid   41 and name   HN ) ( resid   42 and name   HN ) 3.6 1.8 0.0
assign ( resid   36 and name   HA ) ( resid   40 and name   HN ) 5.5 3.7 0.0
assign ( resid   39 and name  HB* ) ( resid   40 and name   HN ) 3.4 1.6 0.0
assign ( resid   40 and name   HB ) ( resid   41 and name   HN ) 4.2 2.4 0.0
assign ( resid   39 and name  HB* ) ( resid   41 and name   HN ) 5.2 3.4 0.0
assign ( resid   41 and name   HN ) ( resid   42 and name  HB* ) 5.5 3.7 0.0
assign ( resid   38 and name   HA ) ( resid   41 and name   HN ) 4.9 3.1 0.0
assign ( resid   24 and name   HN ) ( resid   26 and name   HN ) 5.5 3.7 0.0
assign ( resid   42 and name   HN ) ( resid   44 and name   HN ) 5.5 3.7 0.0
assign ( resid   41 and name  HB* ) ( resid   43 and name   HN ) 5.2 3.4 0.0
assign ( resid   43 and name   HN ) ( resid   44 and name  HB* ) 5.5 3.7 0.0
assign ( resid   42 and name  HB* ) ( resid   43 and name   HN ) 3.7 1.9 0.0
assign ( resid   39 and name   HA ) ( resid   43 and name   HN ) 5.3 3.5 0.0
assign ( resid   43 and name   HN ) ( resid   44 and name   HA ) 5.5 3.7 0.0
assign ( resid   42 and name   HN ) ( resid   43 and name   HN ) 3.4 1.6 0.0
assign ( resid   43 and name   HN ) ( resid   44 and name   HN ) 3.4 1.6 0.0
assign ( resid   42 and name   HA ) ( resid   44 and name   HN ) 5.5 3.7 0.0
assign ( resid   43 and name   HB ) ( resid   44 and name   HN ) 3.4 1.6 0.0
assign ( resid   44 and name   HG ) ( resid   45 and name   HN ) 4.2 2.4 0.0
assign ( resid   44 and name  HB* ) ( resid   45 and name   HN ) 3.6 1.8 0.0
assign ( resid   43 and name   HN ) ( resid   45 and name   HN ) 5.0 3.2 0.0
assign ( resid   45 and name   HN ) ( resid   46 and name   HN ) 3.6 1.8 0.0
assign ( resid   46 and name   HN ) ( resid   47 and name   HN ) 3.5 1.7 0.0
assign ( resid   45 and name  HB* ) ( resid   46 and name   HN ) 4.2 2.4 0.0
assign ( resid   46 and name   HN ) ( resid   47 and name   HB ) 5.5 3.7 0.0
assign ( resid   44 and name  HB* ) ( resid   46 and name   HN ) 5.5 3.7 0.0
assign ( resid   44 and name   HG ) ( resid   46 and name   HN ) 5.5 3.7 0.0
assign ( resid    4 and name   HN ) ( resid    8 and name  HB* ) 5.4 3.6 0.0
assign ( resid   47 and name   HN ) ( resid   47 and name   HB ) 3.7 1.9 0.0
assign ( resid    4 and name   HN ) ( resid    7 and name   HN ) 5.0 3.2 0.0
assign ( resid   45 and name   HN ) ( resid   47 and name   HN ) 5.5 3.7 0.0
assign ( resid   47 and name   HB ) ( resid   48 and name   HN ) 4.2 2.4 0.0
assign ( resid    4 and name   HN ) ( resid    4 and name  HB* ) 2.9 1.1 0.0
assign ( resid    4 and name  HB* ) ( resid    5 and name   HN ) 3.3 1.5 0.0
assign ( resid   20 and name   HN ) ( resid   20 and name  HB* ) 3.2 1.4 0.0
assign ( resid   20 and name  HB* ) ( resid   21 and name   HN ) 3.7 1.9 0.0
assign ( resid   21 and name   HN ) ( resid   21 and name   HG ) 3.6 1.8 0.0
assign ( resid    2 and name   HN ) ( resid    3 and name   HN ) 5.0 3.2 0.0
assign ( resid    5 and name   HN ) ( resid    6 and name  HB* ) 5.5 3.7 0.0
assign ( resid    3 and name   HN ) ( resid    7 and name   HN ) 5.1 3.3 0.0
assign ( resid    8 and name   HN ) ( resid    9 and name   HA ) 5.5 3.7 0.0
assign ( resid   11 and name   HN ) ( resid   13 and name   HN ) 4.7 2.9 0.0
assign ( resid   23 and name  HD* ) ( resid   25 and name   HN ) 5.5 3.7 0.0
assign ( resid   13 and name  HD* ) ( resid   14 and name   HN ) 4.9 3.1 0.0
assign ( resid   20 and name   HA ) ( resid   23 and name   HN ) 5.3 3.5 0.0
assign ( resid   21 and name   HA ) ( resid   23 and name   HN ) 5.5 3.7 0.0
assign ( resid   21 and name   HA ) ( resid   24 and name   HN ) 4.3 2.5 0.0
assign ( resid   27 and name   HN ) ( resid   29 and name  HB* ) 5.5 3.7 0.0
assign ( resid    5 and name  HB* ) ( resid    6 and name   HN ) 3.7 1.9 0.0
assign ( resid   34 and name  HG* ) ( resid   35 and name   HN ) 5.5 3.7 0.0
assign ( resid    2 and name  HB* ) ( resid    3 and name   HN ) 3.7 1.9 0.0
assign ( resid    9 and name   HN ) ( resid    9 and name  HB* ) 3.1 1.3 0.0
assign ( resid    9 and name  HB* ) ( resid   10 and name   HN ) 3.7 1.9 0.0
assign ( resid    9 and name  HB* ) ( resid   11 and name   HN ) 5.3 3.5 0.0
assign ( resid   27 and name   HN ) ( resid   27 and name  HG* ) 3.5 1.7 0.0
assign ( resid   28 and name   HN ) ( resid   28 and name  HB* ) 3.0 1.2 0.0
assign ( resid   28 and name  HB* ) ( resid   29 and name   HN ) 3.5 1.7 0.0
assign ( resid   29 and name   HN ) ( resid   32 and name  HG* ) 5.1 3.3 0.0
assign ( resid   30 and name   HN ) ( resid   30 and name  HG* ) 3.4 1.6 0.0
assign ( resid   30 and name   HN ) ( resid   31 and name  HB* ) 5.0 3.2 0.0
assign ( resid   30 and name   HN ) ( resid   32 and name  HG* ) 5.2 3.4 0.0
assign ( resid   30 and name  HG* ) ( resid   31 and name   HN ) 4.8 3.0 0.0
assign ( resid   31 and name   HN ) ( resid   31 and name  HB* ) 3.2 1.4 0.0
assign ( resid   31 and name   HN ) ( resid   32 and name  HG* ) 4.7 2.9 0.0
assign ( resid   31 and name  HB* ) ( resid   32 and name   HN ) 3.4 1.6 0.0
assign ( resid   32 and name   HN ) ( resid   32 and name  HG* ) 3.0 1.2 0.0
assign ( resid   32 and name  HG* ) ( resid   34 and name   HN ) 4.6 2.8 0.0
assign ( resid   32 and name  HG* ) ( resid   35 and name   HN ) 5.2 3.5 0.0
assign ( resid   38 and name   HN ) ( resid   38 and name  HB* ) 3.1 1.3 0.0
assign ( resid   38 and name  HB* ) ( resid   39 and name   HN ) 3.5 1.7 0.0
assign ( resid   45 and name   HN ) ( resid   46 and name  HB* ) 5.3 3.5 0.0
assign ( resid   46 and name  HB* ) ( resid   47 and name   HN ) 4.3 2.5 0.0



!DCD-1L
{dihedral}

restraints
  dihedral

  reset

assign (resid  2  and name c   )  (resid   3 and name n   )
       (resid  3  and name ca  )  (resid   3 and name c   ) 1  -60.0 30.0 2
assign (resid  4  and name c   )  (resid   5 and name n   )
       (resid  5  and name ca  )  (resid   5 and name c   ) 1  -60.0 30.0 2
assign (resid  7  and name c   )  (resid   8 and name n   )
       (resid  8  and name ca  )  (resid   8 and name c   ) 1  -60.0 30.0 2
assign (resid  8  and name c   )  (resid   9 and name n   )
       (resid  9  and name ca  )  (resid   9 and name c   ) 1  -60.0 30.0 2
assign (resid 10  and name c   )  (resid  11 and name n   )
       (resid 11  and name ca  )  (resid  11 and name c   ) 1  -60.0 30.0 2
assign (resid 11  and name c   )  (resid  12 and name n   )
       (resid 12  and name ca  )  (resid  12 and name c   ) 1  -60.0 30.0 2
assign (resid 22  and name c   )  (resid  23 and name n   )
       (resid 23  and name ca  )  (resid  23 and name c   ) 1  -60.0 30.0 2
assign (resid 25  and name c   )  (resid  26 and name n   )
       (resid 26  and name ca  )  (resid  26 and name c   ) 1  -60.0 30.0 2
assign (resid 26  and name c   )  (resid  27 and name n   )
       (resid 27  and name ca  )  (resid  27 and name c   ) 1  -60.0 30.0 2
assign (resid 27  and name c   )  (resid  28 and name n   )
       (resid 28  and name ca  )  (resid  28 and name c   ) 1  -60.0 30.0 2
assign (resid 29  and name c   )  (resid  30 and name n   )
       (resid 30  and name ca  )  (resid  30 and name c   ) 1  -60.0 30.0 2
assign (resid 31  and name c   )  (resid  32 and name n   )
       (resid 32  and name ca  )  (resid  32 and name c   ) 1  -60.0 30.0 2
assign (resid 35  and name c   )  (resid  36 and name n   )
       (resid 36  and name ca  )  (resid  36 and name c   ) 1  -60.0 30.0 2
assign (resid 39  and name c   )  (resid  40 and name n   )
       (resid 40  and name ca  )  (resid  40 and name c   ) 1  -60.0 30.0 2
assign (resid 40  and name c   )  (resid  41 and name n   )
       (resid 41  and name ca  )  (resid  41 and name c   ) 1  -60.0 30.0 2
assign (resid 43  and name c   )  (resid  44 and name n   )
       (resid 44  and name ca  )  (resid  44 and name c   ) 1  -60.0 30.0 2
assign (resid 44  and name c   )  (resid  45 and name n   )
       (resid 45  and name ca  )  (resid  45 and name c   ) 1  -60.0 30.0 2
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           1HT      SER   1  10.063  12.998  -5.235
    2    H2   SER   1           2HT      SER   1  11.131  12.287  -4.130
    3    H3   SER   1           3HT      SER   1  10.015  11.322  -4.973
    4    HA   SER   1           HA       SER   1  11.090  11.807  -7.044
    5    HB2  SER   1           2HB      SER   1  11.893  14.072  -6.392
    6    HB3  SER   1           1HB      SER   1  13.101  13.322  -5.350
    7    HG   SER   1           HG       SER   1  14.308  13.269  -7.060
    8    H    SER   2           H        SER   2  11.345   9.625  -7.069
    9    HA   SER   2           HA       SER   2  13.789   8.606  -5.803
   10    HB2  SER   2           2HB      SER   2  12.387   6.376  -5.689
   11    HB3  SER   2           1HB      SER   2  12.218   7.594  -4.423
   12    HG   SER   2           HG       SER   2  10.461   6.938  -6.529
   13    H    LEU   3           H        LEU   3  15.005   8.646  -7.632
   14    HA   LEU   3           HA       LEU   3  13.922   7.669 -10.131
   15    HB2  LEU   3           2HB      LEU   3  16.599   8.857  -9.410
   16    HB3  LEU   3           1HB      LEU   3  16.205   8.286 -11.015
   17    HG   LEU   3           HG       LEU   3  15.939  10.624 -11.075
   18   HD11  LEU   3          1HD1      LEU   3  13.558  10.934 -11.518
   19   HD12  LEU   3          2HD1      LEU   3  13.213   9.398 -10.721
   20   HD13  LEU   3          3HD1      LEU   3  14.169   9.428 -12.203
   21   HD21  LEU   3          3HD2      LEU   3  15.901  11.071  -8.689
   22   HD22  LEU   3          1HD2      LEU   3  14.269  10.414  -8.575
   23   HD23  LEU   3          2HD2      LEU   3  14.565  11.889  -9.497
   24    H    LEU   4           H        LEU   4  16.502   6.744  -7.868
   25    HA   LEU   4           HA       LEU   4  16.583   4.126  -9.208
   26    HB2  LEU   4           2HB      LEU   4  18.935   5.759  -8.250
   27    HB3  LEU   4           1HB      LEU   4  19.042   4.047  -8.603
   28    HG   LEU   4           HG       LEU   4  18.125   4.781 -10.957
   29   HD11  LEU   4          1HD1      LEU   4  17.728   7.112 -10.361
   30   HD12  LEU   4          2HD1      LEU   4  18.943   6.976 -11.633
   31   HD13  LEU   4          3HD1      LEU   4  19.438   7.309  -9.974
   32   HD21  LEU   4          3HD2      LEU   4  20.963   5.253 -10.059
   33   HD22  LEU   4          1HD2      LEU   4  20.436   5.023 -11.726
   34   HD23  LEU   4          2HD2      LEU   4  20.270   3.710 -10.560
   35    H    GLU   5           H        GLU   5  18.227   2.762  -7.617
   36    HA   GLU   5           HA       GLU   5  16.766   1.998  -5.407
   37    HB2  GLU   5           2HB      GLU   5  18.958   0.994  -4.604
   38    HB3  GLU   5           1HB      GLU   5  18.444   0.530  -6.221
   39    HG2  GLU   5           2HG      GLU   5  20.029   1.974  -7.234
   40    HG3  GLU   5           1HG      GLU   5  20.395   2.754  -5.697
   41    H    LYS   6           H        LYS   6  19.447   4.313  -5.575
   42    HA   LYS   6           HA       LYS   6  19.323   4.833  -2.735
   43    HB2  LYS   6           2HB      LYS   6  20.959   6.144  -4.912
   44    HB3  LYS   6           1HB      LYS   6  21.155   6.428  -3.189
   45    HG2  LYS   6           2HG      LYS   6  21.774   4.083  -2.870
   46    HG3  LYS   6           1HG      LYS   6  21.573   3.799  -4.598
   47    HD2  LYS   6           2HD      LYS   6  23.329   5.437  -5.069
   48    HD3  LYS   6           1HD      LYS   6  23.538   5.707  -3.341
   49    HE2  LYS   6           2HE      LYS   6  25.249   4.200  -4.172
   50    HE3  LYS   6           1HE      LYS   6  24.174   3.351  -3.063
   51    HZ1  LYS   6           3HZ      LYS   6  23.141   2.222  -4.826
   52    HZ2  LYS   6           1HZ      LYS   6  24.799   2.156  -5.183
   53    HZ3  LYS   6           2HZ      LYS   6  23.794   3.253  -5.999
   54    H    GLY   7           H        GLY   7  17.233   5.588  -4.959
   55    HA2  GLY   7           2HA      GLY   7  16.947   8.433  -4.340
   56    HA3  GLY   7           1HA      GLY   7  15.968   7.508  -5.477
   57    H    LEU   8           H        LEU   8  16.067   5.494  -3.035
   58    HA   LEU   8           HA       LEU   8  13.531   6.391  -1.952
   59    HB2  LEU   8           2HB      LEU   8  15.106   3.842  -1.724
   60    HB3  LEU   8           1HB      LEU   8  13.724   4.150  -0.695
   61    HG   LEU   8           HG       LEU   8  12.931   2.804  -2.462
   62   HD11  LEU   8          1HD1      LEU   8  11.336   4.231  -3.632
   63   HD12  LEU   8          2HD1      LEU   8  12.243   5.656  -3.128
   64   HD13  LEU   8          3HD1      LEU   8  11.448   4.645  -1.922
   65   HD21  LEU   8          3HD2      LEU   8  13.281   3.293  -4.823
   66   HD22  LEU   8          1HD2      LEU   8  14.817   3.072  -3.983
   67   HD23  LEU   8          2HD2      LEU   8  14.262   4.695  -4.391
   68    H    ASP   9           H        ASP   9  13.143   6.688   0.269
   69    HA   ASP   9           HA       ASP   9  15.388   7.987   1.556
   70    HB2  ASP   9           2HB      ASP   9  13.165   9.067   1.435
   71    HB3  ASP   9           1HB      ASP   9  12.503   7.778   2.435
   72    H    GLY  10           H        GLY  10  13.337   5.189   2.044
   73    HA2  GLY  10           2HA      GLY  10  14.299   4.587   4.673
   74    HA3  GLY  10           1HA      GLY  10  13.385   3.511   3.625
   75    H    ALA  11           H        ALA  11  15.861   4.472   1.757
   76    HA   ALA  11           HA       ALA  11  17.184   1.984   1.844
   77    HB1  ALA  11           1HB      ALA  11  17.083   3.374  -0.163
   78    HB2  ALA  11           2HB      ALA  11  18.748   2.969   0.257
   79    HB3  ALA  11           3HB      ALA  11  18.112   4.574   0.617
   80    H    LYS  12           H        LYS  12  17.689   4.951   3.576
   81    HA   LYS  12           HA       LYS  12  20.384   4.242   4.384
   82    HB2  LYS  12           2HB      LYS  12  18.592   6.499   5.309
   83    HB3  LYS  12           1HB      LYS  12  20.273   6.291   5.773
   84    HG2  LYS  12           2HG      LYS  12  20.536   7.802   4.108
   85    HG3  LYS  12           1HG      LYS  12  20.625   6.328   3.151
   86    HD2  LYS  12           2HD      LYS  12  19.139   7.602   1.923
   87    HD3  LYS  12           1HD      LYS  12  18.049   6.634   2.920
   88    HE2  LYS  12           2HE      LYS  12  18.950   9.432   3.612
   89    HE3  LYS  12           1HE      LYS  12  17.451   9.062   2.768
   90    HZ1  LYS  12           3HZ      LYS  12  16.837   7.682   4.732
   91    HZ2  LYS  12           1HZ      LYS  12  16.948   9.342   5.053
   92    HZ3  LYS  12           2HZ      LYS  12  18.196   8.302   5.543
   93    H    LYS  13           H        LYS  13  17.460   3.110   5.232
   94    HA   LYS  13           HA       LYS  13  18.140   2.852   8.085
   95    HB2  LYS  13           2HB      LYS  13  16.192   4.285   7.701
   96    HB3  LYS  13           1HB      LYS  13  15.414   3.011   6.780
   97    HG2  LYS  13           2HG      LYS  13  16.179   2.490   9.614
   98    HG3  LYS  13           1HG      LYS  13  14.758   3.477   9.263
   99    HD2  LYS  13           2HD      LYS  13  13.955   1.612   7.782
  100    HD3  LYS  13           1HD      LYS  13  15.280   0.633   8.417
  101    HE2  LYS  13           2HE      LYS  13  13.037   1.868  10.011
  102    HE3  LYS  13           1HE      LYS  13  13.215   0.163   9.608
  103    HZ1  LYS  13           3HZ      LYS  13  15.408   0.305  10.850
  104    HZ2  LYS  13           1HZ      LYS  13  13.989   0.366  11.782
  105    HZ3  LYS  13           2HZ      LYS  13  14.852   1.789  11.459
  106    H    ALA  14           H        ALA  14  16.641   1.224   5.311
  107    HA   ALA  14           HA       ALA  14  16.187  -1.181   6.830
  108    HB1  ALA  14           1HB      ALA  14  15.191  -2.054   4.809
  109    HB2  ALA  14           2HB      ALA  14  15.821  -0.692   3.883
  110    HB3  ALA  14           3HB      ALA  14  14.598  -0.423   5.126
  111    H    VAL  15           H        VAL  15  18.264  -0.384   4.024
  112    HA   VAL  15           HA       VAL  15  19.245  -3.110   3.990
  113    HB   VAL  15           HB       VAL  15  18.685  -1.742   1.919
  114   HG11  VAL  15          1HG1      VAL  15  21.362  -0.504   2.525
  115   HG12  VAL  15          2HG1      VAL  15  19.805   0.322   2.486
  116   HG13  VAL  15          3HG1      VAL  15  20.485  -0.346   1.002
  117   HG21  VAL  15          3HG2      VAL  15  21.372  -3.092   2.095
  118   HG22  VAL  15          1HG2      VAL  15  20.497  -2.741   0.602
  119   HG23  VAL  15          2HG2      VAL  15  19.816  -3.862   1.777
  120    H    GLY  16           H        GLY  16  20.062  -0.508   5.796
  121    HA2  GLY  16           2HA      GLY  16  22.882  -1.363   5.932
  122    HA3  GLY  16           1HA      GLY  16  22.439   0.337   5.987
  123    H    GLY  17           H        GLY  17  21.243  -2.610   7.592
  124    HA2  GLY  17           2HA      GLY  17  20.562  -1.257   9.976
  125    HA3  GLY  17           1HA      GLY  17  20.679  -2.996   9.779
  126    H    LEU  18           H        LEU  18  23.367  -3.288   9.171
  127    HA   LEU  18           HA       LEU  18  24.458  -3.204  11.803
  128    HB2  LEU  18           2HB      LEU  18  24.944  -4.986  10.157
  129    HB3  LEU  18           1HB      LEU  18  25.828  -3.828   9.186
  130    HG   LEU  18           HG       LEU  18  27.432  -3.526  11.065
  131   HD11  LEU  18          1HD1      LEU  18  27.435  -5.150  12.886
  132   HD12  LEU  18          2HD1      LEU  18  25.921  -5.833  12.291
  133   HD13  LEU  18          3HD1      LEU  18  25.964  -4.178  12.902
  134   HD21  LEU  18          3HD2      LEU  18  28.575  -5.663  10.754
  135   HD22  LEU  18          1HD2      LEU  18  27.925  -5.060   9.230
  136   HD23  LEU  18          2HD2      LEU  18  27.100  -6.362  10.090
  137    H    GLY  19           H        GLY  19  24.685  -1.147   9.022
  138    HA2  GLY  19           2HA      GLY  19  26.889   0.379  10.202
  139    HA3  GLY  19           1HA      GLY  19  26.191   0.627   8.608
  140    H    LYS  20           H        LYS  20  23.676   0.266  10.694
  141    HA   LYS  20           HA       LYS  20  23.128   3.115  10.573
  142    HB2  LYS  20           2HB      LYS  20  21.501   1.159  10.013
  143    HB3  LYS  20           1HB      LYS  20  21.280   1.054  11.751
  144    HG2  LYS  20           2HG      LYS  20  20.957   3.724  10.519
  145    HG3  LYS  20           1HG      LYS  20  19.725   2.522  10.155
  146    HD2  LYS  20           2HD      LYS  20  20.581   3.324  12.936
  147    HD3  LYS  20           1HD      LYS  20  19.162   3.950  12.096
  148    HE2  LYS  20           2HE      LYS  20  18.292   2.256  13.435
  149    HE3  LYS  20           1HE      LYS  20  18.467   1.490  11.859
  150    HZ1  LYS  20           3HZ      LYS  20  19.281  -0.019  13.470
  151    HZ2  LYS  20           1HZ      LYS  20  20.225   1.174  14.230
  152    HZ3  LYS  20           2HZ      LYS  20  20.643   0.615  12.688
  153    H    LEU  21           H        LEU  21  25.152   2.932  12.190
  154    HA   LEU  21           HA       LEU  21  23.939   3.687  14.743
  155    HB2  LEU  21           2HB      LEU  21  26.416   1.971  14.469
  156    HB3  LEU  21           1HB      LEU  21  25.932   2.762  15.954
  157    HG   LEU  21           HG       LEU  21  23.695   1.392  15.537
  158   HD11  LEU  21          1HD1      LEU  21  24.406   0.443  13.406
  159   HD12  LEU  21          2HD1      LEU  21  24.163  -0.817  14.615
  160   HD13  LEU  21          3HD1      LEU  21  25.797  -0.301  14.193
  161   HD21  LEU  21          3HD2      LEU  21  25.070   1.253  17.527
  162   HD22  LEU  21          1HD2      LEU  21  26.233   0.232  16.677
  163   HD23  LEU  21          2HD2      LEU  21  24.602  -0.361  16.994
  164    H    GLY  22           H        GLY  22  24.143   5.762  13.664
  165    HA2  GLY  22           2HA      GLY  22  25.698   7.642  14.388
  166    HA3  GLY  22           1HA      GLY  22  26.935   6.732  13.532
  167    H    LYS  23           H        LYS  23  25.092   5.910  11.406
  168    HA   LYS  23           HA       LYS  23  25.331   8.268   9.764
  169    HB2  LYS  23           2HB      LYS  23  24.702   6.903   7.928
  170    HB3  LYS  23           1HB      LYS  23  25.728   5.901   8.943
  171    HG2  LYS  23           2HG      LYS  23  23.846   4.702   9.787
  172    HG3  LYS  23           1HG      LYS  23  22.719   5.820   9.018
  173    HD2  LYS  23           2HD      LYS  23  24.613   3.932   7.624
  174    HD3  LYS  23           1HD      LYS  23  22.859   3.781   7.726
  175    HE2  LYS  23           2HE      LYS  23  22.550   5.769   6.421
  176    HE3  LYS  23           1HE      LYS  23  24.279   6.108   6.449
  177    HZ1  LYS  23           3HZ      LYS  23  23.735   5.162   4.352
  178    HZ2  LYS  23           1HZ      LYS  23  22.922   3.857   5.069
  179    HZ3  LYS  23           2HZ      LYS  23  24.604   3.994   5.220
  180    H    ASP  24           H        ASP  24  22.963   6.771  11.696
  181    HA   ASP  24           HA       ASP  24  20.634   7.818  10.441
  182    HB2  ASP  24           2HB      ASP  24  19.566   7.236  12.672
  183    HB3  ASP  24           1HB      ASP  24  20.335   5.901  11.821
  184    H    ALA  25           H        ALA  25  20.384   9.895  10.217
  185    HA   ALA  25           HA       ALA  25  20.380  11.647  12.530
  186    HB1  ALA  25           1HB      ALA  25  22.279  12.190  10.249
  187    HB2  ALA  25           2HB      ALA  25  22.744  11.679  11.870
  188    HB3  ALA  25           3HB      ALA  25  21.975  13.248  11.630
  189    H    VAL  26           H        VAL  26  20.385  11.570   8.975
  190    HA   VAL  26           HA       VAL  26  18.663  13.804   8.643
  191    HB   VAL  26           HB       VAL  26  19.014  11.504   6.706
  192   HG11  VAL  26          1HG1      VAL  26  18.511  13.174   5.004
  193   HG12  VAL  26          2HG1      VAL  26  18.322  14.403   6.255
  194   HG13  VAL  26          3HG1      VAL  26  17.197  13.046   6.176
  195   HG21  VAL  26          3HG2      VAL  26  20.850  12.773   5.717
  196   HG22  VAL  26          1HG2      VAL  26  21.205  12.328   7.385
  197   HG23  VAL  26          2HG2      VAL  26  20.715  13.977   6.998
  198    H    GLU  27           H        GLU  27  18.238  10.373   8.980
  199    HA   GLU  27           HA       GLU  27  15.556  10.082   8.290
  200    HB2  GLU  27           2HB      GLU  27  17.141   8.597  10.401
  201    HB3  GLU  27           1HB      GLU  27  15.618   8.060   9.713
  202    HG2  GLU  27           2HG      GLU  27  17.439   6.847   8.721
  203    HG3  GLU  27           1HG      GLU  27  16.679   7.879   7.513
  204    H    ASP  28           H        ASP  28  17.076  10.969  11.328
  205    HA   ASP  28           HA       ASP  28  14.841  10.864  13.004
  206    HB2  ASP  28           2HB      ASP  28  17.102  10.987  13.882
  207    HB3  ASP  28           1HB      ASP  28  17.331  12.577  13.164
  208    H    LEU  29           H        LEU  29  16.241  13.646  11.266
  209    HA   LEU  29           HA       LEU  29  14.162  15.364  12.272
  210    HB2  LEU  29           2HB      LEU  29  15.325  17.104  10.837
  211    HB3  LEU  29           1HB      LEU  29  16.224  16.427  12.177
  212    HG   LEU  29           HG       LEU  29  17.222  14.834  10.366
  213   HD11  LEU  29          1HD1      LEU  29  16.301  17.147   8.671
  214   HD12  LEU  29          2HD1      LEU  29  15.757  15.474   8.540
  215   HD13  LEU  29          3HD1      LEU  29  17.430  15.888   8.169
  216   HD21  LEU  29          3HD2      LEU  29  19.001  16.466   9.939
  217   HD22  LEU  29          1HD2      LEU  29  18.502  16.459  11.631
  218   HD23  LEU  29          2HD2      LEU  29  17.961  17.749  10.558
  219    H    GLU  30           H        GLU  30  14.732  13.600   9.318
  220    HA   GLU  30           HA       GLU  30  12.763  15.095   7.845
  221    HB2  GLU  30           2HB      GLU  30  14.237  12.535   7.278
  222    HB3  GLU  30           1HB      GLU  30  12.976  13.143   6.214
  223    HG2  GLU  30           2HG      GLU  30  15.495  14.608   6.963
  224    HG3  GLU  30           1HG      GLU  30  15.205  13.766   5.441
  225    H    SER  31           H        SER  31  12.786  12.261   9.878
  226    HA   SER  31           HA       SER  31  10.324  11.159   9.080
  227    HB2  SER  31           2HB      SER  31  11.994  10.000  10.540
  228    HB3  SER  31           1HB      SER  31  11.545  11.084  11.852
  229    HG   SER  31           HG       SER  31  10.409   8.813  11.220
  230    H    VAL  32           H        VAL  32  11.159  13.697  11.375
  231    HA   VAL  32           HA       VAL  32   8.616  14.065  12.515
  232    HB   VAL  32           HB       VAL  32  10.747  16.163  12.073
  233   HG11  VAL  32          1HG1      VAL  32   9.736  17.295  13.980
  234   HG12  VAL  32          2HG1      VAL  32   8.504  16.037  14.087
  235   HG13  VAL  32          3HG1      VAL  32   8.568  17.091  12.674
  236   HG21  VAL  32          3HG2      VAL  32  11.528  15.603  14.319
  237   HG22  VAL  32          1HG2      VAL  32  11.642  14.213  13.242
  238   HG23  VAL  32          2HG2      VAL  32  10.332  14.310  14.418
  239    H    GLY  33           H        GLY  33  10.191  15.690   9.769
  240    HA2  GLY  33           2HA      GLY  33   8.019  17.384   9.136
  241    HA3  GLY  33           1HA      GLY  33   9.341  16.966   8.058
  242    H    LYS  34           H        LYS  34   8.820  14.110   8.177
  243    HA   LYS  34           HA       LYS  34   6.675  14.009   6.228
  244    HB2  LYS  34           2HB      LYS  34   8.744  12.029   7.161
  245    HB3  LYS  34           1HB      LYS  34   7.419  11.553   6.106
  246    HG2  LYS  34           2HG      LYS  34   8.166  12.948   4.368
  247    HG3  LYS  34           1HG      LYS  34   9.280  13.805   5.433
  248    HD2  LYS  34           2HD      LYS  34  10.756  11.983   5.537
  249    HD3  LYS  34           1HD      LYS  34   9.550  10.862   4.904
  250    HE2  LYS  34           2HE      LYS  34   9.744  11.696   2.729
  251    HE3  LYS  34           1HE      LYS  34  10.530  13.177   3.274
  252    HZ1  LYS  34           3HZ      LYS  34  11.796  10.513   3.575
  253    HZ2  LYS  34           1HZ      LYS  34  12.521  12.038   3.682
  254    HZ3  LYS  34           2HZ      LYS  34  11.999  11.464   2.181
  255    H    GLY  35           H        GLY  35   6.445  14.219   9.345
  256    HA2  GLY  35           2HA      GLY  35   4.464  13.810  10.544
  257    HA3  GLY  35           1HA      GLY  35   4.077  12.514   9.423
  258    H    ALA  36           H        ALA  36   6.142  13.430  12.121
  259    HA   ALA  36           HA       ALA  36   7.345  10.967  12.623
  260    HB1  ALA  36           1HB      ALA  36   8.049  13.055  13.689
  261    HB2  ALA  36           2HB      ALA  36   7.744  11.790  14.880
  262    HB3  ALA  36           3HB      ALA  36   6.560  13.073  14.634
  263    H    VAL  37           H        VAL  37   4.130  12.059  13.229
  264    HA   VAL  37           HA       VAL  37   3.259  10.300  15.199
  265    HB   VAL  37           HB       VAL  37   1.703  11.297  12.803
  266   HG11  VAL  37          1HG1      VAL  37   0.589   9.433  13.891
  267   HG12  VAL  37          2HG1      VAL  37  -0.280  10.936  14.200
  268   HG13  VAL  37          3HG1      VAL  37   0.741  10.232  15.455
  269   HG21  VAL  37          3HG2      VAL  37   2.004  12.472  15.568
  270   HG22  VAL  37          1HG2      VAL  37   0.920  13.068  14.309
  271   HG23  VAL  37          2HG2      VAL  37   2.666  13.133  14.074
  272    H    HIS  38           H        HIS  38   3.364   9.881  11.672
  273    HA   HIS  38           HA       HIS  38   2.217   7.294  11.668
  274    HB2  HIS  38           2HB      HIS  38   2.192   8.631   9.642
  275    HB3  HIS  38           1HB      HIS  38   3.952   8.664   9.602
  276    HD1  HIS  38           1HD      HIS  38   4.691   7.248   7.710
  277    HD2  HIS  38           2HD      HIS  38   1.489   5.536   9.753
  278    HE1  HIS  38           1HE      HIS  38   4.297   5.018   6.617
  279    HE2  HIS  38           2HE      HIS  38   2.386   3.976   7.888
  280    H    ASP  39           H        ASP  39   5.527   8.454  11.918
  281    HA   ASP  39           HA       ASP  39   6.836   6.038  11.346
  282    HB2  ASP  39           2HB      ASP  39   7.930   8.292  11.519
  283    HB3  ASP  39           1HB      ASP  39   7.801   8.164  13.271
  284    H    VAL  40           H        VAL  40   6.081   7.455  14.539
  285    HA   VAL  40           HA       VAL  40   6.861   5.131  15.962
  286    HB   VAL  40           HB       VAL  40   6.842   7.317  17.047
  287   HG11  VAL  40          1HG1      VAL  40   4.752   8.393  17.732
  288   HG12  VAL  40          2HG1      VAL  40   3.839   7.189  16.822
  289   HG13  VAL  40          3HG1      VAL  40   4.903   8.309  15.975
  290   HG21  VAL  40          3HG2      VAL  40   5.748   6.685  19.156
  291   HG22  VAL  40          1HG2      VAL  40   6.690   5.366  18.463
  292   HG23  VAL  40          2HG2      VAL  40   4.933   5.363  18.317
  293    H    LYS  41           H        LYS  41   3.769   6.264  14.702
  294    HA   LYS  41           HA       LYS  41   2.101   4.431  16.021
  295    HB2  LYS  41           2HB      LYS  41   1.210   6.391  14.917
  296    HB3  LYS  41           1HB      LYS  41   1.785   5.825  13.357
  297    HG2  LYS  41           2HG      LYS  41  -0.629   5.527  13.641
  298    HG3  LYS  41           1HG      LYS  41   0.212   3.993  13.401
  299    HD2  LYS  41           2HD      LYS  41   0.151   3.583  15.807
  300    HD3  LYS  41           1HD      LYS  41  -0.666   5.127  16.056
  301    HE2  LYS  41           2HE      LYS  41  -2.594   4.374  14.863
  302    HE3  LYS  41           1HE      LYS  41  -1.762   2.908  14.339
  303    HZ1  LYS  41           3HZ      LYS  41  -3.279   2.489  16.187
  304    HZ2  LYS  41           1HZ      LYS  41  -2.426   3.588  17.159
  305    HZ3  LYS  41           2HZ      LYS  41  -1.675   2.166  16.619
  306    H    ASP  42           H        ASP  42   3.744   4.257  12.893
  307    HA   ASP  42           HA       ASP  42   2.539   1.800  12.127
  308    HB2  ASP  42           2HB      ASP  42   3.571   3.537  10.588
  309    HB3  ASP  42           1HB      ASP  42   5.140   2.893  11.061
  310    H    VAL  43           H        VAL  43   5.579   2.624  13.726
  311    HA   VAL  43           HA       VAL  43   6.690   0.015  13.636
  312    HB   VAL  43           HB       VAL  43   7.222   2.265  15.592
  313   HG11  VAL  43          1HG1      VAL  43   8.805  -0.254  15.084
  314   HG12  VAL  43          2HG1      VAL  43   7.900   0.127  16.549
  315   HG13  VAL  43          3HG1      VAL  43   9.311   1.088  16.110
  316   HG21  VAL  43          3HG2      VAL  43   9.227   2.639  14.216
  317   HG22  VAL  43          1HG2      VAL  43   7.738   2.857  13.298
  318   HG23  VAL  43          2HG2      VAL  43   8.683   1.380  13.107
  319    H    LEU  44           H        LEU  44   4.543   1.643  15.909
  320    HA   LEU  44           HA       LEU  44   4.625  -0.439  17.859
  321    HB2  LEU  44           2HB      LEU  44   2.598   1.756  17.433
  322    HB3  LEU  44           1HB      LEU  44   2.655   0.699  18.831
  323    HG   LEU  44           HG       LEU  44   4.808   2.651  18.029
  324   HD11  LEU  44          1HD1      LEU  44   2.811   2.735  20.287
  325   HD12  LEU  44          2HD1      LEU  44   2.813   3.769  18.859
  326   HD13  LEU  44          3HD1      LEU  44   4.127   3.883  20.031
  327   HD21  LEU  44          3HD2      LEU  44   5.818   2.096  20.186
  328   HD22  LEU  44          1HD2      LEU  44   5.721   0.681  19.137
  329   HD23  LEU  44          2HD2      LEU  44   4.570   0.880  20.458
  330    H    ASP  45           H        ASP  45   3.038  -0.085  14.877
  331    HA   ASP  45           HA       ASP  45   1.008  -2.087  15.521
  332    HB2  ASP  45           2HB      ASP  45   0.291  -0.185  14.164
  333    HB3  ASP  45           1HB      ASP  45   1.530  -0.549  12.965
  334    H    SER  46           H        SER  46   3.616  -1.572  13.165
  335    HA   SER  46           HA       SER  46   3.680  -4.435  12.599
  336    HB2  SER  46           2HB      SER  46   3.789  -2.862  10.700
  337    HB3  SER  46           1HB      SER  46   5.257  -2.152  11.371
  338    HG   SER  46           HG       SER  46   6.315  -4.095  11.038
  339    H    VAL  47           H        VAL  47   4.389  -4.953  14.755
  340    HA   VAL  47           HA       VAL  47   6.972  -4.017  15.642
  341    HB   VAL  47           HB       VAL  47   5.230  -6.187  16.832
  342   HG11  VAL  47          1HG1      VAL  47   6.499  -5.771  18.888
  343   HG12  VAL  47          2HG1      VAL  47   7.509  -4.609  18.026
  344   HG13  VAL  47          3HG1      VAL  47   7.547  -6.314  17.578
  345   HG21  VAL  47          3HG2      VAL  47   5.394  -3.258  17.540
  346   HG22  VAL  47          1HG2      VAL  47   4.448  -4.477  18.395
  347   HG23  VAL  47          2HG2      VAL  47   4.042  -4.052  16.733
  348    H    LEU  48           H        LEU  48   8.878  -5.042  15.426
  349    HA   LEU  48           HA       LEU  48   8.928  -7.554  13.946
  350    HB2  LEU  48           2HB      LEU  48  11.031  -5.508  14.609
  351    HB3  LEU  48           1HB      LEU  48  11.457  -7.089  13.988
  352    HG   LEU  48           HG       LEU  48  11.486  -5.560  12.166
  353   HD11  LEU  48          1HD1      LEU  48   9.845  -6.526  10.658
  354   HD12  LEU  48          2HD1      LEU  48   8.948  -7.175  12.031
  355   HD13  LEU  48          3HD1      LEU  48  10.575  -7.762  11.681
  356   HD21  LEU  48          3HD2      LEU  48   8.682  -4.771  12.937
  357   HD22  LEU  48          1HD2      LEU  48   9.547  -4.229  11.499
  358   HD23  LEU  48          2HD2      LEU  48  10.132  -3.779  13.100
  Start of MODEL    2
    1    H1   SER   1           1HT      SER   1  27.105   4.897  39.003
    2    H2   SER   1           2HT      SER   1  25.766   4.420  39.927
    3    H3   SER   1           3HT      SER   1  27.216   3.555  40.036
    4    HA   SER   1           HA       SER   1  26.784   6.356  40.885
    5    HB2  SER   1           2HB      SER   1  27.333   3.893  42.567
    6    HB3  SER   1           1HB      SER   1  26.979   5.519  43.153
    7    HG   SER   1           HG       SER   1  25.268   3.556  42.496
    8    H    SER   2           H        SER   2  28.591   7.259  39.987
    9    HA   SER   2           HA       SER   2  31.070   6.817  41.277
   10    HB2  SER   2           2HB      SER   2  31.014   4.870  39.665
   11    HB3  SER   2           1HB      SER   2  30.980   6.035  38.345
   12    HG   SER   2           HG       SER   2  33.083   5.108  39.711
   13    H    LEU   3           H        LEU   3  32.748   7.901  39.333
   14    HA   LEU   3           HA       LEU   3  31.574  10.562  38.964
   15    HB2  LEU   3           2HB      LEU   3  34.018  11.205  38.558
   16    HB3  LEU   3           1HB      LEU   3  33.534  10.812  40.193
   17    HG   LEU   3           HG       LEU   3  34.494   8.499  39.802
   18   HD11  LEU   3          1HD1      LEU   3  36.156   8.266  38.026
   19   HD12  LEU   3          2HD1      LEU   3  35.697   9.846  37.388
   20   HD13  LEU   3          3HD1      LEU   3  34.540   8.514  37.369
   21   HD21  LEU   3          3HD2      LEU   3  35.637  10.197  41.116
   22   HD22  LEU   3          1HD2      LEU   3  36.363  10.857  39.649
   23   HD23  LEU   3          2HD2      LEU   3  36.788   9.233  40.188
   24    H    LEU   4           H        LEU   4  31.481   7.968  37.269
   25    HA   LEU   4           HA       LEU   4  32.724   8.913  34.803
   26    HB2  LEU   4           2HB      LEU   4  32.862   6.509  35.697
   27    HB3  LEU   4           1HB      LEU   4  31.193   6.346  35.193
   28    HG   LEU   4           HG       LEU   4  33.402   7.096  33.276
   29   HD11  LEU   4          1HD1      LEU   4  33.383   4.740  32.581
   30   HD12  LEU   4          2HD1      LEU   4  32.302   4.365  33.923
   31   HD13  LEU   4          3HD1      LEU   4  33.937   4.940  34.245
   32   HD21  LEU   4          3HD2      LEU   4  31.148   7.631  32.512
   33   HD22  LEU   4          1HD2      LEU   4  30.629   5.978  32.853
   34   HD23  LEU   4          2HD2      LEU   4  31.816   6.285  31.586
   35    H    GLU   5           H        GLU   5  29.522   7.731  35.870
   36    HA   GLU   5           HA       GLU   5  28.344   8.560  33.365
   37    HB2  GLU   5           2HB      GLU   5  26.304   7.540  34.163
   38    HB3  GLU   5           1HB      GLU   5  27.647   6.456  34.477
   39    HG2  GLU   5           2HG      GLU   5  26.562   8.298  36.582
   40    HG3  GLU   5           1HG      GLU   5  25.870   6.708  36.278
   41    H    LYS   6           H        LYS   6  28.393   9.657  36.695
   42    HA   LYS   6           HA       LYS   6  26.646  11.900  35.934
   43    HB2  LYS   6           2HB      LYS   6  27.216  10.721  38.658
   44    HB3  LYS   6           1HB      LYS   6  26.229  12.149  38.375
   45    HG2  LYS   6           2HG      LYS   6  24.673  10.799  37.045
   46    HG3  LYS   6           1HG      LYS   6  25.658   9.371  37.365
   47    HD2  LYS   6           2HD      LYS   6  23.716   9.497  38.866
   48    HD3  LYS   6           1HD      LYS   6  25.242   9.585  39.747
   49    HE2  LYS   6           2HE      LYS   6  25.034  11.966  39.984
   50    HE3  LYS   6           1HE      LYS   6  23.607  11.989  38.951
   51    HZ1  LYS   6           3HZ      LYS   6  23.128  12.127  41.357
   52    HZ2  LYS   6           1HZ      LYS   6  23.753  10.564  41.551
   53    HZ3  LYS   6           2HZ      LYS   6  22.371  10.817  40.597
   54    H    GLY   7           H        GLY   7  29.825  11.083  36.571
   55    HA2  GLY   7           2HA      GLY   7  30.587  13.531  37.897
   56    HA3  GLY   7           1HA      GLY   7  31.679  12.294  37.286
   57    H    LEU   8           H        LEU   8  31.295  12.145  34.698
   58    HA   LEU   8           HA       LEU   8  32.164  14.724  33.737
   59    HB2  LEU   8           2HB      LEU   8  31.999  11.990  32.509
   60    HB3  LEU   8           1HB      LEU   8  32.265  13.398  31.504
   61    HG   LEU   8           HG       LEU   8  34.381  12.383  31.942
   62   HD11  LEU   8          1HD1      LEU   8  35.582  14.206  33.044
   63   HD12  LEU   8          2HD1      LEU   8  34.050  14.846  33.642
   64   HD13  LEU   8          3HD1      LEU   8  34.371  14.803  31.907
   65   HD21  LEU   8          3HD2      LEU   8  35.266  12.066  34.195
   66   HD22  LEU   8          1HD2      LEU   8  33.802  11.116  33.939
   67   HD23  LEU   8          2HD2      LEU   8  33.733  12.606  34.879
   68    H    ASP   9           H        ASP   9  30.698  16.202  33.274
   69    HA   ASP   9           HA       ASP   9  28.002  15.576  32.566
   70    HB2  ASP   9           2HB      ASP   9  28.662  17.670  33.743
   71    HB3  ASP   9           1HB      ASP   9  29.460  18.210  32.271
   72    H    GLY  10           H        GLY  10  30.896  15.671  30.854
   73    HA2  GLY  10           2HA      GLY  10  30.130  16.473  28.287
   74    HA3  GLY  10           1HA      GLY  10  31.399  15.310  28.643
   75    H    ALA  11           H        ALA  11  29.389  13.571  30.048
   76    HA   ALA  11           HA       ALA  11  28.624  11.954  27.845
   77    HB1  ALA  11           1HB      ALA  11  27.658  11.828  30.704
   78    HB2  ALA  11           2HB      ALA  11  29.105  11.040  30.073
   79    HB3  ALA  11           3HB      ALA  11  27.513  10.550  29.493
   80    H    LYS  12           H        LYS  12  27.126  14.555  29.535
   81    HA   LYS  12           HA       LYS  12  24.480  14.016  28.426
   82    HB2  LYS  12           2HB      LYS  12  25.360  16.440  29.997
   83    HB3  LYS  12           1HB      LYS  12  23.721  15.850  29.762
   84    HG2  LYS  12           2HG      LYS  12  25.861  14.421  31.327
   85    HG3  LYS  12           1HG      LYS  12  24.589  15.423  32.026
   86    HD2  LYS  12           2HD      LYS  12  22.898  13.917  31.104
   87    HD3  LYS  12           1HD      LYS  12  24.172  12.917  30.400
   88    HE2  LYS  12           2HE      LYS  12  23.341  11.971  32.504
   89    HE3  LYS  12           1HE      LYS  12  25.040  12.429  32.623
   90    HZ1  LYS  12           3HZ      LYS  12  24.387  14.459  33.757
   91    HZ2  LYS  12           1HZ      LYS  12  23.786  13.111  34.588
   92    HZ3  LYS  12           2HZ      LYS  12  22.748  14.041  33.624
   93    H    LYS  13           H        LYS  13  27.153  16.289  28.169
   94    HA   LYS  13           HA       LYS  13  25.978  18.029  26.280
   95    HB2  LYS  13           2HB      LYS  13  27.970  18.575  27.663
   96    HB3  LYS  13           1HB      LYS  13  28.917  17.445  26.709
   97    HG2  LYS  13           2HG      LYS  13  29.329  19.710  25.977
   98    HG3  LYS  13           1HG      LYS  13  28.495  18.812  24.703
   99    HD2  LYS  13           2HD      LYS  13  26.354  19.806  25.507
  100    HD3  LYS  13           1HD      LYS  13  27.290  20.796  26.630
  101    HE2  LYS  13           2HE      LYS  13  28.491  21.790  24.739
  102    HE3  LYS  13           1HE      LYS  13  27.544  20.806  23.625
  103    HZ1  LYS  13           3HZ      LYS  13  26.585  22.994  25.375
  104    HZ2  LYS  13           1HZ      LYS  13  25.531  21.915  24.601
  105    HZ3  LYS  13           2HZ      LYS  13  26.547  22.924  23.685
  106    H    ALA  14           H        ALA  14  27.391  14.903  25.996
  107    HA   ALA  14           HA       ALA  14  28.050  14.888  23.267
  108    HB1  ALA  14           1HB      ALA  14  27.052  12.622  24.986
  109    HB2  ALA  14           2HB      ALA  14  28.732  13.122  24.803
  110    HB3  ALA  14           3HB      ALA  14  27.858  12.452  23.424
  111    H    VAL  15           H        VAL  15  25.010  14.842  24.904
  112    HA   VAL  15           HA       VAL  15  23.564  14.152  22.459
  113    HB   VAL  15           HB       VAL  15  22.456  14.839  25.189
  114   HG11  VAL  15          1HG1      VAL  15  20.888  15.203  23.339
  115   HG12  VAL  15          2HG1      VAL  15  20.382  13.866  24.369
  116   HG13  VAL  15          3HG1      VAL  15  21.134  13.538  22.809
  117   HG21  VAL  15          3HG2      VAL  15  22.112  12.437  25.484
  118   HG22  VAL  15          1HG2      VAL  15  23.822  12.817  25.286
  119   HG23  VAL  15          2HG2      VAL  15  22.911  12.129  23.942
  120    H    GLY  16           H        GLY  16  23.674  16.757  24.882
  121    HA2  GLY  16           2HA      GLY  16  22.226  18.584  23.184
  122    HA3  GLY  16           1HA      GLY  16  22.938  18.950  24.747
  123    H    GLY  17           H        GLY  17  24.583  17.612  21.939
  124    HA2  GLY  17           2HA      GLY  17  26.144  20.116  21.762
  125    HA3  GLY  17           1HA      GLY  17  26.846  18.521  21.522
  126    H    LEU  18           H        LEU  18  25.063  17.287  19.899
  127    HA   LEU  18           HA       LEU  18  25.227  18.906  17.464
  128    HB2  LEU  18           2HB      LEU  18  25.183  16.896  16.207
  129    HB3  LEU  18           1HB      LEU  18  26.311  16.643  17.521
  130    HG   LEU  18           HG       LEU  18  23.466  15.639  17.572
  131   HD11  LEU  18          1HD1      LEU  18  24.649  14.619  15.705
  132   HD12  LEU  18          2HD1      LEU  18  24.385  13.449  16.997
  133   HD13  LEU  18          3HD1      LEU  18  25.978  14.173  16.775
  134   HD21  LEU  18          3HD2      LEU  18  25.894  14.934  19.215
  135   HD22  LEU  18          1HD2      LEU  18  24.319  14.148  19.323
  136   HD23  LEU  18          2HD2      LEU  18  24.490  15.848  19.764
  137    H    GLY  19           H        GLY  19  23.046  18.101  19.798
  138    HA2  GLY  19           2HA      GLY  19  20.725  17.429  18.342
  139    HA3  GLY  19           1HA      GLY  19  20.761  18.121  19.959
  140    H    LYS  20           H        LYS  20  21.799  20.562  19.646
  141    HA   LYS  20           HA       LYS  20  19.658  22.042  18.624
  142    HB2  LYS  20           2HB      LYS  20  21.334  24.017  18.836
  143    HB3  LYS  20           1HB      LYS  20  20.790  23.183  20.278
  144    HG2  LYS  20           2HG      LYS  20  23.046  23.427  20.661
  145    HG3  LYS  20           1HG      LYS  20  22.956  21.795  20.011
  146    HD2  LYS  20           2HD      LYS  20  24.815  22.956  19.013
  147    HD3  LYS  20           1HD      LYS  20  23.574  22.681  17.789
  148    HE2  LYS  20           2HE      LYS  20  22.792  24.990  18.090
  149    HE3  LYS  20           1HE      LYS  20  24.052  25.254  19.294
  150    HZ1  LYS  20           3HZ      LYS  20  24.648  26.099  17.077
  151    HZ2  LYS  20           1HZ      LYS  20  24.556  24.522  16.458
  152    HZ3  LYS  20           2HZ      LYS  20  25.725  24.904  17.622
  153    H    LEU  21           H        LEU  21  19.088  22.528  16.672
  154    HA   LEU  21           HA       LEU  21  19.111  23.093  14.484
  155    HB2  LEU  21           2HB      LEU  21  22.094  23.368  14.828
  156    HB3  LEU  21           1HB      LEU  21  21.213  23.798  13.375
  157    HG   LEU  21           HG       LEU  21  20.875  25.087  16.086
  158   HD11  LEU  21          1HD1      LEU  21  22.976  25.700  15.049
  159   HD12  LEU  21          2HD1      LEU  21  21.851  27.059  14.995
  160   HD13  LEU  21          3HD1      LEU  21  22.146  26.096  13.545
  161   HD21  LEU  21          3HD2      LEU  21  19.427  26.677  14.927
  162   HD22  LEU  21          1HD2      LEU  21  18.779  25.039  14.836
  163   HD23  LEU  21          2HD2      LEU  21  19.588  25.746  13.437
  164    H    GLY  22           H        GLY  22  21.292  20.618  15.592
  165    HA2  GLY  22           2HA      GLY  22  21.744  19.331  13.113
  166    HA3  GLY  22           1HA      GLY  22  21.905  18.596  14.701
  167    H    LYS  23           H        LYS  23  19.302  18.782  15.650
  168    HA   LYS  23           HA       LYS  23  17.975  16.879  13.873
  169    HB2  LYS  23           2HB      LYS  23  16.511  16.361  15.758
  170    HB3  LYS  23           1HB      LYS  23  18.196  16.215  16.216
  171    HG2  LYS  23           2HG      LYS  23  17.182  17.225  18.048
  172    HG3  LYS  23           1HG      LYS  23  17.952  18.563  17.200
  173    HD2  LYS  23           2HD      LYS  23  15.842  19.231  16.242
  174    HD3  LYS  23           1HD      LYS  23  15.044  17.808  16.909
  175    HE2  LYS  23           2HE      LYS  23  15.340  18.610  19.142
  176    HE3  LYS  23           1HE      LYS  23  16.355  19.940  18.583
  177    HZ1  LYS  23           3HZ      LYS  23  13.965  20.492  19.116
  178    HZ2  LYS  23           1HZ      LYS  23  13.531  19.631  17.721
  179    HZ3  LYS  23           2HZ      LYS  23  14.527  21.004  17.599
  180    H    ASP  24           H        ASP  24  17.908  20.154  14.587
  181    HA   ASP  24           HA       ASP  24  15.097  20.594  14.490
  182    HB2  ASP  24           2HB      ASP  24  17.460  22.455  14.331
  183    HB3  ASP  24           1HB      ASP  24  15.802  23.032  14.182
  184    H    ALA  25           H        ALA  25  17.142  19.661  12.101
  185    HA   ALA  25           HA       ALA  25  16.181  21.227   9.926
  186    HB1  ALA  25           1HB      ALA  25  17.184  19.502   8.514
  187    HB2  ALA  25           2HB      ALA  25  17.417  18.476   9.929
  188    HB3  ALA  25           3HB      ALA  25  18.287  20.005   9.796
  189    H    VAL  26           H        VAL  26  15.174  18.204  11.453
  190    HA   VAL  26           HA       VAL  26  13.199  17.669   9.411
  191    HB   VAL  26           HB       VAL  26  14.424  15.860  10.663
  192   HG11  VAL  26          1HG1      VAL  26  13.570  15.192  12.859
  193   HG12  VAL  26          2HG1      VAL  26  12.559  16.637  12.899
  194   HG13  VAL  26          3HG1      VAL  26  14.316  16.788  12.903
  195   HG21  VAL  26          3HG2      VAL  26  12.504  14.366  10.812
  196   HG22  VAL  26          1HG2      VAL  26  12.413  15.377   9.372
  197   HG23  VAL  26          2HG2      VAL  26  11.413  15.752  10.776
  198    H    GLU  27           H        GLU  27  13.378  19.482  12.278
  199    HA   GLU  27           HA       GLU  27  10.685  19.356  13.149
  200    HB2  GLU  27           2HB      GLU  27  12.663  21.613  13.500
  201    HB3  GLU  27           1HB      GLU  27  11.239  21.308  14.484
  202    HG2  GLU  27           2HG      GLU  27  13.551  19.395  14.267
  203    HG3  GLU  27           1HG      GLU  27  13.430  20.645  15.501
  204    H    ASP  28           H        ASP  28  12.108  20.715  10.432
  205    HA   ASP  28           HA       ASP  28  10.281  22.916  10.083
  206    HB2  ASP  28           2HB      ASP  28  12.547  23.045   9.162
  207    HB3  ASP  28           1HB      ASP  28  12.246  21.620   8.177
  208    H    LEU  29           H        LEU  29  10.407  19.552   9.275
  209    HA   LEU  29           HA       LEU  29   8.207  19.851   7.355
  210    HB2  LEU  29           2HB      LEU  29  10.199  18.628   6.586
  211    HB3  LEU  29           1HB      LEU  29  10.001  17.483   7.900
  212    HG   LEU  29           HG       LEU  29   7.821  16.791   6.927
  213   HD11  LEU  29          1HD1      LEU  29   7.303  17.464   4.622
  214   HD12  LEU  29          2HD1      LEU  29   8.641  18.610   4.667
  215   HD13  LEU  29          3HD1      LEU  29   7.259  18.829   5.740
  216   HD21  LEU  29          3HD2      LEU  29   9.854  15.541   6.445
  217   HD22  LEU  29          1HD2      LEU  29  10.190  16.592   5.073
  218   HD23  LEU  29          2HD2      LEU  29   8.770  15.545   5.053
  219    H    GLU  30           H        GLU  30   9.134  18.190  10.335
  220    HA   GLU  30           HA       GLU  30   6.666  16.718  10.448
  221    HB2  GLU  30           2HB      GLU  30   8.915  17.043  12.423
  222    HB3  GLU  30           1HB      GLU  30   7.491  16.058  12.732
  223    HG2  GLU  30           2HG      GLU  30   9.554  15.667  10.584
  224    HG3  GLU  30           1HG      GLU  30   9.242  14.631  11.977
  225    H    SER  31           H        SER  31   7.061  19.852  10.756
  226    HA   SER  31           HA       SER  31   5.723  20.463  13.182
  227    HB2  SER  31           2HB      SER  31   5.264  22.663  11.941
  228    HB3  SER  31           1HB      SER  31   6.956  22.217  12.178
  229    HG   SER  31           HG       SER  31   6.696  22.824  10.049
  230    H    VAL  32           H        VAL  32   4.694  19.614   9.950
  231    HA   VAL  32           HA       VAL  32   1.892  20.076  10.634
  232    HB   VAL  32           HB       VAL  32   1.398  19.533   8.299
  233   HG11  VAL  32          1HG1      VAL  32   1.949  21.833   8.866
  234   HG12  VAL  32          2HG1      VAL  32   2.530  21.438   7.249
  235   HG13  VAL  32          3HG1      VAL  32   3.661  21.504   8.600
  236   HG21  VAL  32          3HG2      VAL  32   4.370  19.118   8.000
  237   HG22  VAL  32          1HG2      VAL  32   3.190  19.120   6.691
  238   HG23  VAL  32          2HG2      VAL  32   3.139  17.861   7.922
  239    H    GLY  33           H        GLY  33   4.144  17.624  10.869
  240    HA2  GLY  33           2HA      GLY  33   3.827  15.451  11.643
  241    HA3  GLY  33           1HA      GLY  33   2.094  15.656  11.415
  242    H    LYS  34           H        LYS  34   5.137  15.076   9.720
  243    HA   LYS  34           HA       LYS  34   3.633  14.231   7.348
  244    HB2  LYS  34           2HB      LYS  34   5.476  15.875   7.073
  245    HB3  LYS  34           1HB      LYS  34   6.603  14.681   7.699
  246    HG2  LYS  34           2HG      LYS  34   6.793  14.732   5.325
  247    HG3  LYS  34           1HG      LYS  34   6.031  13.209   5.788
  248    HD2  LYS  34           2HD      LYS  34   4.108  15.343   5.294
  249    HD3  LYS  34           1HD      LYS  34   5.103  14.977   3.885
  250    HE2  LYS  34           2HE      LYS  34   3.480  12.998   5.479
  251    HE3  LYS  34           1HE      LYS  34   3.059  13.649   3.895
  252    HZ1  LYS  34           3HZ      LYS  34   5.254  12.676   3.130
  253    HZ2  LYS  34           1HZ      LYS  34   4.020  11.567   3.480
  254    HZ3  LYS  34           2HZ      LYS  34   5.276  11.814   4.589
  255    H    GLY  35           H        GLY  35   6.604  13.141   8.998
  256    HA2  GLY  35           2HA      GLY  35   5.754  10.368   8.438
  257    HA3  GLY  35           1HA      GLY  35   7.417  10.891   8.655
  258    H    ALA  36           H        ALA  36   6.542  12.603  10.983
  259    HA   ALA  36           HA       ALA  36   7.279  10.791  12.997
  260    HB1  ALA  36           1HB      ALA  36   5.862  13.434  13.321
  261    HB2  ALA  36           2HB      ALA  36   7.606  13.218  13.169
  262    HB3  ALA  36           3HB      ALA  36   6.755  12.568  14.572
  263    H    VAL  37           H        VAL  37   4.093  12.178  12.235
  264    HA   VAL  37           HA       VAL  37   2.651  10.962  14.292
  265    HB   VAL  37           HB       VAL  37   1.778  12.816  12.941
  266   HG11  VAL  37          1HG1      VAL  37   1.485  10.767  10.753
  267   HG12  VAL  37          2HG1      VAL  37   2.572  12.160  10.754
  268   HG13  VAL  37          3HG1      VAL  37   0.823  12.400  10.719
  269   HG21  VAL  37          3HG2      VAL  37   0.023  10.367  12.867
  270   HG22  VAL  37          1HG2      VAL  37  -0.533  12.032  12.716
  271   HG23  VAL  37          2HG2      VAL  37   0.206  11.483  14.221
  272    H    HIS  38           H        HIS  38   3.913   9.611  11.391
  273    HA   HIS  38           HA       HIS  38   2.208   7.247  11.575
  274    HB2  HIS  38           2HB      HIS  38   4.300   8.102   9.578
  275    HB3  HIS  38           1HB      HIS  38   3.575   6.500   9.561
  276    HD1  HIS  38           1HD      HIS  38   0.930   6.447   9.148
  277    HD2  HIS  38           2HD      HIS  38   2.847  10.044   8.317
  278    HE1  HIS  38           1HE      HIS  38  -0.662   7.745   7.695
  279    HE2  HIS  38           2HE      HIS  38   0.603   9.825   7.042
  280    H    ASP  39           H        ASP  39   5.653   8.082  11.625
  281    HA   ASP  39           HA       ASP  39   6.680   5.529  11.967
  282    HB2  ASP  39           2HB      ASP  39   7.954   7.635  11.437
  283    HB3  ASP  39           1HB      ASP  39   7.865   8.044  13.148
  284    H    VAL  40           H        VAL  40   5.524   7.806  14.404
  285    HA   VAL  40           HA       VAL  40   6.549   6.462  16.649
  286    HB   VAL  40           HB       VAL  40   4.954   7.752  17.985
  287   HG11  VAL  40          1HG1      VAL  40   5.695   9.995  17.293
  288   HG12  VAL  40          2HG1      VAL  40   6.278   9.313  15.776
  289   HG13  VAL  40          3HG1      VAL  40   7.008   8.818  17.303
  290   HG21  VAL  40          3HG2      VAL  40   3.812   8.596  15.323
  291   HG22  VAL  40          1HG2      VAL  40   3.412   9.327  16.876
  292   HG23  VAL  40          2HG2      VAL  40   2.998   7.642  16.562
  293    H    LYS  41           H        LYS  41   3.677   5.850  14.743
  294    HA   LYS  41           HA       LYS  41   2.756   3.946  16.770
  295    HB2  LYS  41           2HB      LYS  41   0.711   3.713  15.416
  296    HB3  LYS  41           1HB      LYS  41   0.996   5.376  15.905
  297    HG2  LYS  41           2HG      LYS  41   1.578   6.033  13.741
  298    HG3  LYS  41           1HG      LYS  41   1.849   4.374  13.211
  299    HD2  LYS  41           2HD      LYS  41  -0.857   5.372  14.069
  300    HD3  LYS  41           1HD      LYS  41  -0.283   5.506  12.406
  301    HE2  LYS  41           2HE      LYS  41  -0.359   2.895  13.905
  302    HE3  LYS  41           1HE      LYS  41  -1.716   3.482  12.947
  303    HZ1  LYS  41           3HZ      LYS  41   1.017   3.112  11.830
  304    HZ2  LYS  41           1HZ      LYS  41  -0.422   3.382  10.979
  305    HZ3  LYS  41           2HZ      LYS  41  -0.178   1.907  11.778
  306    H    ASP  42           H        ASP  42   3.997   4.131  13.502
  307    HA   ASP  42           HA       ASP  42   3.247   1.590  12.620
  308    HB2  ASP  42           2HB      ASP  42   5.547   3.336  11.756
  309    HB3  ASP  42           1HB      ASP  42   5.058   1.866  10.917
  310    H    VAL  43           H        VAL  43   5.932   2.546  14.617
  311    HA   VAL  43           HA       VAL  43   7.545   0.276  14.361
  312    HB   VAL  43           HB       VAL  43   7.048   1.955  16.834
  313   HG11  VAL  43          1HG1      VAL  43   8.033  -0.181  17.443
  314   HG12  VAL  43          2HG1      VAL  43   9.225   1.109  17.607
  315   HG13  VAL  43          3HG1      VAL  43   9.285   0.023  16.219
  316   HG21  VAL  43          3HG2      VAL  43   9.116   3.094  16.184
  317   HG22  VAL  43          1HG2      VAL  43   7.869   3.258  14.952
  318   HG23  VAL  43          2HG2      VAL  43   9.195   2.118  14.717
  319    H    LEU  44           H        LEU  44   4.806   0.881  16.547
  320    HA   LEU  44           HA       LEU  44   4.933  -1.859  17.524
  321    HB2  LEU  44           2HB      LEU  44   3.082   0.415  18.234
  322    HB3  LEU  44           1HB      LEU  44   3.088  -1.155  19.014
  323    HG   LEU  44           HG       LEU  44   5.362   0.832  19.055
  324   HD11  LEU  44          1HD1      LEU  44   3.409  -0.008  21.194
  325   HD12  LEU  44          2HD1      LEU  44   3.477   1.565  20.398
  326   HD13  LEU  44          3HD1      LEU  44   4.804   1.041  21.435
  327   HD21  LEU  44          3HD2      LEU  44   5.057  -1.831  20.439
  328   HD22  LEU  44          1HD2      LEU  44   6.379  -0.691  20.675
  329   HD23  LEU  44          2HD2      LEU  44   6.161  -1.473  19.110
  330    H    ASP  45           H        ASP  45   3.043   0.126  15.389
  331    HA   ASP  45           HA       ASP  45   0.787  -1.594  15.183
  332    HB2  ASP  45           2HB      ASP  45   0.694   0.799  14.639
  333    HB3  ASP  45           1HB      ASP  45   1.791   0.541  13.290
  334    H    SER  46           H        SER  46   3.870  -1.405  13.593
  335    HA   SER  46           HA       SER  46   5.024  -2.910  12.370
  336    HB2  SER  46           2HB      SER  46   4.179  -4.587  13.939
  337    HB3  SER  46           1HB      SER  46   2.704  -4.760  12.989
  338    HG   SER  46           HG       SER  46   4.249  -5.305  11.208
  339    H    VAL  47           H        VAL  47   2.911  -1.133  11.150
  340    HA   VAL  47           HA       VAL  47   2.004  -2.651   8.874
  341    HB   VAL  47           HB       VAL  47   0.589  -0.842   9.691
  342   HG11  VAL  47          1HG1      VAL  47   2.264   0.688  10.531
  343   HG12  VAL  47          2HG1      VAL  47   1.220   1.510   9.368
  344   HG13  VAL  47          3HG1      VAL  47   2.839   0.994   8.891
  345   HG21  VAL  47          3HG2      VAL  47   0.407  -1.439   7.355
  346   HG22  VAL  47          1HG2      VAL  47   1.699  -0.309   6.942
  347   HG23  VAL  47          2HG2      VAL  47   0.160   0.298   7.560
  348    H    LEU  48           H        LEU  48   3.139  -3.060   7.144
  349    HA   LEU  48           HA       LEU  48   5.243  -1.193   6.333
  350    HB2  LEU  48           2HB      LEU  48   6.608  -3.187   5.616
  351    HB3  LEU  48           1HB      LEU  48   6.481  -2.929   7.343
  352    HG   LEU  48           HG       LEU  48   4.450  -4.682   6.974
  353   HD11  LEU  48          1HD1      LEU  48   4.925  -4.956   4.596
  354   HD12  LEU  48          2HD1      LEU  48   5.219  -6.451   5.483
  355   HD13  LEU  48          3HD1      LEU  48   6.575  -5.444   4.976
  356   HD21  LEU  48          3HD2      LEU  48   6.006  -6.390   7.802
  357   HD22  LEU  48          1HD2      LEU  48   6.192  -4.853   8.650
  358   HD23  LEU  48          2HD2      LEU  48   7.361  -5.327   7.417
  Start of MODEL    3
    1    H1   SER   1           1HT      SER   1  29.089   6.365   8.309
    2    H2   SER   1           2HT      SER   1  28.627   7.366   9.596
    3    H3   SER   1           3HT      SER   1  29.038   8.048   8.101
    4    HA   SER   1           HA       SER   1  26.719   6.284   8.608
    5    HB2  SER   1           2HB      SER   1  26.497   8.534   9.626
    6    HB3  SER   1           1HB      SER   1  26.849   9.266   8.061
    7    HG   SER   1           HG       SER   1  24.668   9.235   8.181
    8    H    SER   2           H        SER   2  25.529   5.739   6.793
    9    HA   SER   2           HA       SER   2  26.874   6.188   4.234
   10    HB2  SER   2           2HB      SER   2  26.308   3.878   4.737
   11    HB3  SER   2           1HB      SER   2  24.621   4.316   5.007
   12    HG   SER   2           HG       SER   2  25.794   3.627   2.724
   13    H    LEU   3           H        LEU   3  26.229   7.793   2.976
   14    HA   LEU   3           HA       LEU   3  23.623   9.001   3.418
   15    HB2  LEU   3           2HB      LEU   3  24.379  10.711   1.798
   16    HB3  LEU   3           1HB      LEU   3  25.452  10.532   3.169
   17    HG   LEU   3           HG       LEU   3  26.826   9.000   1.568
   18   HD11  LEU   3          1HD1      LEU   3  26.686   9.653  -0.771
   19   HD12  LEU   3          2HD1      LEU   3  25.291  10.673  -0.415
   20   HD13  LEU   3          3HD1      LEU   3  25.176   8.922  -0.228
   21   HD21  LEU   3          3HD2      LEU   3  27.597  11.122   2.481
   22   HD22  LEU   3          1HD2      LEU   3  26.720  11.991   1.222
   23   HD23  LEU   3          2HD2      LEU   3  28.078  10.950   0.791
   24    H    LEU   4           H        LEU   4  24.807   6.483   1.666
   25    HA   LEU   4           HA       LEU   4  23.222   6.795  -0.703
   26    HB2  LEU   4           2HB      LEU   4  24.899   4.642   0.468
   27    HB3  LEU   4           1HB      LEU   4  23.656   4.155  -0.667
   28    HG   LEU   4           HG       LEU   4  25.750   4.404  -1.832
   29   HD11  LEU   4          1HD1      LEU   4  25.117   6.015  -3.551
   30   HD12  LEU   4          2HD1      LEU   4  23.912   6.707  -2.467
   31   HD13  LEU   4          3HD1      LEU   4  23.734   5.049  -3.039
   32   HD21  LEU   4          3HD2      LEU   4  25.787   7.240  -0.816
   33   HD22  LEU   4          1HD2      LEU   4  26.929   6.535  -1.959
   34   HD23  LEU   4          2HD2      LEU   4  26.859   5.939  -0.300
   35    H    GLU   5           H        GLU   5  22.983   4.553   2.063
   36    HA   GLU   5           HA       GLU   5  20.389   3.678   1.273
   37    HB2  GLU   5           2HB      GLU   5  20.413   2.451   3.444
   38    HB3  GLU   5           1HB      GLU   5  21.813   2.134   2.428
   39    HG2  GLU   5           2HG      GLU   5  23.150   3.654   3.775
   40    HG3  GLU   5           1HG      GLU   5  21.745   4.021   4.778
   41    H    LYS   6           H        LYS   6  21.574   5.970   3.691
   42    HA   LYS   6           HA       LYS   6  18.859   6.309   4.712
   43    HB2  LYS   6           2HB      LYS   6  21.455   7.460   5.742
   44    HB3  LYS   6           1HB      LYS   6  19.893   7.529   6.549
   45    HG2  LYS   6           2HG      LYS   6  19.880   5.091   6.729
   46    HG3  LYS   6           1HG      LYS   6  21.452   5.030   5.928
   47    HD2  LYS   6           2HD      LYS   6  22.388   6.397   7.766
   48    HD3  LYS   6           1HD      LYS   6  20.820   6.329   8.576
   49    HE2  LYS   6           2HE      LYS   6  22.589   3.987   7.889
   50    HE3  LYS   6           1HE      LYS   6  22.325   4.659   9.496
   51    HZ1  LYS   6           3HZ      LYS   6  20.300   3.331   7.782
   52    HZ2  LYS   6           1HZ      LYS   6  19.955   4.083   9.261
   53    HZ3  LYS   6           2HZ      LYS   6  20.968   2.722   9.213
   54    H    GLY   7           H        GLY   7  21.117   7.878   2.677
   55    HA2  GLY   7           2HA      GLY   7  19.707  10.434   2.931
   56    HA3  GLY   7           1HA      GLY   7  21.253  10.190   2.128
   57    H    LEU   8           H        LEU   8  21.200   8.866   0.139
   58    HA   LEU   8           HA       LEU   8  19.440  10.068  -1.690
   59    HB2  LEU   8           2HB      LEU   8  21.797   9.060  -2.030
   60    HB3  LEU   8           1HB      LEU   8  20.961   7.537  -2.252
   61    HG   LEU   8           HG       LEU   8  21.597   8.734  -4.364
   62   HD11  LEU   8          1HD1      LEU   8  19.482   8.338  -5.513
   63   HD12  LEU   8          2HD1      LEU   8  18.650   8.253  -3.959
   64   HD13  LEU   8          3HD1      LEU   8  19.856   7.037  -4.382
   65   HD21  LEU   8          3HD2      LEU   8  19.462  10.659  -3.467
   66   HD22  LEU   8          1HD2      LEU   8  20.207  10.627  -5.066
   67   HD23  LEU   8          2HD2      LEU   8  21.182  11.006  -3.645
   68    H    ASP   9           H        ASP   9  19.652   6.634  -0.734
   69    HA   ASP   9           HA       ASP   9  17.415   5.793  -2.195
   70    HB2  ASP   9           2HB      ASP   9  19.171   4.292  -1.259
   71    HB3  ASP   9           1HB      ASP   9  18.501   4.562   0.345
   72    H    GLY  10           H        GLY  10  17.711   6.862   1.156
   73    HA2  GLY  10           2HA      GLY  10  15.032   6.429   1.918
   74    HA3  GLY  10           1HA      GLY  10  16.145   7.559   2.678
   75    H    ALA  11           H        ALA  11  16.639   9.172   0.394
   76    HA   ALA  11           HA       ALA  11  14.461  10.969   0.531
   77    HB1  ALA  11           1HB      ALA  11  15.678  12.269  -1.141
   78    HB2  ALA  11           2HB      ALA  11  16.760  10.904  -1.424
   79    HB3  ALA  11           3HB      ALA  11  16.753  11.717   0.142
   80    H    LYS  12           H        LYS  12  15.191   8.315  -1.556
   81    HA   LYS  12           HA       LYS  12  13.309   9.136  -3.604
   82    HB2  LYS  12           2HB      LYS  12  14.581   6.415  -3.291
   83    HB3  LYS  12           1HB      LYS  12  13.876   7.107  -4.743
   84    HG2  LYS  12           2HG      LYS  12  16.412   7.993  -3.383
   85    HG3  LYS  12           1HG      LYS  12  16.280   7.107  -4.901
   86    HD2  LYS  12           2HD      LYS  12  15.147   9.862  -4.444
   87    HD3  LYS  12           1HD      LYS  12  16.727   9.549  -5.162
   88    HE2  LYS  12           2HE      LYS  12  15.638   8.280  -6.960
   89    HE3  LYS  12           1HE      LYS  12  14.065   8.632  -6.243
   90    HZ1  LYS  12           3HZ      LYS  12  15.988  10.666  -7.232
   91    HZ2  LYS  12           1HZ      LYS  12  14.453  10.976  -6.590
   92    HZ3  LYS  12           2HZ      LYS  12  14.609  10.145  -8.065
   93    H    LYS  13           H        LYS  13  13.236   7.561  -0.623
   94    HA   LYS  13           HA       LYS  13  11.884   6.074   0.435
   95    HB2  LYS  13           2HB      LYS  13   9.489   6.797   0.495
   96    HB3  LYS  13           1HB      LYS  13  10.660   8.044   0.879
   97    HG2  LYS  13           2HG      LYS  13   9.788   7.921  -1.934
   98    HG3  LYS  13           1HG      LYS  13   8.564   8.399  -0.759
   99    HD2  LYS  13           2HD      LYS  13  11.285   9.676  -1.060
  100    HD3  LYS  13           1HD      LYS  13   9.777  10.333  -1.701
  101    HE2  LYS  13           2HE      LYS  13   8.879  10.443   0.587
  102    HE3  LYS  13           1HE      LYS  13  10.413   9.836   1.206
  103    HZ1  LYS  13           3HZ      LYS  13  10.137  12.345  -0.359
  104    HZ2  LYS  13           1HZ      LYS  13  11.519  11.795   0.458
  105    HZ3  LYS  13           2HZ      LYS  13  10.156  12.285   1.338
  106    H    ALA  14           H        ALA  14  12.661   4.989  -2.000
  107    HA   ALA  14           HA       ALA  14  10.439   3.864  -3.390
  108    HB1  ALA  14           1HB      ALA  14  12.636   4.131  -4.446
  109    HB2  ALA  14           2HB      ALA  14  12.100   2.450  -4.485
  110    HB3  ALA  14           3HB      ALA  14  13.318   2.960  -3.317
  111    H    VAL  15           H        VAL  15  12.711   2.649  -0.949
  112    HA   VAL  15           HA       VAL  15  10.781   0.491  -0.377
  113    HB   VAL  15           HB       VAL  15  12.618  -0.892   0.423
  114   HG11  VAL  15          1HG1      VAL  15  11.989  -1.091  -1.910
  115   HG12  VAL  15          2HG1      VAL  15  13.725  -1.338  -1.718
  116   HG13  VAL  15          3HG1      VAL  15  13.117   0.194  -2.344
  117   HG21  VAL  15          3HG2      VAL  15  14.421   1.361  -0.454
  118   HG22  VAL  15          1HG2      VAL  15  14.952  -0.231   0.096
  119   HG23  VAL  15          2HG2      VAL  15  14.116   0.855   1.208
  120    H    GLY  16           H        GLY  16  12.484   3.202   0.791
  121    HA2  GLY  16           2HA      GLY  16  12.125   2.488   3.597
  122    HA3  GLY  16           1HA      GLY  16  12.926   3.925   2.979
  123    H    GLY  17           H        GLY  17   9.679   2.642   2.327
  124    HA2  GLY  17           2HA      GLY  17   8.585   5.269   3.040
  125    HA3  GLY  17           1HA      GLY  17   7.754   4.023   2.116
  126    H    LEU  18           H        LEU  18   9.454   3.080   4.925
  127    HA   LEU  18           HA       LEU  18   7.217   3.283   6.726
  128    HB2  LEU  18           2HB      LEU  18   7.339   0.734   7.137
  129    HB3  LEU  18           1HB      LEU  18   6.407   1.322   5.778
  130    HG   LEU  18           HG       LEU  18   8.463   0.819   4.340
  131   HD11  LEU  18          1HD1      LEU  18   9.982  -0.889   5.199
  132   HD12  LEU  18          2HD1      LEU  18   9.220  -0.772   6.785
  133   HD13  LEU  18          3HD1      LEU  18  10.101   0.606   6.128
  134   HD21  LEU  18          3HD2      LEU  18   7.861  -1.536   4.138
  135   HD22  LEU  18          1HD2      LEU  18   6.430  -0.521   4.306
  136   HD23  LEU  18          2HD2      LEU  18   7.012  -1.457   5.683
  137    H    GLY  19           H        GLY  19   8.116   1.373   8.608
  138    HA2  GLY  19           2HA      GLY  19  10.319   2.707   9.790
  139    HA3  GLY  19           1HA      GLY  19   9.638   1.174  10.317
  140    H    LYS  20           H        LYS  20  11.873   2.685   8.088
  141    HA   LYS  20           HA       LYS  20  13.309   0.130   7.830
  142    HB2  LYS  20           2HB      LYS  20  11.943   0.834   5.801
  143    HB3  LYS  20           1HB      LYS  20  13.035   2.196   5.644
  144    HG2  LYS  20           2HG      LYS  20  13.716   0.519   4.113
  145    HG3  LYS  20           1HG      LYS  20  14.910   0.587   5.405
  146    HD2  LYS  20           2HD      LYS  20  12.659  -1.385   5.526
  147    HD3  LYS  20           1HD      LYS  20  14.081  -1.719   4.540
  148    HE2  LYS  20           2HE      LYS  20  15.490  -1.370   6.555
  149    HE3  LYS  20           1HE      LYS  20  14.019  -1.195   7.510
  150    HZ1  LYS  20           3HZ      LYS  20  14.926  -3.435   7.637
  151    HZ2  LYS  20           1HZ      LYS  20  14.789  -3.610   5.957
  152    HZ3  LYS  20           2HZ      LYS  20  13.393  -3.447   6.911
  153    H    LEU  21           H        LEU  21  15.635   0.560   7.043
  154    HA   LEU  21           HA       LEU  21  16.684   2.402   9.013
  155    HB2  LEU  21           2HB      LEU  21  18.034   0.291   7.340
  156    HB3  LEU  21           1HB      LEU  21  18.826   1.247   8.581
  157    HG   LEU  21           HG       LEU  21  16.575  -0.718   9.025
  158   HD11  LEU  21          1HD1      LEU  21  19.491  -0.820   9.776
  159   HD12  LEU  21          2HD1      LEU  21  18.692  -1.807   8.551
  160   HD13  LEU  21          3HD1      LEU  21  18.265  -1.994  10.254
  161   HD21  LEU  21          3HD2      LEU  21  18.115   0.953  11.008
  162   HD22  LEU  21          1HD2      LEU  21  16.923  -0.285  11.404
  163   HD23  LEU  21          2HD2      LEU  21  16.426   1.178  10.554
  164    H    GLY  22           H        GLY  22  15.596   3.336   6.406
  165    HA2  GLY  22           2HA      GLY  22  17.989   4.839   5.555
  166    HA3  GLY  22           1HA      GLY  22  16.524   4.660   4.592
  167    H    LYS  23           H        LYS  23  15.549   4.983   7.672
  168    HA   LYS  23           HA       LYS  23  14.946   7.833   7.279
  169    HB2  LYS  23           2HB      LYS  23  13.497   5.578   8.640
  170    HB3  LYS  23           1HB      LYS  23  13.110   7.252   9.010
  171    HG2  LYS  23           2HG      LYS  23  13.171   6.483   6.155
  172    HG3  LYS  23           1HG      LYS  23  11.838   5.867   7.137
  173    HD2  LYS  23           2HD      LYS  23  12.643   8.772   6.961
  174    HD3  LYS  23           1HD      LYS  23  11.333   8.038   6.029
  175    HE2  LYS  23           2HE      LYS  23  10.186   7.436   8.087
  176    HE3  LYS  23           1HE      LYS  23  11.507   8.100   9.044
  177    HZ1  LYS  23           3HZ      LYS  23  11.003  10.288   8.222
  178    HZ2  LYS  23           1HZ      LYS  23   9.597   9.598   8.880
  179    HZ3  LYS  23           2HZ      LYS  23   9.797   9.679   7.199
  180    H    ASP  24           H        ASP  24  16.575   5.617   9.336
  181    HA   ASP  24           HA       ASP  24  16.149   6.968  11.812
  182    HB2  ASP  24           2HB      ASP  24  17.718   5.361  12.739
  183    HB3  ASP  24           1HB      ASP  24  16.582   4.547  11.668
  184    H    ALA  25           H        ALA  25  17.781   8.153   9.345
  185    HA   ALA  25           HA       ALA  25  19.989   9.180  10.990
  186    HB1  ALA  25           1HB      ALA  25  19.670   9.252   7.993
  187    HB2  ALA  25           2HB      ALA  25  20.676   8.123   8.900
  188    HB3  ALA  25           3HB      ALA  25  21.058   9.844   8.905
  189    H    VAL  26           H        VAL  26  16.950  10.006   9.780
  190    HA   VAL  26           HA       VAL  26  17.539  12.876  10.091
  191    HB   VAL  26           HB       VAL  26  17.370  12.281   7.687
  192   HG11  VAL  26          1HG1      VAL  26  14.524  11.555   8.359
  193   HG12  VAL  26          2HG1      VAL  26  15.796  10.442   7.855
  194   HG13  VAL  26          3HG1      VAL  26  15.203  11.668   6.735
  195   HG21  VAL  26          3HG2      VAL  26  15.756  14.029   7.060
  196   HG22  VAL  26          1HG2      VAL  26  16.817  14.535   8.375
  197   HG23  VAL  26          2HG2      VAL  26  15.155  14.051   8.719
  198    H    GLU  27           H        GLU  27  15.661  10.259  11.049
  199    HA   GLU  27           HA       GLU  27  13.153  11.520  11.399
  200    HB2  GLU  27           2HB      GLU  27  12.796   9.576  13.074
  201    HB3  GLU  27           1HB      GLU  27  12.954   9.230  11.363
  202    HG2  GLU  27           2HG      GLU  27  14.186   7.599  12.557
  203    HG3  GLU  27           1HG      GLU  27  15.342   8.657  11.760
  204    H    ASP  28           H        ASP  28  16.018  11.999  13.024
  205    HA   ASP  28           HA       ASP  28  15.004  12.560  15.628
  206    HB2  ASP  28           2HB      ASP  28  17.356  12.047  15.327
  207    HB3  ASP  28           1HB      ASP  28  17.554  13.423  14.250
  208    H    LEU  29           H        LEU  29  15.153  14.307  12.646
  209    HA   LEU  29           HA       LEU  29  14.650  16.851  13.994
  210    HB2  LEU  29           2HB      LEU  29  16.351  16.765  12.212
  211    HB3  LEU  29           1HB      LEU  29  15.121  16.257  11.072
  212    HG   LEU  29           HG       LEU  29  13.960  18.420  11.397
  213   HD11  LEU  29          1HD1      LEU  29  14.715  18.929  13.647
  214   HD12  LEU  29          2HD1      LEU  29  15.134  20.238  12.541
  215   HD13  LEU  29          3HD1      LEU  29  16.373  19.099  13.069
  216   HD21  LEU  29          3HD2      LEU  29  16.857  18.647  10.602
  217   HD22  LEU  29          1HD2      LEU  29  15.570  19.768  10.162
  218   HD23  LEU  29          2HD2      LEU  29  15.539  18.109   9.562
  219    H    GLU  30           H        GLU  30  13.147  14.664  11.634
  220    HA   GLU  30           HA       GLU  30  10.947  16.439  11.191
  221    HB2  GLU  30           2HB      GLU  30  10.033  14.649   9.794
  222    HB3  GLU  30           1HB      GLU  30  11.710  15.003   9.406
  223    HG2  GLU  30           2HG      GLU  30  12.439  13.033  10.604
  224    HG3  GLU  30           1HG      GLU  30  10.779  12.693  11.099
  225    H    SER  31           H        SER  31  11.602  13.985  13.508
  226    HA   SER  31           HA       SER  31   8.937  13.286  14.158
  227    HB2  SER  31           2HB      SER  31   9.944  12.660  16.402
  228    HB3  SER  31           1HB      SER  31  10.693  11.892  15.002
  229    HG   SER  31           HG       SER  31  12.495  12.838  15.490
  230    H    VAL  32           H        VAL  32  11.077  15.882  15.110
  231    HA   VAL  32           HA       VAL  32   9.506  17.069  17.109
  232    HB   VAL  32           HB       VAL  32  11.385  18.418  15.155
  233   HG11  VAL  32          1HG1      VAL  32  11.603  20.156  16.859
  234   HG12  VAL  32          2HG1      VAL  32  10.392  19.343  17.849
  235   HG13  VAL  32          3HG1      VAL  32   9.942  20.024  16.285
  236   HG21  VAL  32          3HG2      VAL  32  13.061  18.201  16.948
  237   HG22  VAL  32          1HG2      VAL  32  12.507  16.637  16.350
  238   HG23  VAL  32          2HG2      VAL  32  11.907  17.255  17.887
  239    H    GLY  33           H        GLY  33   9.392  17.217  13.612
  240    HA2  GLY  33           2HA      GLY  33   7.395  19.295  13.526
  241    HA3  GLY  33           1HA      GLY  33   7.951  18.323  12.170
  242    H    LYS  34           H        LYS  34   6.993  16.668  14.986
  243    HA   LYS  34           HA       LYS  34   5.255  15.377  15.590
  244    HB2  LYS  34           2HB      LYS  34   4.043  17.612  15.245
  245    HB3  LYS  34           1HB      LYS  34   3.478  16.935  13.725
  246    HG2  LYS  34           2HG      LYS  34   1.837  16.690  15.527
  247    HG3  LYS  34           1HG      LYS  34   2.372  15.133  14.893
  248    HD2  LYS  34           2HD      LYS  34   2.271  15.019  17.303
  249    HD3  LYS  34           1HD      LYS  34   3.954  14.947  16.787
  250    HE2  LYS  34           2HE      LYS  34   3.861  16.405  18.663
  251    HE3  LYS  34           1HE      LYS  34   4.101  17.414  17.236
  252    HZ1  LYS  34           3HZ      LYS  34   2.451  18.379  18.681
  253    HZ2  LYS  34           1HZ      LYS  34   1.530  16.956  18.652
  254    HZ3  LYS  34           2HZ      LYS  34   1.708  17.879  17.239
  255    H    GLY  35           H        GLY  35   6.834  14.970  12.999
  256    HA2  GLY  35           2HA      GLY  35   5.113  13.413  11.318
  257    HA3  GLY  35           1HA      GLY  35   6.874  13.425  11.282
  258    H    ALA  36           H        ALA  36   6.419  12.900  14.352
  259    HA   ALA  36           HA       ALA  36   7.080  10.193  14.368
  260    HB1  ALA  36           1HB      ALA  36   6.684  10.278  16.777
  261    HB2  ALA  36           2HB      ALA  36   5.854  11.822  16.591
  262    HB3  ALA  36           3HB      ALA  36   7.574  11.697  16.225
  263    H    VAL  37           H        VAL  37   3.972  11.779  14.386
  264    HA   VAL  37           HA       VAL  37   2.357   9.641  15.239
  265    HB   VAL  37           HB       VAL  37   1.642  11.833  13.276
  266   HG11  VAL  37          1HG1      VAL  37  -0.656  11.479  14.054
  267   HG12  VAL  37          2HG1      VAL  37  -0.106  10.129  15.046
  268   HG13  VAL  37          3HG1      VAL  37   0.010  10.037  13.289
  269   HG21  VAL  37          3HG2      VAL  37   1.434  11.796  16.287
  270   HG22  VAL  37          1HG2      VAL  37   0.804  13.061  15.230
  271   HG23  VAL  37          2HG2      VAL  37   2.541  12.777  15.327
  272    H    HIS  38           H        HIS  38   3.942  10.318  12.237
  273    HA   HIS  38           HA       HIS  38   2.393   8.391  10.721
  274    HB2  HIS  38           2HB      HIS  38   3.138  10.434   9.606
  275    HB3  HIS  38           1HB      HIS  38   4.812  10.070   9.994
  276    HD1  HIS  38           1HD      HIS  38   2.277   9.607   7.421
  277    HD2  HIS  38           2HD      HIS  38   5.823   7.741   8.539
  278    HE1  HIS  38           1HE      HIS  38   2.977   8.239   5.439
  279    HE2  HIS  38           2HE      HIS  38   5.029   6.998   6.192
  280    H    ASP  39           H        ASP  39   5.789   8.779  11.737
  281    HA   ASP  39           HA       ASP  39   6.511   6.259  10.577
  282    HB2  ASP  39           2HB      ASP  39   8.116   8.167  12.290
  283    HB3  ASP  39           1HB      ASP  39   8.770   6.755  11.466
  284    H    VAL  40           H        VAL  40   6.181   7.447  13.909
  285    HA   VAL  40           HA       VAL  40   7.170   5.077  15.108
  286    HB   VAL  40           HB       VAL  40   5.378   7.208  16.295
  287   HG11  VAL  40          1HG1      VAL  40   6.122   6.356  18.472
  288   HG12  VAL  40          2HG1      VAL  40   6.987   5.052  17.663
  289   HG13  VAL  40          3HG1      VAL  40   5.230   5.133  17.569
  290   HG21  VAL  40          3HG2      VAL  40   7.525   8.068  15.535
  291   HG22  VAL  40          1HG2      VAL  40   8.361   6.808  16.443
  292   HG23  VAL  40          2HG2      VAL  40   7.445   8.051  17.296
  293    H    LYS  41           H        LYS  41   4.016   6.060  13.993
  294    HA   LYS  41           HA       LYS  41   2.510   4.100  15.371
  295    HB2  LYS  41           2HB      LYS  41   1.536   6.125  14.333
  296    HB3  LYS  41           1HB      LYS  41   1.874   5.452  12.745
  297    HG2  LYS  41           2HG      LYS  41   0.319   3.674  13.085
  298    HG3  LYS  41           1HG      LYS  41   0.102   4.116  14.779
  299    HD2  LYS  41           2HD      LYS  41  -0.640   5.852  12.424
  300    HD3  LYS  41           1HD      LYS  41  -1.769   4.864  13.354
  301    HE2  LYS  41           2HE      LYS  41  -1.171   6.132  15.379
  302    HE3  LYS  41           1HE      LYS  41  -0.100   7.146  14.413
  303    HZ1  LYS  41           3HZ      LYS  41  -2.010   7.886  13.137
  304    HZ2  LYS  41           1HZ      LYS  41  -2.241   8.203  14.787
  305    HZ3  LYS  41           2HZ      LYS  41  -3.041   6.899  14.055
  306    H    ASP  42           H        ASP  42   4.211   4.099  12.286
  307    HA   ASP  42           HA       ASP  42   3.254   1.642  11.290
  308    HB2  ASP  42           2HB      ASP  42   4.525   3.224   9.901
  309    HB3  ASP  42           1HB      ASP  42   5.961   2.945  10.882
  310    H    VAL  43           H        VAL  43   5.731   2.475  13.595
  311    HA   VAL  43           HA       VAL  43   6.766  -0.203  13.845
  312    HB   VAL  43           HB       VAL  43   7.173   2.144  15.708
  313   HG11  VAL  43          1HG1      VAL  43   8.790  -0.367  15.277
  314   HG12  VAL  43          2HG1      VAL  43   7.781  -0.008  16.678
  315   HG13  VAL  43          3HG1      VAL  43   9.221   0.960  16.357
  316   HG21  VAL  43          3HG2      VAL  43   7.820   2.748  13.441
  317   HG22  VAL  43          1HG2      VAL  43   8.813   1.296  13.323
  318   HG23  VAL  43          2HG2      VAL  43   9.244   2.567  14.468
  319    H    LEU  44           H        LEU  44   4.582   1.916  15.621
  320    HA   LEU  44           HA       LEU  44   4.189   0.407  17.921
  321    HB2  LEU  44           2HB      LEU  44   3.377   2.710  17.595
  322    HB3  LEU  44           1HB      LEU  44   2.175   2.118  16.464
  323    HG   LEU  44           HG       LEU  44   1.127   0.816  18.294
  324   HD11  LEU  44          1HD1      LEU  44   3.126   2.258  20.037
  325   HD12  LEU  44          2HD1      LEU  44   3.087   0.525  19.716
  326   HD13  LEU  44          3HD1      LEU  44   1.771   1.285  20.607
  327   HD21  LEU  44          3HD2      LEU  44   0.137   2.728  19.442
  328   HD22  LEU  44          1HD2      LEU  44   0.305   3.045  17.713
  329   HD23  LEU  44          2HD2      LEU  44   1.441   3.762  18.856
  330    H    ASP  45           H        ASP  45   2.347   0.305  14.865
  331    HA   ASP  45           HA       ASP  45   0.862  -2.007  15.788
  332    HB2  ASP  45           2HB      ASP  45   0.785  -0.328  13.313
  333    HB3  ASP  45           1HB      ASP  45   0.030  -1.917  13.309
  334    H    SER  46           H        SER  46   3.906  -1.775  14.900
  335    HA   SER  46           HA       SER  46   3.932  -4.165  13.207
  336    HB2  SER  46           2HB      SER  46   5.357  -2.132  12.640
  337    HB3  SER  46           1HB      SER  46   6.318  -2.517  14.067
  338    HG   SER  46           HG       SER  46   5.901  -4.147  11.776
  339    H    VAL  47           H        VAL  47   4.672  -3.005  16.405
  340    HA   VAL  47           HA       VAL  47   6.111  -5.365  17.209
  341    HB   VAL  47           HB       VAL  47   4.899  -3.179  18.917
  342   HG11  VAL  47          1HG1      VAL  47   5.285  -5.206  20.191
  343   HG12  VAL  47          2HG1      VAL  47   6.459  -3.968  20.645
  344   HG13  VAL  47          3HG1      VAL  47   6.937  -5.296  19.587
  345   HG21  VAL  47          3HG2      VAL  47   6.556  -2.288  17.374
  346   HG22  VAL  47          1HG2      VAL  47   7.715  -3.516  17.887
  347   HG23  VAL  47          2HG2      VAL  47   7.179  -2.279  19.025
  348    H    LEU  48           H        LEU  48   4.982  -7.213  17.187
  349    HA   LEU  48           HA       LEU  48   2.351  -7.245  18.506
  350    HB2  LEU  48           2HB      LEU  48   2.548  -7.835  15.996
  351    HB3  LEU  48           1HB      LEU  48   3.324  -9.308  16.535
  352    HG   LEU  48           HG       LEU  48   0.547  -8.501  17.405
  353   HD11  LEU  48          1HD1      LEU  48   0.598  -8.730  14.982
  354   HD12  LEU  48          2HD1      LEU  48  -0.281 -10.065  15.726
  355   HD13  LEU  48          3HD1      LEU  48   1.363 -10.312  15.137
  356   HD21  LEU  48          3HD2      LEU  48   0.321 -10.875  17.952
  357   HD22  LEU  48          1HD2      LEU  48   1.646 -10.135  18.850
  358   HD23  LEU  48          2HD2      LEU  48   1.989 -11.153  17.452
  Start of MODEL    4
    1    H1   SER   1           1HT      SER   1  10.395  -5.766  26.963
    2    H2   SER   1           2HT      SER   1  11.804  -6.690  27.138
    3    H3   SER   1           3HT      SER   1  10.370  -7.422  26.604
    4    HA   SER   1           HA       SER   1  11.956  -7.052  24.812
    5    HB2  SER   1           2HB      SER   1   9.413  -5.413  24.663
    6    HB3  SER   1           1HB      SER   1  10.349  -5.976  23.276
    7    HG   SER   1           HG       SER   1   9.969  -8.138  24.047
    8    H    SER   2           H        SER   2  13.799  -5.932  24.765
    9    HA   SER   2           HA       SER   2  13.712  -3.022  25.133
   10    HB2  SER   2           2HB      SER   2  16.142  -4.810  24.873
   11    HB3  SER   2           1HB      SER   2  16.104  -3.136  25.433
   12    HG   SER   2           HG       SER   2  14.464  -4.893  26.808
   13    H    LEU   3           H        LEU   3  14.722  -1.633  23.555
   14    HA   LEU   3           HA       LEU   3  14.295  -2.659  20.858
   15    HB2  LEU   3           2HB      LEU   3  14.795   0.164  21.809
   16    HB3  LEU   3           1HB      LEU   3  14.342  -0.306  20.181
   17    HG   LEU   3           HG       LEU   3  12.621  -0.669  22.635
   18   HD11  LEU   3          1HD1      LEU   3  12.897   1.683  22.019
   19   HD12  LEU   3          2HD1      LEU   3  11.257   1.116  21.701
   20   HD13  LEU   3          3HD1      LEU   3  12.397   1.306  20.369
   21   HD21  LEU   3          3HD2      LEU   3  12.021  -1.115  19.713
   22   HD22  LEU   3          1HD2      LEU   3  10.867  -1.250  21.039
   23   HD23  LEU   3          2HD2      LEU   3  12.222  -2.373  20.933
   24    H    LEU   4           H        LEU   4  16.806  -1.145  22.816
   25    HA   LEU   4           HA       LEU   4  18.978  -2.262  21.427
   26    HB2  LEU   4           2HB      LEU   4  18.093  -0.597  19.706
   27    HB3  LEU   4           1HB      LEU   4  18.548   0.670  20.824
   28    HG   LEU   4           HG       LEU   4  20.912  -0.115  20.677
   29   HD11  LEU   4          1HD1      LEU   4  19.825  -1.865  18.477
   30   HD12  LEU   4          2HD1      LEU   4  20.491  -2.420  20.013
   31   HD13  LEU   4          3HD1      LEU   4  21.529  -1.606  18.842
   32   HD21  LEU   4          3HD2      LEU   4  21.312   0.814  18.449
   33   HD22  LEU   4          1HD2      LEU   4  20.129   1.766  19.346
   34   HD23  LEU   4          2HD2      LEU   4  19.595   0.662  18.078
   35    H    GLU   5           H        GLU   5  21.055  -0.793  22.050
   36    HA   GLU   5           HA       GLU   5  21.103  -0.460  24.841
   37    HB2  GLU   5           2HB      GLU   5  23.283   0.650  24.475
   38    HB3  GLU   5           1HB      GLU   5  23.149  -0.860  23.585
   39    HG2  GLU   5           2HG      GLU   5  22.803   0.289  21.532
   40    HG3  GLU   5           1HG      GLU   5  22.629   1.835  22.359
   41    H    LYS   6           H        LYS   6  20.635   1.810  22.193
   42    HA   LYS   6           HA       LYS   6  20.349   4.094  23.915
   43    HB2  LYS   6           2HB      LYS   6  21.198   4.256  21.584
   44    HB3  LYS   6           1HB      LYS   6  19.631   3.734  20.992
   45    HG2  LYS   6           2HG      LYS   6  19.833   6.174  22.699
   46    HG3  LYS   6           1HG      LYS   6  20.259   6.253  20.991
   47    HD2  LYS   6           2HD      LYS   6  18.044   5.386  20.406
   48    HD3  LYS   6           1HD      LYS   6  17.621   5.318  22.117
   49    HE2  LYS   6           2HE      LYS   6  17.922   7.741  22.281
   50    HE3  LYS   6           1HE      LYS   6  18.333   7.802  20.567
   51    HZ1  LYS   6           3HZ      LYS   6  15.726   7.056  21.767
   52    HZ2  LYS   6           1HZ      LYS   6  16.101   6.810  20.129
   53    HZ3  LYS   6           2HZ      LYS   6  16.065   8.378  20.774
   54    H    GLY   7           H        GLY   7  18.332   1.656  22.509
   55    HA2  GLY   7           2HA      GLY   7  15.877   3.028  23.313
   56    HA3  GLY   7           1HA      GLY   7  15.975   1.543  22.374
   57    H    LEU   8           H        LEU   8  17.580   2.320  25.409
   58    HA   LEU   8           HA       LEU   8  16.390  -0.061  26.627
   59    HB2  LEU   8           2HB      LEU   8  18.894   0.366  26.585
   60    HB3  LEU   8           1HB      LEU   8  18.607   1.685  27.700
   61    HG   LEU   8           HG       LEU   8  17.718   0.084  29.354
   62   HD11  LEU   8          1HD1      LEU   8  18.539  -2.003  27.339
   63   HD12  LEU   8          2HD1      LEU   8  16.886  -1.609  27.807
   64   HD13  LEU   8          3HD1      LEU   8  17.991  -2.316  28.987
   65   HD21  LEU   8          3HD2      LEU   8  19.861  -0.976  29.900
   66   HD22  LEU   8          1HD2      LEU   8  20.072   0.706  29.413
   67   HD23  LEU   8          2HD2      LEU   8  20.458  -0.593  28.285
   68    H    ASP   9           H        ASP   9  14.805   2.197  26.193
   69    HA   ASP   9           HA       ASP   9  14.522   4.110  28.137
   70    HB2  ASP   9           2HB      ASP   9  13.226   4.091  26.077
   71    HB3  ASP   9           1HB      ASP   9  12.358   2.655  26.608
   72    H    GLY  10           H        GLY  10  12.792   0.996  28.064
   73    HA2  GLY  10           2HA      GLY  10  12.774  -0.335  30.118
   74    HA3  GLY  10           1HA      GLY  10  12.601   1.176  31.001
   75    H    ALA  11           H        ALA  11  10.596   2.441  30.546
   76    HA   ALA  11           HA       ALA  11   8.330   1.086  29.470
   77    HB1  ALA  11           1HB      ALA  11   7.117   0.687  31.550
   78    HB2  ALA  11           2HB      ALA  11   8.528   1.203  32.475
   79    HB3  ALA  11           3HB      ALA  11   8.609  -0.252  31.485
   80    H    LYS  12           H        LYS  12   9.700   3.827  29.649
   81    HA   LYS  12           HA       LYS  12   7.288   5.284  30.542
   82    HB2  LYS  12           2HB      LYS  12   8.712   7.309  30.736
   83    HB3  LYS  12           1HB      LYS  12   9.152   6.029  31.852
   84    HG2  LYS  12           2HG      LYS  12  10.605   6.151  29.274
   85    HG3  LYS  12           1HG      LYS  12  10.944   7.405  30.468
   86    HD2  LYS  12           2HD      LYS  12  11.088   4.436  30.980
   87    HD3  LYS  12           1HD      LYS  12  12.474   5.476  30.646
   88    HE2  LYS  12           2HE      LYS  12  11.858   6.831  32.636
   89    HE3  LYS  12           1HE      LYS  12  10.596   5.654  32.996
   90    HZ1  LYS  12           3HZ      LYS  12  12.245   3.960  33.292
   91    HZ2  LYS  12           1HZ      LYS  12  12.664   5.293  34.254
   92    HZ3  LYS  12           2HZ      LYS  12  13.489   5.008  32.801
   93    H    LYS  13           H        LYS  13   9.380   4.577  27.924
   94    HA   LYS  13           HA       LYS  13   9.230   4.938  25.695
   95    HB2  LYS  13           2HB      LYS  13   6.814   4.284  26.221
   96    HB3  LYS  13           1HB      LYS  13   6.443   6.000  26.157
   97    HG2  LYS  13           2HG      LYS  13   5.926   4.842  24.056
   98    HG3  LYS  13           1HG      LYS  13   7.140   6.106  23.847
   99    HD2  LYS  13           2HD      LYS  13   8.910   4.453  23.843
  100    HD3  LYS  13           1HD      LYS  13   7.747   3.167  24.168
  101    HE2  LYS  13           2HE      LYS  13   7.653   4.922  21.719
  102    HE3  LYS  13           1HE      LYS  13   8.488   3.371  21.773
  103    HZ1  LYS  13           3HZ      LYS  13   5.582   3.820  22.215
  104    HZ2  LYS  13           1HZ      LYS  13   6.372   2.323  22.362
  105    HZ3  LYS  13           2HZ      LYS  13   6.298   3.103  20.857
  106    H    ALA  14           H        ALA  14  10.399   6.900  27.277
  107    HA   ALA  14           HA       ALA  14   9.459   9.497  26.348
  108    HB1  ALA  14           1HB      ALA  14  10.193   9.237  28.679
  109    HB2  ALA  14           2HB      ALA  14  11.182  10.412  27.813
  110    HB3  ALA  14           3HB      ALA  14  11.802   8.789  28.116
  111    H    VAL  15           H        VAL  15  10.225   7.867  24.274
  112    HA   VAL  15           HA       VAL  15  11.458   7.826  22.361
  113    HB   VAL  15           HB       VAL  15  12.774  10.382  23.314
  114   HG11  VAL  15          1HG1      VAL  15  12.972  10.890  20.933
  115   HG12  VAL  15          2HG1      VAL  15  12.230   9.339  20.539
  116   HG13  VAL  15          3HG1      VAL  15  13.799   9.385  21.342
  117   HG21  VAL  15          3HG2      VAL  15  10.159  10.078  21.840
  118   HG22  VAL  15          1HG2      VAL  15  10.983  11.602  22.167
  119   HG23  VAL  15          2HG2      VAL  15  10.356  10.633  23.502
  120    H    GLY  16           H        GLY  16  12.493   6.894  25.091
  121    HA2  GLY  16           2HA      GLY  16  14.334   5.634  25.727
  122    HA3  GLY  16           1HA      GLY  16  15.128   6.089  24.223
  123    H    GLY  17           H        GLY  17  14.286   7.204  27.452
  124    HA2  GLY  17           2HA      GLY  17  15.457   9.744  27.325
  125    HA3  GLY  17           1HA      GLY  17  15.135   8.849  28.797
  126    H    LEU  18           H        LEU  18  16.978   6.667  27.726
  127    HA   LEU  18           HA       LEU  18  19.359   7.715  28.956
  128    HB2  LEU  18           2HB      LEU  18  18.862   5.038  27.653
  129    HB3  LEU  18           1HB      LEU  18  20.255   5.454  28.632
  130    HG   LEU  18           HG       LEU  18  17.399   5.293  29.603
  131   HD11  LEU  18          1HD1      LEU  18  18.193   3.360  30.866
  132   HD12  LEU  18          2HD1      LEU  18  19.778   3.518  30.110
  133   HD13  LEU  18          3HD1      LEU  18  18.370   3.117  29.128
  134   HD21  LEU  18          3HD2      LEU  18  19.940   5.835  31.134
  135   HD22  LEU  18          1HD2      LEU  18  18.329   5.641  31.824
  136   HD23  LEU  18          2HD2      LEU  18  18.681   7.017  30.780
  137    H    GLY  19           H        GLY  19  18.164   8.037  25.929
  138    HA2  GLY  19           2HA      GLY  19  20.871   8.366  24.817
  139    HA3  GLY  19           1HA      GLY  19  19.630   7.540  23.883
  140    H    LYS  20           H        LYS  20  17.431   9.048  24.355
  141    HA   LYS  20           HA       LYS  20  16.279  10.773  23.484
  142    HB2  LYS  20           2HB      LYS  20  18.490  12.189  24.922
  143    HB3  LYS  20           1HB      LYS  20  17.221  13.080  24.095
  144    HG2  LYS  20           2HG      LYS  20  15.545  11.887  25.475
  145    HG3  LYS  20           1HG      LYS  20  16.872  11.125  26.357
  146    HD2  LYS  20           2HD      LYS  20  16.064  13.053  27.583
  147    HD3  LYS  20           1HD      LYS  20  17.698  13.359  26.992
  148    HE2  LYS  20           2HE      LYS  20  16.476  15.340  26.587
  149    HE3  LYS  20           1HE      LYS  20  16.634  14.536  25.028
  150    HZ1  LYS  20           3HZ      LYS  20  14.401  15.312  25.267
  151    HZ2  LYS  20           1HZ      LYS  20  14.240  14.573  26.783
  152    HZ3  LYS  20           2HZ      LYS  20  14.367  13.621  25.390
  153    H    LEU  21           H        LEU  21  19.465  12.275  23.000
  154    HA   LEU  21           HA       LEU  21  18.719  13.788  20.856
  155    HB2  LEU  21           2HB      LEU  21  21.125  14.010  20.323
  156    HB3  LEU  21           1HB      LEU  21  20.734  14.263  22.010
  157    HG   LEU  21           HG       LEU  21  21.440  11.735  22.241
  158   HD11  LEU  21          1HD1      LEU  21  23.280  11.157  20.731
  159   HD12  LEU  21          2HD1      LEU  21  22.943  12.600  19.774
  160   HD13  LEU  21          3HD1      LEU  21  21.750  11.304  19.870
  161   HD21  LEU  21          3HD2      LEU  21  22.520  13.613  23.351
  162   HD22  LEU  21          1HD2      LEU  21  23.424  13.975  21.879
  163   HD23  LEU  21          2HD2      LEU  21  23.714  12.465  22.744
  164    H    GLY  22           H        GLY  22  19.754  10.433  20.695
  165    HA2  GLY  22           2HA      GLY  22  20.067  10.471  17.824
  166    HA3  GLY  22           1HA      GLY  22  20.128   9.054  18.862
  167    H    LYS  23           H        LYS  23  17.563  11.441  18.603
  168    HA   LYS  23           HA       LYS  23  15.792  10.225  16.874
  169    HB2  LYS  23           2HB      LYS  23  16.051   8.487  18.912
  170    HB3  LYS  23           1HB      LYS  23  14.817   9.527  19.599
  171    HG2  LYS  23           2HG      LYS  23  14.608   8.082  16.967
  172    HG3  LYS  23           1HG      LYS  23  13.886   7.559  18.486
  173    HD2  LYS  23           2HD      LYS  23  12.671   9.782  18.514
  174    HD3  LYS  23           1HD      LYS  23  13.215   9.994  16.850
  175    HE2  LYS  23           2HE      LYS  23  11.534   7.714  17.889
  176    HE3  LYS  23           1HE      LYS  23  10.946   9.084  16.952
  177    HZ1  LYS  23           3HZ      LYS  23  11.309   7.049  15.637
  178    HZ2  LYS  23           1HZ      LYS  23  12.966   7.139  15.971
  179    HZ3  LYS  23           2HZ      LYS  23  12.212   8.367  15.074
  180    H    ASP  24           H        ASP  24  16.099  11.762  20.043
  181    HA   ASP  24           HA       ASP  24  13.681  13.150  20.129
  182    HB2  ASP  24           2HB      ASP  24  15.242  12.916  22.042
  183    HB3  ASP  24           1HB      ASP  24  16.355  14.028  21.255
  184    H    ALA  25           H        ALA  25  16.824  14.190  18.855
  185    HA   ALA  25           HA       ALA  25  16.009  16.754  18.016
  186    HB1  ALA  25           1HB      ALA  25  18.356  16.141  18.295
  187    HB2  ALA  25           2HB      ALA  25  18.051  16.755  16.671
  188    HB3  ALA  25           3HB      ALA  25  18.233  15.022  16.939
  189    H    VAL  26           H        VAL  26  15.813  13.600  16.531
  190    HA   VAL  26           HA       VAL  26  15.080  14.541  13.928
  191    HB   VAL  26           HB       VAL  26  14.612  11.804  15.132
  192   HG11  VAL  26          1HG1      VAL  26  14.772  12.708  12.259
  193   HG12  VAL  26          2HG1      VAL  26  13.315  12.208  13.116
  194   HG13  VAL  26          3HG1      VAL  26  14.597  11.041  12.804
  195   HG21  VAL  26          3HG2      VAL  26  16.960  12.339  15.300
  196   HG22  VAL  26          1HG2      VAL  26  16.996  12.863  13.615
  197   HG23  VAL  26          2HG2      VAL  26  16.721  11.165  14.005
  198    H    GLU  27           H        GLU  27  13.388  13.367  16.788
  199    HA   GLU  27           HA       GLU  27  10.779  13.271  15.798
  200    HB2  GLU  27           2HB      GLU  27  11.822  12.556  18.092
  201    HB3  GLU  27           1HB      GLU  27  11.397  14.181  18.598
  202    HG2  GLU  27           2HG      GLU  27   9.405  12.246  17.448
  203    HG3  GLU  27           1HG      GLU  27   9.755  12.363  19.168
  204    H    ASP  28           H        ASP  28  12.612  15.925  17.241
  205    HA   ASP  28           HA       ASP  28  10.648  17.904  17.231
  206    HB2  ASP  28           2HB      ASP  28  12.843  18.170  18.320
  207    HB3  ASP  28           1HB      ASP  28  13.622  18.221  16.742
  208    H    LEU  29           H        LEU  29  12.887  16.898  14.688
  209    HA   LEU  29           HA       LEU  29  12.046  18.844  12.790
  210    HB2  LEU  29           2HB      LEU  29  14.243  17.729  12.715
  211    HB3  LEU  29           1HB      LEU  29  13.452  16.203  12.373
  212    HG   LEU  29           HG       LEU  29  12.626  17.113  10.238
  213   HD11  LEU  29          1HD1      LEU  29  13.479  19.241   9.410
  214   HD12  LEU  29          2HD1      LEU  29  14.267  19.537  10.959
  215   HD13  LEU  29          3HD1      LEU  29  12.507  19.464  10.863
  216   HD21  LEU  29          3HD2      LEU  29  14.784  17.175   9.087
  217   HD22  LEU  29          1HD2      LEU  29  14.724  15.885  10.287
  218   HD23  LEU  29          2HD2      LEU  29  15.604  17.373  10.636
  219    H    GLU  30           H        GLU  30  11.175  15.485  13.445
  220    HA   GLU  30           HA       GLU  30   9.410  15.275  11.203
  221    HB2  GLU  30           2HB      GLU  30   9.675  13.554  13.670
  222    HB3  GLU  30           1HB      GLU  30   8.689  13.152  12.271
  223    HG2  GLU  30           2HG      GLU  30  11.679  13.426  12.376
  224    HG3  GLU  30           1HG      GLU  30  10.746  11.951  12.122
  225    H    SER  31           H        SER  31   9.143  17.004  13.988
  226    HA   SER  31           HA       SER  31   6.323  16.658  14.416
  227    HB2  SER  31           2HB      SER  31   8.225  18.820  15.355
  228    HB3  SER  31           1HB      SER  31   6.545  18.666  15.869
  229    HG   SER  31           HG       SER  31   8.497  16.619  16.196
  230    H    VAL  32           H        VAL  32   8.384  19.141  12.899
  231    HA   VAL  32           HA       VAL  32   6.144  20.660  11.973
  232    HB   VAL  32           HB       VAL  32   7.771  21.972  10.677
  233   HG11  VAL  32          1HG1      VAL  32   8.663  21.401  13.499
  234   HG12  VAL  32          2HG1      VAL  32   7.387  22.520  13.017
  235   HG13  VAL  32          3HG1      VAL  32   9.062  22.841  12.562
  236   HG21  VAL  32          3HG2      VAL  32   9.794  19.970  11.678
  237   HG22  VAL  32          1HG2      VAL  32  10.176  21.483  10.854
  238   HG23  VAL  32          2HG2      VAL  32   9.297  20.212  10.003
  239    H    GLY  33           H        GLY  33   7.967  17.985  10.767
  240    HA2  GLY  33           2HA      GLY  33   6.792  18.217   8.107
  241    HA3  GLY  33           1HA      GLY  33   7.928  16.981   8.639
  242    H    LYS  34           H        LYS  34   5.956  16.985  11.098
  243    HA   LYS  34           HA       LYS  34   4.303  15.673  11.895
  244    HB2  LYS  34           2HB      LYS  34   3.180  16.081   9.122
  245    HB3  LYS  34           1HB      LYS  34   2.287  15.392  10.473
  246    HG2  LYS  34           2HG      LYS  34   2.556  17.466  11.724
  247    HG3  LYS  34           1HG      LYS  34   3.475  18.157  10.388
  248    HD2  LYS  34           2HD      LYS  34   1.519  17.947   8.937
  249    HD3  LYS  34           1HD      LYS  34   0.601  17.255  10.277
  250    HE2  LYS  34           2HE      LYS  34   0.882  19.314  11.549
  251    HE3  LYS  34           1HE      LYS  34   1.843  20.000  10.239
  252    HZ1  LYS  34           3HZ      LYS  34  -1.015  19.206  10.059
  253    HZ2  LYS  34           1HZ      LYS  34  -0.090  19.863   8.796
  254    HZ3  LYS  34           2HZ      LYS  34  -0.429  20.795  10.169
  255    H    GLY  35           H        GLY  35   6.617  14.482  10.371
  256    HA2  GLY  35           2HA      GLY  35   5.626  12.041   9.225
  257    HA3  GLY  35           1HA      GLY  35   7.306  12.424   9.585
  258    H    ALA  36           H        ALA  36   6.573  13.118  12.380
  259    HA   ALA  36           HA       ALA  36   7.165  10.630  13.556
  260    HB1  ALA  36           1HB      ALA  36   6.836  11.768  15.695
  261    HB2  ALA  36           2HB      ALA  36   6.103  13.135  14.856
  262    HB3  ALA  36           3HB      ALA  36   7.802  12.743  14.588
  263    H    VAL  37           H        VAL  37   4.178  12.134  12.728
  264    HA   VAL  37           HA       VAL  37   2.469  10.773  14.530
  265    HB   VAL  37           HB       VAL  37   1.729  11.798  11.779
  266   HG11  VAL  37          1HG1      VAL  37  -0.498  12.071  12.755
  267   HG12  VAL  37          2HG1      VAL  37   0.081  11.391  14.275
  268   HG13  VAL  37          3HG1      VAL  37   0.032  10.390  12.823
  269   HG21  VAL  37          3HG2      VAL  37   1.808  13.288  14.402
  270   HG22  VAL  37          1HG2      VAL  37   1.141  13.906  12.892
  271   HG23  VAL  37          2HG2      VAL  37   2.866  13.557  13.016
  272    H    HIS  38           H        HIS  38   3.964   9.913  11.519
  273    HA   HIS  38           HA       HIS  38   2.236   7.591  11.138
  274    HB2  HIS  38           2HB      HIS  38   4.686   8.268   9.511
  275    HB3  HIS  38           1HB      HIS  38   3.306   7.288   9.038
  276    HD1  HIS  38           1HD      HIS  38   4.722  10.359   8.249
  277    HD2  HIS  38           2HD      HIS  38   0.832   9.177   9.128
  278    HE1  HIS  38           1HE      HIS  38   3.238  12.162   7.318
  279    HE2  HIS  38           2HE      HIS  38   0.903  11.271   7.609
  280    H    ASP  39           H        ASP  39   5.700   8.259  11.404
  281    HA   ASP  39           HA       ASP  39   6.600   5.637  11.345
  282    HB2  ASP  39           2HB      ASP  39   8.012   7.613  10.979
  283    HB3  ASP  39           1HB      ASP  39   7.888   8.019  12.685
  284    H    VAL  40           H        VAL  40   6.060   7.680  14.228
  285    HA   VAL  40           HA       VAL  40   7.061   5.863  16.097
  286    HB   VAL  40           HB       VAL  40   4.957   7.997  16.505
  287   HG11  VAL  40          1HG1      VAL  40   6.673   6.564  18.533
  288   HG12  VAL  40          2HG1      VAL  40   4.931   6.371  18.327
  289   HG13  VAL  40          3HG1      VAL  40   5.591   7.916  18.868
  290   HG21  VAL  40          3HG2      VAL  40   6.848   9.346  17.315
  291   HG22  VAL  40          1HG2      VAL  40   7.037   8.886  15.622
  292   HG23  VAL  40          2HG2      VAL  40   7.951   8.043  16.873
  293    H    LYS  41           H        LYS  41   3.789   6.240  14.826
  294    HA   LYS  41           HA       LYS  41   2.648   4.282  16.582
  295    HB2  LYS  41           2HB      LYS  41   1.334   6.130  15.532
  296    HB3  LYS  41           1HB      LYS  41   1.552   5.352  13.970
  297    HG2  LYS  41           2HG      LYS  41   0.530   3.358  15.627
  298    HG3  LYS  41           1HG      LYS  41  -0.379   4.811  16.043
  299    HD2  LYS  41           2HD      LYS  41  -1.525   3.637  14.274
  300    HD3  LYS  41           1HD      LYS  41  -0.865   5.141  13.631
  301    HE2  LYS  41           2HE      LYS  41   0.967   3.969  12.614
  302    HE3  LYS  41           1HE      LYS  41   0.488   2.460  13.389
  303    HZ1  LYS  41           3HZ      LYS  41  -1.542   2.469  12.091
  304    HZ2  LYS  41           1HZ      LYS  41  -0.188   2.535  11.069
  305    HZ3  LYS  41           2HZ      LYS  41  -1.104   3.934  11.358
  306    H    ASP  42           H        ASP  42   3.889   4.343  13.298
  307    HA   ASP  42           HA       ASP  42   2.857   1.900  12.394
  308    HB2  ASP  42           2HB      ASP  42   3.780   3.638  10.917
  309    HB3  ASP  42           1HB      ASP  42   5.395   3.302  11.535
  310    H    VAL  43           H        VAL  43   5.837   2.633  14.130
  311    HA   VAL  43           HA       VAL  43   7.141   0.188  13.882
  312    HB   VAL  43           HB       VAL  43   7.091   1.988  16.318
  313   HG11  VAL  43          1HG1      VAL  43   7.958  -0.225  16.854
  314   HG12  VAL  43          2HG1      VAL  43   9.252   0.971  16.865
  315   HG13  VAL  43          3HG1      VAL  43   9.080  -0.127  15.497
  316   HG21  VAL  43          3HG2      VAL  43   9.149   2.938  15.387
  317   HG22  VAL  43          1HG2      VAL  43   7.780   3.171  14.300
  318   HG23  VAL  43          2HG2      VAL  43   8.974   1.919  13.961
  319    H    LEU  44           H        LEU  44   4.715   1.177  16.293
  320    HA   LEU  44           HA       LEU  44   4.712  -1.353  17.627
  321    HB2  LEU  44           2HB      LEU  44   2.694   0.896  17.694
  322    HB3  LEU  44           1HB      LEU  44   2.695  -0.487  18.772
  323    HG   LEU  44           HG       LEU  44   4.859   1.613  18.614
  324   HD11  LEU  44          1HD1      LEU  44   2.782   2.444  19.601
  325   HD12  LEU  44          2HD1      LEU  44   4.057   2.293  20.810
  326   HD13  LEU  44          3HD1      LEU  44   2.773   1.087  20.726
  327   HD21  LEU  44          3HD2      LEU  44   5.778   0.518  20.588
  328   HD22  LEU  44          1HD2      LEU  44   5.734  -0.589  19.215
  329   HD23  LEU  44          2HD2      LEU  44   4.525  -0.721  20.494
  330    H    ASP  45           H        ASP  45   2.761   0.189  15.167
  331    HA   ASP  45           HA       ASP  45   0.687  -1.692  14.982
  332    HB2  ASP  45           2HB      ASP  45   0.497   0.508  13.994
  333    HB3  ASP  45           1HB      ASP  45   1.858   0.192  12.925
  334    H    SER  46           H        SER  46   3.917  -1.643  13.683
  335    HA   SER  46           HA       SER  46   3.433  -3.804  11.840
  336    HB2  SER  46           2HB      SER  46   5.077  -1.916  11.447
  337    HB3  SER  46           1HB      SER  46   6.103  -2.655  12.675
  338    HG   SER  46           HG       SER  46   5.671  -3.374  10.069
  339    H    VAL  47           H        VAL  47   4.925  -3.400  15.024
  340    HA   VAL  47           HA       VAL  47   6.074  -6.036  14.988
  341    HB   VAL  47           HB       VAL  47   7.143  -4.143  16.175
  342   HG11  VAL  47          1HG1      VAL  47   6.323  -3.492  18.397
  343   HG12  VAL  47          2HG1      VAL  47   4.873  -4.461  18.134
  344   HG13  VAL  47          3HG1      VAL  47   5.192  -3.058  17.115
  345   HG21  VAL  47          3HG2      VAL  47   6.459  -6.514  17.909
  346   HG22  VAL  47          1HG2      VAL  47   7.812  -5.411  18.163
  347   HG23  VAL  47          2HG2      VAL  47   7.760  -6.426  16.723
  348    H    LEU  48           H        LEU  48   3.085  -4.654  16.121
  349    HA   LEU  48           HA       LEU  48   2.405  -7.264  17.307
  350    HB2  LEU  48           2HB      LEU  48   1.394  -4.537  18.117
  351    HB3  LEU  48           1HB      LEU  48   0.824  -6.058  18.777
  352    HG   LEU  48           HG       LEU  48   3.626  -4.965  19.046
  353   HD11  LEU  48          1HD1      LEU  48   1.404  -5.243  21.064
  354   HD12  LEU  48          2HD1      LEU  48   2.006  -3.732  20.380
  355   HD13  LEU  48          3HD1      LEU  48   3.051  -4.713  21.409
  356   HD21  LEU  48          3HD2      LEU  48   3.983  -6.836  20.577
  357   HD22  LEU  48          1HD2      LEU  48   3.604  -7.399  18.949
  358   HD23  LEU  48          2HD2      LEU  48   2.370  -7.446  20.207
  Start of MODEL    5
    1    H1   SER   1           1HT      SER   1   6.017  -2.851  21.655
    2    H2   SER   1           2HT      SER   1   6.072  -4.531  21.459
    3    H3   SER   1           3HT      SER   1   6.871  -3.523  20.362
    4    HA   SER   1           HA       SER   1   7.545  -3.850  23.221
    5    HB2  SER   1           2HB      SER   1   9.151  -4.642  20.779
    6    HB3  SER   1           1HB      SER   1   9.497  -5.031  22.465
    7    HG   SER   1           HG       SER   1   8.052  -6.587  22.427
    8    H    SER   2           H        SER   2   8.489  -2.097  24.046
    9    HA   SER   2           HA       SER   2   9.262   0.129  22.463
   10    HB2  SER   2           2HB      SER   2   9.964  -0.477  25.342
   11    HB3  SER   2           1HB      SER   2  10.048   1.100  24.556
   12    HG   SER   2           HG       SER   2   8.099   1.219  25.413
   13    H    LEU   3           H        LEU   3  10.820  -0.142  21.050
   14    HA   LEU   3           HA       LEU   3  13.207  -1.589  21.509
   15    HB2  LEU   3           2HB      LEU   3  12.639   0.624  19.533
   16    HB3  LEU   3           1HB      LEU   3  14.026  -0.449  19.486
   17    HG   LEU   3           HG       LEU   3  11.143  -1.288  19.146
   18   HD11  LEU   3          1HD1      LEU   3  11.975  -0.021  17.242
   19   HD12  LEU   3          2HD1      LEU   3  11.781  -1.725  16.827
   20   HD13  LEU   3          3HD1      LEU   3  13.389  -1.072  17.146
   21   HD21  LEU   3          3HD2      LEU   3  12.078  -3.472  18.537
   22   HD22  LEU   3          1HD2      LEU   3  12.476  -3.036  20.199
   23   HD23  LEU   3          2HD2      LEU   3  13.694  -2.890  18.934
   24    H    LEU   4           H        LEU   4  15.332  -0.665  21.695
   25    HA   LEU   4           HA       LEU   4  15.608   0.925  23.937
   26    HB2  LEU   4           2HB      LEU   4  17.587   0.331  21.748
   27    HB3  LEU   4           1HB      LEU   4  18.011   1.213  23.199
   28    HG   LEU   4           HG       LEU   4  18.724  -1.015  23.536
   29   HD11  LEU   4          1HD1      LEU   4  16.112  -0.608  24.972
   30   HD12  LEU   4          2HD1      LEU   4  17.700  -0.032  25.483
   31   HD13  LEU   4          3HD1      LEU   4  17.361  -1.763  25.434
   32   HD21  LEU   4          3HD2      LEU   4  15.964  -1.914  22.712
   33   HD22  LEU   4          1HD2      LEU   4  17.244  -2.961  23.325
   34   HD23  LEU   4          2HD2      LEU   4  17.454  -2.122  21.788
   35    H    GLU   5           H        GLU   5  16.030   1.887  20.531
   36    HA   GLU   5           HA       GLU   5  16.767   4.543  21.064
   37    HB2  GLU   5           2HB      GLU   5  15.437   3.336  18.640
   38    HB3  GLU   5           1HB      GLU   5  16.057   4.980  18.704
   39    HG2  GLU   5           2HG      GLU   5  18.300   4.135  19.101
   40    HG3  GLU   5           1HG      GLU   5  17.689   2.479  19.092
   41    H    LYS   6           H        LYS   6  13.586   3.397  19.901
   42    HA   LYS   6           HA       LYS   6  12.379   5.930  20.279
   43    HB2  LYS   6           2HB      LYS   6  11.437   3.234  19.496
   44    HB3  LYS   6           1HB      LYS   6  10.227   4.313  20.176
   45    HG2  LYS   6           2HG      LYS   6  10.099   4.638  17.869
   46    HG3  LYS   6           1HG      LYS   6  11.008   6.023  18.467
   47    HD2  LYS   6           2HD      LYS   6  13.105   4.873  17.823
   48    HD3  LYS   6           1HD      LYS   6  12.143   3.559  17.139
   49    HE2  LYS   6           2HE      LYS   6  11.007   5.317  15.712
   50    HE3  LYS   6           1HE      LYS   6  12.258   6.432  16.253
   51    HZ1  LYS   6           3HZ      LYS   6  13.928   4.925  15.311
   52    HZ2  LYS   6           1HZ      LYS   6  12.836   5.477  14.134
   53    HZ3  LYS   6           2HZ      LYS   6  12.691   3.907  14.753
   54    H    GLY   7           H        GLY   7  12.686   3.122  22.347
   55    HA2  GLY   7           2HA      GLY   7  10.553   3.936  24.104
   56    HA3  GLY   7           1HA      GLY   7  11.648   2.586  24.344
   57    H    LEU   8           H        LEU   8  14.082   4.137  24.170
   58    HA   LEU   8           HA       LEU   8  13.936   5.248  26.872
   59    HB2  LEU   8           2HB      LEU   8  15.551   3.413  26.310
   60    HB3  LEU   8           1HB      LEU   8  16.387   4.538  25.260
   61    HG   LEU   8           HG       LEU   8  16.025   5.249  28.146
   62   HD11  LEU   8          1HD1      LEU   8  18.096   4.074  28.684
   63   HD12  LEU   8          2HD1      LEU   8  18.141   3.400  27.054
   64   HD13  LEU   8          3HD1      LEU   8  16.841   2.948  28.158
   65   HD21  LEU   8          3HD2      LEU   8  16.982   6.895  26.597
   66   HD22  LEU   8          1HD2      LEU   8  18.230   5.738  26.143
   67   HD23  LEU   8          2HD2      LEU   8  18.171   6.368  27.788
   68    H    ASP   9           H        ASP   9  15.269   6.083  23.662
   69    HA   ASP   9           HA       ASP   9  15.861   8.765  24.635
   70    HB2  ASP   9           2HB      ASP   9  17.526   7.689  23.215
   71    HB3  ASP   9           1HB      ASP   9  16.340   7.505  21.925
   72    H    GLY  10           H        GLY  10  13.953   7.314  22.005
   73    HA2  GLY  10           2HA      GLY  10  12.898   9.713  21.007
   74    HA3  GLY  10           1HA      GLY  10  12.201   8.121  20.768
   75    H    ALA  11           H        ALA  11  11.843   7.745  23.690
   76    HA   ALA  11           HA       ALA  11   9.202   8.780  23.847
   77    HB1  ALA  11           1HB      ALA  11   9.832   6.630  24.837
   78    HB2  ALA  11           2HB      ALA  11   9.104   7.708  26.028
   79    HB3  ALA  11           3HB      ALA  11  10.851   7.470  26.006
   80    H    LYS  12           H        LYS  12  12.159  10.234  24.495
   81    HA   LYS  12           HA       LYS  12  11.229  11.844  26.709
   82    HB2  LYS  12           2HB      LYS  12  13.789  11.770  25.147
   83    HB3  LYS  12           1HB      LYS  12  13.448  13.066  26.284
   84    HG2  LYS  12           2HG      LYS  12  13.067  11.260  28.017
   85    HG3  LYS  12           1HG      LYS  12  13.760  10.133  26.847
   86    HD2  LYS  12           2HD      LYS  12  15.176  12.642  27.716
   87    HD3  LYS  12           1HD      LYS  12  15.347  11.113  28.581
   88    HE2  LYS  12           2HE      LYS  12  15.889  11.417  25.635
   89    HE3  LYS  12           1HE      LYS  12  17.129  11.618  26.872
   90    HZ1  LYS  12           3HZ      LYS  12  15.571   9.160  26.284
   91    HZ2  LYS  12           1HZ      LYS  12  16.579   9.337  27.635
   92    HZ3  LYS  12           2HZ      LYS  12  17.239   9.400  26.080
   93    H    LYS  13           H        LYS  13  10.438  11.897  23.586
   94    HA   LYS  13           HA       LYS  13  10.692  14.506  22.684
   95    HB2  LYS  13           2HB      LYS  13   8.556  12.431  22.326
   96    HB3  LYS  13           1HB      LYS  13   8.348  14.037  21.648
   97    HG2  LYS  13           2HG      LYS  13  10.351  13.764  20.312
   98    HG3  LYS  13           1HG      LYS  13  10.641  12.181  21.041
   99    HD2  LYS  13           2HD      LYS  13   8.687  11.268  20.041
  100    HD3  LYS  13           1HD      LYS  13   8.113  12.863  19.556
  101    HE2  LYS  13           2HE      LYS  13  10.598  11.513  18.503
  102    HE3  LYS  13           1HE      LYS  13   9.042  11.562  17.675
  103    HZ1  LYS  13           3HZ      LYS  13   9.864  13.399  16.732
  104    HZ2  LYS  13           1HZ      LYS  13  11.064  13.611  17.918
  105    HZ3  LYS  13           2HZ      LYS  13   9.485  14.163  18.199
  106    H    ALA  14           H        ALA  14   8.118  13.136  24.713
  107    HA   ALA  14           HA       ALA  14   6.889  15.731  25.061
  108    HB1  ALA  14           1HB      ALA  14   5.491  13.746  24.829
  109    HB2  ALA  14           2HB      ALA  14   5.229  14.522  26.390
  110    HB3  ALA  14           3HB      ALA  14   6.208  13.060  26.286
  111    H    VAL  15           H        VAL  15   9.348  13.979  26.551
  112    HA   VAL  15           HA       VAL  15   8.874  14.950  29.234
  113    HB   VAL  15           HB       VAL  15  11.296  13.510  28.133
  114   HG11  VAL  15          1HG1      VAL  15  11.783  12.999  30.483
  115   HG12  VAL  15          2HG1      VAL  15  10.409  13.990  30.976
  116   HG13  VAL  15          3HG1      VAL  15  11.793  14.735  30.176
  117   HG21  VAL  15          3HG2      VAL  15   9.304  12.139  27.907
  118   HG22  VAL  15          1HG2      VAL  15   8.892  12.426  29.597
  119   HG23  VAL  15          2HG2      VAL  15  10.339  11.507  29.186
  120    H    GLY  16           H        GLY  16  11.450  15.362  26.797
  121    HA2  GLY  16           2HA      GLY  16  11.935  18.045  27.923
  122    HA3  GLY  16           1HA      GLY  16  13.273  16.941  27.637
  123    H    GLY  17           H        GLY  17  10.393  17.775  25.726
  124    HA2  GLY  17           2HA      GLY  17  12.218  18.448  23.505
  125    HA3  GLY  17           1HA      GLY  17  10.614  17.763  23.289
  126    H    LEU  18           H        LEU  18   8.934  19.225  24.659
  127    HA   LEU  18           HA       LEU  18   8.638  21.523  23.096
  128    HB2  LEU  18           2HB      LEU  18   6.708  22.037  24.420
  129    HB3  LEU  18           1HB      LEU  18   6.770  20.310  24.147
  130    HG   LEU  18           HG       LEU  18   7.712  21.575  26.721
  131   HD11  LEU  18          1HD1      LEU  18   5.540  20.967  27.661
  132   HD12  LEU  18          2HD1      LEU  18   4.986  20.461  26.065
  133   HD13  LEU  18          3HD1      LEU  18   5.370  22.157  26.368
  134   HD21  LEU  18          3HD2      LEU  18   6.888  18.758  26.005
  135   HD22  LEU  18          1HD2      LEU  18   7.336  19.316  27.617
  136   HD23  LEU  18          2HD2      LEU  18   8.531  19.315  26.321
  137    H    GLY  19           H        GLY  19  10.250  21.076  26.140
  138    HA2  GLY  19           2HA      GLY  19  10.512  23.999  26.419
  139    HA3  GLY  19           1HA      GLY  19  10.713  22.842  27.727
  140    H    LYS  20           H        LYS  20  12.078  22.232  24.585
  141    HA   LYS  20           HA       LYS  20  14.725  23.117  25.450
  142    HB2  LYS  20           2HB      LYS  20  14.397  20.750  26.203
  143    HB3  LYS  20           1HB      LYS  20  14.173  20.293  24.521
  144    HG2  LYS  20           2HG      LYS  20  16.456  21.090  24.031
  145    HG3  LYS  20           1HG      LYS  20  16.666  21.449  25.747
  146    HD2  LYS  20           2HD      LYS  20  16.198  19.065  26.253
  147    HD3  LYS  20           1HD      LYS  20  16.145  18.744  24.520
  148    HE2  LYS  20           2HE      LYS  20  18.318  18.144  25.327
  149    HE3  LYS  20           1HE      LYS  20  18.475  19.605  24.353
  150    HZ1  LYS  20           3HZ      LYS  20  19.759  19.664  26.442
  151    HZ2  LYS  20           1HZ      LYS  20  18.310  19.580  27.319
  152    HZ3  LYS  20           2HZ      LYS  20  18.626  20.923  26.332
  153    H    LEU  21           H        LEU  21  15.403  24.350  23.819
  154    HA   LEU  21           HA       LEU  21  14.207  24.398  21.276
  155    HB2  LEU  21           2HB      LEU  21  16.710  25.591  22.395
  156    HB3  LEU  21           1HB      LEU  21  16.412  25.676  20.672
  157    HG   LEU  21           HG       LEU  21  14.231  26.806  21.178
  158   HD11  LEU  21          1HD1      LEU  21  15.380  26.989  23.958
  159   HD12  LEU  21          2HD1      LEU  21  13.968  26.045  23.483
  160   HD13  LEU  21          3HD1      LEU  21  13.930  27.804  23.373
  161   HD21  LEU  21          3HD2      LEU  21  15.263  28.973  21.670
  162   HD22  LEU  21          1HD2      LEU  21  16.182  28.059  20.472
  163   HD23  LEU  21          2HD2      LEU  21  16.750  28.149  22.139
  164    H    GLY  22           H        GLY  22  17.203  22.872  22.378
  165    HA2  GLY  22           2HA      GLY  22  18.072  22.021  19.816
  166    HA3  GLY  22           1HA      GLY  22  18.609  21.374  21.357
  167    H    LYS  23           H        LYS  23  15.397  21.023  21.521
  168    HA   LYS  23           HA       LYS  23  15.475  18.354  20.278
  169    HB2  LYS  23           2HB      LYS  23  14.927  19.053  22.914
  170    HB3  LYS  23           1HB      LYS  23  13.340  18.780  22.212
  171    HG2  LYS  23           2HG      LYS  23  15.635  16.839  22.248
  172    HG3  LYS  23           1HG      LYS  23  14.168  16.754  23.220
  173    HD2  LYS  23           2HD      LYS  23  12.836  16.501  21.177
  174    HD3  LYS  23           1HD      LYS  23  14.311  16.578  20.209
  175    HE2  LYS  23           2HE      LYS  23  13.691  14.495  22.299
  176    HE3  LYS  23           1HE      LYS  23  13.546  14.272  20.557
  177    HZ1  LYS  23           3HZ      LYS  23  15.899  14.571  20.319
  178    HZ2  LYS  23           1HZ      LYS  23  15.626  13.378  21.486
  179    HZ3  LYS  23           2HZ      LYS  23  16.084  14.944  21.959
  180    H    ASP  24           H        ASP  24  13.350  21.085  21.036
  181    HA   ASP  24           HA       ASP  24  11.136  20.271  19.537
  182    HB2  ASP  24           2HB      ASP  24  10.970  22.040  21.181
  183    HB3  ASP  24           1HB      ASP  24  12.090  23.046  20.264
  184    H    ALA  25           H        ALA  25  14.020  22.051  18.597
  185    HA   ALA  25           HA       ALA  25  13.092  23.079  16.168
  186    HB1  ALA  25           1HB      ALA  25  15.921  22.333  16.879
  187    HB2  ALA  25           2HB      ALA  25  15.123  23.850  17.295
  188    HB3  ALA  25           3HB      ALA  25  15.413  23.442  15.605
  189    H    VAL  26           H        VAL  26  14.403  19.889  16.921
  190    HA   VAL  26           HA       VAL  26  14.808  19.245  14.146
  191    HB   VAL  26           HB       VAL  26  16.168  18.241  15.996
  192   HG11  VAL  26          1HG1      VAL  26  13.694  16.587  16.479
  193   HG12  VAL  26          2HG1      VAL  26  14.408  17.755  17.591
  194   HG13  VAL  26          3HG1      VAL  26  15.286  16.284  17.174
  195   HG21  VAL  26          3HG2      VAL  26  16.285  16.007  14.972
  196   HG22  VAL  26          1HG2      VAL  26  16.220  17.302  13.775
  197   HG23  VAL  26          2HG2      VAL  26  14.779  16.342  14.115
  198    H    GLU  27           H        GLU  27  12.222  18.977  16.440
  199    HA   GLU  27           HA       GLU  27  10.758  16.983  14.997
  200    HB2  GLU  27           2HB      GLU  27   9.843  18.892  17.154
  201    HB3  GLU  27           1HB      GLU  27   8.886  17.563  16.515
  202    HG2  GLU  27           2HG      GLU  27  10.761  16.037  17.258
  203    HG3  GLU  27           1HG      GLU  27  11.409  17.425  18.131
  204    H    ASP  28           H        ASP  28  11.268  20.289  14.574
  205    HA   ASP  28           HA       ASP  28   8.846  21.186  13.509
  206    HB2  ASP  28           2HB      ASP  28  10.712  22.690  14.015
  207    HB3  ASP  28           1HB      ASP  28  11.667  21.955  12.732
  208    H    LEU  29           H        LEU  29  11.508  19.432  12.008
  209    HA   LEU  29           HA       LEU  29  10.504  19.604   9.348
  210    HB2  LEU  29           2HB      LEU  29  12.867  19.267   9.786
  211    HB3  LEU  29           1HB      LEU  29  12.530  17.748  10.593
  212    HG   LEU  29           HG       LEU  29  11.688  16.841   8.427
  213   HD11  LEU  29          1HD1      LEU  29  12.787  19.417   7.309
  214   HD12  LEU  29          2HD1      LEU  29  11.087  18.949   7.359
  215   HD13  LEU  29          3HD1      LEU  29  12.225  18.038   6.364
  216   HD21  LEU  29          3HD2      LEU  29  13.970  16.409   9.190
  217   HD22  LEU  29          1HD2      LEU  29  14.518  17.880   8.388
  218   HD23  LEU  29          2HD2      LEU  29  13.891  16.537   7.434
  219    H    GLU  30           H        GLU  30  10.384  17.092  11.853
  220    HA   GLU  30           HA       GLU  30   9.123  15.195  10.139
  221    HB2  GLU  30           2HB      GLU  30   8.756  13.910  12.265
  222    HB3  GLU  30           1HB      GLU  30  10.427  14.337  11.933
  223    HG2  GLU  30           2HG      GLU  30  10.262  16.195  13.515
  224    HG3  GLU  30           1HG      GLU  30   8.589  15.752  13.851
  225    H    SER  31           H        SER  31   7.950  17.636  12.356
  226    HA   SER  31           HA       SER  31   5.302  16.638  12.557
  227    HB2  SER  31           2HB      SER  31   6.247  18.201  14.204
  228    HB3  SER  31           1HB      SER  31   6.319  19.460  12.971
  229    HG   SER  31           HG       SER  31   4.303  18.893  14.557
  230    H    VAL  32           H        VAL  32   6.776  19.148  10.501
  231    HA   VAL  32           HA       VAL  32   4.353  19.997   9.326
  232    HB   VAL  32           HB       VAL  32   6.458  21.332   9.355
  233   HG11  VAL  32          1HG1      VAL  32   7.315  19.471   7.145
  234   HG12  VAL  32          2HG1      VAL  32   8.045  19.595   8.747
  235   HG13  VAL  32          3HG1      VAL  32   8.145  20.951   7.623
  236   HG21  VAL  32          3HG2      VAL  32   5.202  20.907   6.647
  237   HG22  VAL  32          1HG2      VAL  32   6.175  22.304   7.108
  238   HG23  VAL  32          2HG2      VAL  32   4.636  21.997   7.910
  239    H    GLY  33           H        GLY  33   6.375  17.275   8.704
  240    HA2  GLY  33           2HA      GLY  33   5.111  16.845   6.088
  241    HA3  GLY  33           1HA      GLY  33   6.561  16.040   6.661
  242    H    LYS  34           H        LYS  34   4.163  16.250   9.029
  243    HA   LYS  34           HA       LYS  34   2.723  14.796  10.003
  244    HB2  LYS  34           2HB      LYS  34   2.526  13.547   7.257
  245    HB3  LYS  34           1HB      LYS  34   1.428  13.260   8.599
  246    HG2  LYS  34           2HG      LYS  34   0.744  15.601   8.553
  247    HG3  LYS  34           1HG      LYS  34   1.851  15.898   7.210
  248    HD2  LYS  34           2HD      LYS  34  -0.355  15.596   6.320
  249    HD3  LYS  34           1HD      LYS  34   0.613  14.183   5.897
  250    HE2  LYS  34           2HE      LYS  34  -1.509  13.382   6.611
  251    HE3  LYS  34           1HE      LYS  34  -0.361  13.030   7.902
  252    HZ1  LYS  34           3HZ      LYS  34  -1.155  15.038   9.056
  253    HZ2  LYS  34           1HZ      LYS  34  -2.391  13.899   8.816
  254    HZ3  LYS  34           2HZ      LYS  34  -2.306  15.278   7.834
  255    H    GLY  35           H        GLY  35   5.702  14.034   9.241
  256    HA2  GLY  35           2HA      GLY  35   5.685  11.164   9.384
  257    HA3  GLY  35           1HA      GLY  35   7.097  12.207   9.479
  258    H    ALA  36           H        ALA  36   5.851  13.778  11.654
  259    HA   ALA  36           HA       ALA  36   7.062  12.540  13.838
  260    HB1  ALA  36           1HB      ALA  36   4.874  14.614  13.885
  261    HB2  ALA  36           2HB      ALA  36   6.596  14.945  13.697
  262    HB3  ALA  36           3HB      ALA  36   5.991  14.244  15.198
  263    H    VAL  37           H        VAL  37   3.690  12.514  12.794
  264    HA   VAL  37           HA       VAL  37   2.904  10.944  15.105
  265    HB   VAL  37           HB       VAL  37   1.388  12.699  14.304
  266   HG11  VAL  37          1HG1      VAL  37   1.904  12.627  11.936
  267   HG12  VAL  37          2HG1      VAL  37   0.170  12.433  12.195
  268   HG13  VAL  37          3HG1      VAL  37   1.168  11.033  11.804
  269   HG21  VAL  37          3HG2      VAL  37  -0.687  11.360  14.208
  270   HG22  VAL  37          1HG2      VAL  37   0.409  10.828  15.484
  271   HG23  VAL  37          2HG2      VAL  37   0.289   9.907  13.987
  272    H    HIS  38           H        HIS  38   3.718  10.455  11.762
  273    HA   HIS  38           HA       HIS  38   2.343   7.937  11.541
  274    HB2  HIS  38           2HB      HIS  38   2.806   9.585   9.639
  275    HB3  HIS  38           1HB      HIS  38   4.459   8.985   9.668
  276    HD1  HIS  38           1HD      HIS  38   4.566   6.193   9.366
  277    HD2  HIS  38           2HD      HIS  38   1.218   8.227   7.944
  278    HE1  HIS  38           1HE      HIS  38   3.485   4.653   7.704
  279    HE2  HIS  38           2HE      HIS  38   1.592   5.982   6.707
  280    H    ASP  39           H        ASP  39   5.742   8.975  11.739
  281    HA   ASP  39           HA       ASP  39   6.944   6.521  11.232
  282    HB2  ASP  39           2HB      ASP  39   8.098   8.733  11.282
  283    HB3  ASP  39           1HB      ASP  39   8.030   8.689  13.040
  284    H    VAL  40           H        VAL  40   6.077   7.947  14.357
  285    HA   VAL  40           HA       VAL  40   7.157   5.878  15.937
  286    HB   VAL  40           HB       VAL  40   6.664   8.115  16.828
  287   HG11  VAL  40          1HG1      VAL  40   4.382   8.769  17.398
  288   HG12  VAL  40          2HG1      VAL  40   3.765   7.316  16.610
  289   HG13  VAL  40          3HG1      VAL  40   4.577   8.558  15.657
  290   HG21  VAL  40          3HG2      VAL  40   5.683   7.413  18.975
  291   HG22  VAL  40          1HG2      VAL  40   6.910   6.287  18.394
  292   HG23  VAL  40          2HG2      VAL  40   5.200   5.885  18.236
  293    H    LYS  41           H        LYS  41   4.128   6.197  14.248
  294    HA   LYS  41           HA       LYS  41   2.909   4.028  15.757
  295    HB2  LYS  41           2HB      LYS  41   1.830   5.660  13.454
  296    HB3  LYS  41           1HB      LYS  41   0.915   4.475  14.376
  297    HG2  LYS  41           2HG      LYS  41   2.118   7.011  15.468
  298    HG3  LYS  41           1HG      LYS  41   0.412   6.739  15.102
  299    HD2  LYS  41           2HD      LYS  41   0.249   5.062  16.800
  300    HD3  LYS  41           1HD      LYS  41   1.993   5.091  17.063
  301    HE2  LYS  41           2HE      LYS  41   0.856   6.302  18.824
  302    HE3  LYS  41           1HE      LYS  41   1.832   7.399  17.851
  303    HZ1  LYS  41           3HZ      LYS  41  -1.096   7.016  17.531
  304    HZ2  LYS  41           1HZ      LYS  41  -0.133   8.153  16.726
  305    HZ3  LYS  41           2HZ      LYS  41  -0.379   8.281  18.396
  306    H    ASP  42           H        ASP  42   4.954   4.304  13.149
  307    HA   ASP  42           HA       ASP  42   3.954   2.264  11.450
  308    HB2  ASP  42           2HB      ASP  42   6.623   3.589  11.792
  309    HB3  ASP  42           1HB      ASP  42   6.488   2.151  10.787
  310    H    VAL  43           H        VAL  43   6.105   2.272  14.229
  311    HA   VAL  43           HA       VAL  43   6.845  -0.466  13.911
  312    HB   VAL  43           HB       VAL  43   8.389   1.034  15.005
  313   HG11  VAL  43          1HG1      VAL  43   7.979   1.966  17.218
  314   HG12  VAL  43          2HG1      VAL  43   6.341   1.316  17.197
  315   HG13  VAL  43          3HG1      VAL  43   6.806   2.569  16.047
  316   HG21  VAL  43          3HG2      VAL  43   8.907  -0.287  17.008
  317   HG22  VAL  43          1HG2      VAL  43   8.509  -1.301  15.620
  318   HG23  VAL  43          2HG2      VAL  43   7.322  -1.050  16.899
  319    H    LEU  44           H        LEU  44   4.537   1.247  16.018
  320    HA   LEU  44           HA       LEU  44   3.804  -1.218  17.311
  321    HB2  LEU  44           2HB      LEU  44   2.098   0.173  18.498
  322    HB3  LEU  44           1HB      LEU  44   3.765   0.646  18.738
  323    HG   LEU  44           HG       LEU  44   2.917   2.245  16.623
  324   HD11  LEU  44          1HD1      LEU  44   0.755   2.053  18.718
  325   HD12  LEU  44          2HD1      LEU  44   0.603   1.617  17.015
  326   HD13  LEU  44          3HD1      LEU  44   0.870   3.299  17.477
  327   HD21  LEU  44          3HD2      LEU  44   3.034   2.850  19.578
  328   HD22  LEU  44          1HD2      LEU  44   3.062   4.043  18.281
  329   HD23  LEU  44          2HD2      LEU  44   4.393   2.898  18.455
  330    H    ASP  45           H        ASP  45   3.300  -2.271  15.357
  331    HA   ASP  45           HA       ASP  45   0.468  -2.509  15.070
  332    HB2  ASP  45           2HB      ASP  45   0.823  -0.697  13.447
  333    HB3  ASP  45           1HB      ASP  45   2.069  -1.649  12.641
  334    H    SER  46           H        SER  46   3.515  -3.197  13.400
  335    HA   SER  46           HA       SER  46   2.899  -6.017  13.243
  336    HB2  SER  46           2HB      SER  46   4.228  -4.823  11.469
  337    HB3  SER  46           1HB      SER  46   5.525  -4.619  12.647
  338    HG   SER  46           HG       SER  46   4.509  -7.196  12.268
  339    H    VAL  47           H        VAL  47   5.169  -3.893  14.935
  340    HA   VAL  47           HA       VAL  47   5.736  -6.013  16.877
  341    HB   VAL  47           HB       VAL  47   7.020  -3.278  16.698
  342   HG11  VAL  47          1HG1      VAL  47   7.838  -5.784  18.160
  343   HG12  VAL  47          2HG1      VAL  47   7.194  -4.313  18.887
  344   HG13  VAL  47          3HG1      VAL  47   8.766  -4.286  18.090
  345   HG21  VAL  47          3HG2      VAL  47   8.042  -5.906  15.624
  346   HG22  VAL  47          1HG2      VAL  47   8.907  -4.369  15.613
  347   HG23  VAL  47          2HG2      VAL  47   7.441  -4.562  14.651
  348    H    LEU  48           H        LEU  48   3.924  -6.049  18.140
  349    HA   LEU  48           HA       LEU  48   2.567  -3.686  18.966
  350    HB2  LEU  48           2HB      LEU  48   1.490  -5.926  18.686
  351    HB3  LEU  48           1HB      LEU  48   2.342  -6.469  20.119
  352    HG   LEU  48           HG       LEU  48   1.141  -4.794  21.463
  353   HD11  LEU  48          1HD1      LEU  48  -0.322  -4.188  18.895
  354   HD12  LEU  48          2HD1      LEU  48   0.806  -3.113  19.723
  355   HD13  LEU  48          3HD1      LEU  48  -0.723  -3.549  20.490
  356   HD21  LEU  48          3HD2      LEU  48   0.221  -7.040  21.253
  357   HD22  LEU  48          1HD2      LEU  48  -0.647  -6.563  19.794
  358   HD23  LEU  48          2HD2      LEU  48  -1.074  -5.847  21.348
  Start of MODEL    6
    1    H1   SER   1           1HT      SER   1  16.683   7.683 -29.282
    2    H2   SER   1           2HT      SER   1  16.210   6.626 -30.523
    3    H3   SER   1           3HT      SER   1  17.553   6.255 -29.560
    4    HA   SER   1           HA       SER   1  15.610   4.947 -28.951
    5    HB2  SER   1           2HB      SER   1  16.391   6.970 -26.837
    6    HB3  SER   1           1HB      SER   1  15.809   5.327 -26.565
    7    HG   SER   1           HG       SER   1  18.144   5.625 -26.437
    8    H    SER   2           H        SER   2  13.460   4.868 -28.271
    9    HA   SER   2           HA       SER   2  11.908   7.041 -27.461
   10    HB2  SER   2           2HB      SER   2  12.330   7.856 -29.790
   11    HB3  SER   2           1HB      SER   2  11.533   6.408 -30.401
   12    HG   SER   2           HG       SER   2   9.901   7.820 -30.324
   13    H    LEU   3           H        LEU   3  10.301   6.099 -26.393
   14    HA   LEU   3           HA       LEU   3   9.342   3.467 -27.119
   15    HB2  LEU   3           2HB      LEU   3   8.537   5.439 -24.977
   16    HB3  LEU   3           1HB      LEU   3   7.644   3.959 -25.263
   17    HG   LEU   3           HG       LEU   3   9.775   2.695 -24.785
   18   HD11  LEU   3          1HD1      LEU   3  11.370   4.494 -25.161
   19   HD12  LEU   3          2HD1      LEU   3  11.515   3.853 -23.523
   20   HD13  LEU   3          3HD1      LEU   3  10.693   5.388 -23.801
   21   HD21  LEU   3          3HD2      LEU   3   8.002   2.862 -23.146
   22   HD22  LEU   3          1HD2      LEU   3   8.609   4.429 -22.611
   23   HD23  LEU   3          2HD2      LEU   3   9.570   2.975 -22.350
   24    H    LEU   4           H        LEU   4   8.321   6.793 -27.245
   25    HA   LEU   4           HA       LEU   4   6.658   6.437 -29.503
   26    HB2  LEU   4           2HB      LEU   4   5.241   5.574 -27.531
   27    HB3  LEU   4           1HB      LEU   4   5.192   7.241 -26.992
   28    HG   LEU   4           HG       LEU   4   4.098   7.886 -29.102
   29   HD11  LEU   4          1HD1      LEU   4   4.993   6.171 -30.564
   30   HD12  LEU   4          2HD1      LEU   4   3.229   6.135 -30.589
   31   HD13  LEU   4          3HD1      LEU   4   4.123   4.922 -29.670
   32   HD21  LEU   4          3HD2      LEU   4   2.727   5.637 -27.632
   33   HD22  LEU   4          1HD2      LEU   4   1.933   6.851 -28.641
   34   HD23  LEU   4          2HD2      LEU   4   2.747   7.335 -27.152
   35    H    GLU   5           H        GLU   5   5.538   8.656 -29.935
   36    HA   GLU   5           HA       GLU   5   7.560  10.520 -30.125
   37    HB2  GLU   5           2HB      GLU   5   5.378  12.128 -30.375
   38    HB3  GLU   5           1HB      GLU   5   6.066  11.149 -31.655
   39    HG2  GLU   5           2HG      GLU   5   3.750  10.792 -31.711
   40    HG3  GLU   5           1HG      GLU   5   4.442   9.341 -31.008
   41    H    LYS   6           H        LYS   6   4.795  10.700 -27.856
   42    HA   LYS   6           HA       LYS   6   6.501  12.440 -26.188
   43    HB2  LYS   6           2HB      LYS   6   4.365  13.084 -25.034
   44    HB3  LYS   6           1HB      LYS   6   4.487  13.603 -26.707
   45    HG2  LYS   6           2HG      LYS   6   3.024  11.827 -27.413
   46    HG3  LYS   6           1HG      LYS   6   2.977  11.172 -25.774
   47    HD2  LYS   6           2HD      LYS   6   1.748  13.003 -24.964
   48    HD3  LYS   6           1HD      LYS   6   2.117  13.985 -26.383
   49    HE2  LYS   6           2HE      LYS   6   0.449  11.477 -26.431
   50    HE3  LYS   6           1HE      LYS   6  -0.209  13.111 -26.331
   51    HZ1  LYS   6           3HZ      LYS   6   0.917  13.611 -28.443
   52    HZ2  LYS   6           1HZ      LYS   6  -0.227  12.372 -28.602
   53    HZ3  LYS   6           2HZ      LYS   6   1.426  11.999 -28.554
   54    H    GLY   7           H        GLY   7   5.684   9.340 -26.549
   55    HA2  GLY   7           2HA      GLY   7   5.148   8.560 -23.844
   56    HA3  GLY   7           1HA      GLY   7   5.623   7.495 -25.160
   57    H    LEU   8           H        LEU   8   8.018   9.042 -25.782
   58    HA   LEU   8           HA       LEU   8   9.867   7.745 -24.110
   59    HB2  LEU   8           2HB      LEU   8  10.356   8.507 -26.409
   60    HB3  LEU   8           1HB      LEU   8  10.298  10.169 -25.859
   61    HG   LEU   8           HG       LEU   8  12.233   9.712 -24.368
   62   HD11  LEU   8          1HD1      LEU   8  12.256   7.054 -25.785
   63   HD12  LEU   8          2HD1      LEU   8  11.934   7.324 -24.073
   64   HD13  LEU   8          3HD1      LEU   8  13.532   7.664 -24.734
   65   HD21  LEU   8          3HD2      LEU   8  12.656   9.109 -27.292
   66   HD22  LEU   8          1HD2      LEU   8  13.905   9.616 -26.157
   67   HD23  LEU   8          2HD2      LEU   8  12.583  10.710 -26.557
   68    H    ASP   9           H        ASP   9   8.796  11.137 -24.209
   69    HA   ASP   9           HA       ASP   9  10.284  11.873 -21.876
   70    HB2  ASP   9           2HB      ASP   9   8.059  13.259 -23.383
   71    HB3  ASP   9           1HB      ASP   9   8.833  13.952 -21.960
   72    H    GLY  10           H        GLY  10   7.149  10.534 -22.500
   73    HA2  GLY  10           2HA      GLY  10   5.860  11.114 -20.082
   74    HA3  GLY  10           1HA      GLY  10   5.553   9.697 -21.079
   75    H    ALA  11           H        ALA  11   8.237   8.652 -20.889
   76    HA   ALA  11           HA       ALA  11   8.060   7.158 -18.505
   77    HB1  ALA  11           1HB      ALA  11  10.451   7.566 -20.302
   78    HB2  ALA  11           2HB      ALA  11   9.197   6.343 -20.516
   79    HB3  ALA  11           3HB      ALA  11  10.255   6.282 -19.105
   80    H    LYS  12           H        LYS  12   9.591  10.193 -19.273
   81    HA   LYS  12           HA       LYS  12  11.241  10.269 -16.925
   82    HB2  LYS  12           2HB      LYS  12  10.489  12.257 -19.030
   83    HB3  LYS  12           1HB      LYS  12  11.176  12.835 -17.524
   84    HG2  LYS  12           2HG      LYS  12  13.015  12.677 -18.906
   85    HG3  LYS  12           1HG      LYS  12  13.078  11.162 -18.009
   86    HD2  LYS  12           2HD      LYS  12  11.560  11.127 -20.543
   87    HD3  LYS  12           1HD      LYS  12  13.308  11.323 -20.682
   88    HE2  LYS  12           2HE      LYS  12  13.572   9.302 -19.247
   89    HE3  LYS  12           1HE      LYS  12  11.822   9.084 -19.319
   90    HZ1  LYS  12           3HZ      LYS  12  13.643   9.115 -21.668
   91    HZ2  LYS  12           1HZ      LYS  12  11.968   8.867 -21.712
   92    HZ3  LYS  12           2HZ      LYS  12  12.974   7.722 -20.965
   93    H    LYS  13           H        LYS  13   7.962  11.006 -17.695
   94    HA   LYS  13           HA       LYS  13   7.569  12.881 -15.564
   95    HB2  LYS  13           2HB      LYS  13   5.559  11.419 -17.283
   96    HB3  LYS  13           1HB      LYS  13   5.182  12.741 -16.184
   97    HG2  LYS  13           2HG      LYS  13   6.666  14.211 -17.503
   98    HG3  LYS  13           1HG      LYS  13   6.929  12.881 -18.634
   99    HD2  LYS  13           2HD      LYS  13   5.231  14.348 -19.518
  100    HD3  LYS  13           1HD      LYS  13   4.489  12.815 -19.056
  101    HE2  LYS  13           2HE      LYS  13   3.725  13.819 -16.958
  102    HE3  LYS  13           1HE      LYS  13   4.466  15.349 -17.422
  103    HZ1  LYS  13           3HZ      LYS  13   2.292  13.992 -18.926
  104    HZ2  LYS  13           1HZ      LYS  13   2.963  15.508 -19.281
  105    HZ3  LYS  13           2HZ      LYS  13   2.073  15.293 -17.857
  106    H    ALA  14           H        ALA  14   7.650   9.480 -15.756
  107    HA   ALA  14           HA       ALA  14   5.940   8.871 -13.567
  108    HB1  ALA  14           1HB      ALA  14   7.101   6.720 -13.513
  109    HB2  ALA  14           2HB      ALA  14   8.339   7.355 -14.598
  110    HB3  ALA  14           3HB      ALA  14   6.680   7.173 -15.164
  111    H    VAL  15           H        VAL  15   9.292   9.772 -13.900
  112    HA   VAL  15           HA       VAL  15   9.425  10.250 -10.999
  113    HB   VAL  15           HB       VAL  15  11.935   9.872 -11.230
  114   HG11  VAL  15          1HG1      VAL  15  10.506   8.265 -10.102
  115   HG12  VAL  15          2HG1      VAL  15  11.747   7.427 -11.034
  116   HG13  VAL  15          3HG1      VAL  15  10.094   7.517 -11.643
  117   HG21  VAL  15          3HG2      VAL  15  12.088   9.964 -13.665
  118   HG22  VAL  15          1HG2      VAL  15  11.074   8.527 -13.795
  119   HG23  VAL  15          2HG2      VAL  15  12.673   8.414 -13.064
  120    H    GLY  16           H        GLY  16   8.462  12.275 -12.040
  121    HA2  GLY  16           2HA      GLY  16  10.051  13.750 -13.900
  122    HA3  GLY  16           1HA      GLY  16   8.541  14.267 -13.176
  123    H    GLY  17           H        GLY  17  11.038  13.341 -10.998
  124    HA2  GLY  17           2HA      GLY  17  11.223  15.957  -9.890
  125    HA3  GLY  17           1HA      GLY  17  12.234  14.579  -9.469
  126    H    LEU  18           H        LEU  18  13.823  13.968 -11.258
  127    HA   LEU  18           HA       LEU  18  15.795  14.486 -12.237
  128    HB2  LEU  18           2HB      LEU  18  13.997  16.458 -13.635
  129    HB3  LEU  18           1HB      LEU  18  15.666  16.198 -14.093
  130    HG   LEU  18           HG       LEU  18  14.451  14.928 -15.623
  131   HD11  LEU  18          1HD1      LEU  18  14.925  12.584 -15.084
  132   HD12  LEU  18          2HD1      LEU  18  15.238  13.045 -13.410
  133   HD13  LEU  18          3HD1      LEU  18  16.278  13.650 -14.701
  134   HD21  LEU  18          3HD2      LEU  18  12.774  13.876 -13.352
  135   HD22  LEU  18          1HD2      LEU  18  12.627  13.417 -15.048
  136   HD23  LEU  18          2HD2      LEU  18  12.274  15.071 -14.548
  137    H    GLY  19           H        GLY  19  14.953  17.837 -12.676
  138    HA2  GLY  19           2HA      GLY  19  16.966  18.514 -10.621
  139    HA3  GLY  19           1HA      GLY  19  16.817  19.367 -12.149
  140    H    LYS  20           H        LYS  20  13.813  18.493 -10.840
  141    HA   LYS  20           HA       LYS  20  13.142  21.249 -10.317
  142    HB2  LYS  20           2HB      LYS  20  11.517  18.727  -9.922
  143    HB3  LYS  20           1HB      LYS  20  10.894  20.365  -9.793
  144    HG2  LYS  20           2HG      LYS  20  11.439  20.738 -12.161
  145    HG3  LYS  20           1HG      LYS  20  11.992  19.064 -12.277
  146    HD2  LYS  20           2HD      LYS  20   9.719  18.343 -11.530
  147    HD3  LYS  20           1HD      LYS  20   9.208  20.029 -11.636
  148    HE2  LYS  20           2HE      LYS  20   8.581  18.795 -13.644
  149    HE3  LYS  20           1HE      LYS  20   9.757  20.055 -14.011
  150    HZ1  LYS  20           3HZ      LYS  20  10.158  17.839 -15.076
  151    HZ2  LYS  20           1HZ      LYS  20  10.524  17.233 -13.533
  152    HZ3  LYS  20           2HZ      LYS  20  11.470  18.474 -14.206
  153    H    LEU  21           H        LEU  21  15.154  20.471  -8.602
  154    HA   LEU  21           HA       LEU  21  14.301  19.403  -6.134
  155    HB2  LEU  21           2HB      LEU  21  16.660  21.201  -6.692
  156    HB3  LEU  21           1HB      LEU  21  16.446  20.194  -5.273
  157    HG   LEU  21           HG       LEU  21  16.810  19.208  -8.104
  158   HD11  LEU  21          1HD1      LEU  21  18.634  19.105  -5.713
  159   HD12  LEU  21          2HD1      LEU  21  18.852  20.101  -7.153
  160   HD13  LEU  21          3HD1      LEU  21  18.936  18.343  -7.275
  161   HD21  LEU  21          3HD2      LEU  21  16.508  17.671  -5.528
  162   HD22  LEU  21          1HD2      LEU  21  16.918  16.978  -7.098
  163   HD23  LEU  21          2HD2      LEU  21  15.343  17.731  -6.850
  164    H    GLY  22           H        GLY  22  13.940  22.509  -7.517
  165    HA2  GLY  22           2HA      GLY  22  13.850  24.124  -5.208
  166    HA3  GLY  22           1HA      GLY  22  13.046  24.472  -6.732
  167    H    LYS  23           H        LYS  23  11.528  21.921  -6.595
  168    HA   LYS  23           HA       LYS  23   9.700  22.643  -4.408
  169    HB2  LYS  23           2HB      LYS  23   7.847  21.735  -5.830
  170    HB3  LYS  23           1HB      LYS  23   8.592  23.201  -6.443
  171    HG2  LYS  23           2HG      LYS  23   8.289  21.898  -8.338
  172    HG3  LYS  23           1HG      LYS  23   9.984  21.635  -7.934
  173    HD2  LYS  23           2HD      LYS  23   8.955  19.530  -8.519
  174    HD3  LYS  23           1HD      LYS  23   9.346  19.530  -6.799
  175    HE2  LYS  23           2HE      LYS  23   6.929  20.287  -6.436
  176    HE3  LYS  23           1HE      LYS  23   6.657  19.812  -8.112
  177    HZ1  LYS  23           3HZ      LYS  23   7.664  17.590  -7.410
  178    HZ2  LYS  23           1HZ      LYS  23   6.093  17.940  -6.864
  179    HZ3  LYS  23           2HZ      LYS  23   7.413  18.112  -5.814
  180    H    ASP  24           H        ASP  24  11.304  20.066  -6.133
  181    HA   ASP  24           HA       ASP  24   9.849  17.893  -5.081
  182    HB2  ASP  24           2HB      ASP  24  11.288  17.721  -7.071
  183    HB3  ASP  24           1HB      ASP  24  12.713  17.962  -6.062
  184    H    ALA  25           H        ALA  25  12.715  19.587  -3.934
  185    HA   ALA  25           HA       ALA  25  13.305  17.785  -1.828
  186    HB1  ALA  25           1HB      ALA  25  14.014  20.705  -2.054
  187    HB2  ALA  25           2HB      ALA  25  14.949  19.371  -2.729
  188    HB3  ALA  25           3HB      ALA  25  14.767  19.526  -0.981
  189    H    VAL  26           H        VAL  26  11.092  20.427  -2.196
  190    HA   VAL  26           HA       VAL  26  10.714  21.079   0.516
  191    HB   VAL  26           HB       VAL  26   8.700  21.370  -1.717
  192   HG11  VAL  26          1HG1      VAL  26   7.808  23.200  -0.371
  193   HG12  VAL  26          2HG1      VAL  26   9.005  22.866   0.881
  194   HG13  VAL  26          3HG1      VAL  26   7.757  21.674   0.513
  195   HG21  VAL  26          3HG2      VAL  26   9.605  23.621  -2.026
  196   HG22  VAL  26          1HG2      VAL  26  10.830  22.392  -2.339
  197   HG23  VAL  26          2HG2      VAL  26  10.848  23.292  -0.821
  198    H    GLU  27           H        GLU  27   9.045  18.791  -1.638
  199    HA   GLU  27           HA       GLU  27   7.116  17.863   0.143
  200    HB2  GLU  27           2HB      GLU  27   8.611  16.533  -2.094
  201    HB3  GLU  27           1HB      GLU  27   7.530  15.593  -1.083
  202    HG2  GLU  27           2HG      GLU  27   6.258  16.175  -2.940
  203    HG3  GLU  27           1HG      GLU  27   5.743  17.294  -1.681
  204    H    ASP  28           H        ASP  28  10.376  16.560  -0.416
  205    HA   ASP  28           HA       ASP  28  10.206  14.537   1.515
  206    HB2  ASP  28           2HB      ASP  28  11.845  14.295  -0.168
  207    HB3  ASP  28           1HB      ASP  28  12.548  15.873   0.179
  208    H    LEU  29           H        LEU  29  11.535  17.838   1.759
  209    HA   LEU  29           HA       LEU  29  12.729  17.385   4.272
  210    HB2  LEU  29           2HB      LEU  29  13.020  19.797   4.436
  211    HB3  LEU  29           1HB      LEU  29  13.508  19.181   2.874
  212    HG   LEU  29           HG       LEU  29  11.133  19.972   2.111
  213   HD11  LEU  29          1HD1      LEU  29  10.283  20.518   4.332
  214   HD12  LEU  29          2HD1      LEU  29  10.346  21.952   3.309
  215   HD13  LEU  29          3HD1      LEU  29  11.576  21.698   4.547
  216   HD21  LEU  29          3HD2      LEU  29  13.379  21.887   2.729
  217   HD22  LEU  29          1HD2      LEU  29  12.072  22.176   1.583
  218   HD23  LEU  29          2HD2      LEU  29  13.230  20.879   1.290
  219    H    GLU  30           H        GLU  30   9.462  18.345   3.415
  220    HA   GLU  30           HA       GLU  30   8.889  18.935   6.204
  221    HB2  GLU  30           2HB      GLU  30   6.632  19.503   5.465
  222    HB3  GLU  30           1HB      GLU  30   7.845  20.351   4.525
  223    HG2  GLU  30           2HG      GLU  30   6.402  19.742   2.881
  224    HG3  GLU  30           1HG      GLU  30   7.496  18.362   2.854
  225    H    SER  31           H        SER  31   8.683  16.300   4.009
  226    HA   SER  31           HA       SER  31   6.764  14.789   5.492
  227    HB2  SER  31           2HB      SER  31   8.784  13.934   3.407
  228    HB3  SER  31           1HB      SER  31   7.543  12.880   4.085
  229    HG   SER  31           HG       SER  31   6.791  15.363   2.998
  230    H    VAL  32           H        VAL  32  10.085  15.481   5.924
  231    HA   VAL  32           HA       VAL  32  10.950  13.268   7.394
  232    HB   VAL  32           HB       VAL  32  11.630  16.179   7.861
  233   HG11  VAL  32          1HG1      VAL  32  13.110  13.690   8.710
  234   HG12  VAL  32          2HG1      VAL  32  12.216  14.774   9.774
  235   HG13  VAL  32          3HG1      VAL  32  13.659  15.352   8.939
  236   HG21  VAL  32          3HG2      VAL  32  12.131  15.507   5.590
  237   HG22  VAL  32          1HG2      VAL  32  12.993  14.083   6.174
  238   HG23  VAL  32          2HG2      VAL  32  13.625  15.694   6.505
  239    H    GLY  33           H        GLY  33   9.054  16.087   8.339
  240    HA2  GLY  33           2HA      GLY  33   8.914  15.282  11.111
  241    HA3  GLY  33           1HA      GLY  33   8.086  16.645  10.372
  242    H    LYS  34           H        LYS  34   7.453  14.067   8.430
  243    HA   LYS  34           HA       LYS  34   4.773  13.817   9.473
  244    HB2  LYS  34           2HB      LYS  34   5.933  13.585   6.948
  245    HB3  LYS  34           1HB      LYS  34   5.457  11.943   7.356
  246    HG2  LYS  34           2HG      LYS  34   3.692  13.066   6.131
  247    HG3  LYS  34           1HG      LYS  34   3.173  12.712   7.780
  248    HD2  LYS  34           2HD      LYS  34   2.470  14.942   7.173
  249    HD3  LYS  34           1HD      LYS  34   3.715  15.034   8.418
  250    HE2  LYS  34           2HE      LYS  34   4.193  16.704   6.795
  251    HE3  LYS  34           1HE      LYS  34   5.388  15.425   6.604
  252    HZ1  LYS  34           3HZ      LYS  34   2.980  15.851   4.916
  253    HZ2  LYS  34           1HZ      LYS  34   4.064  14.558   4.744
  254    HZ3  LYS  34           2HZ      LYS  34   4.588  16.149   4.465
  255    H    GLY  35           H        GLY  35   7.747  12.225   9.832
  256    HA2  GLY  35           2HA      GLY  35   6.931   9.588  10.381
  257    HA3  GLY  35           1HA      GLY  35   8.387  10.357  10.995
  258    H    ALA  36           H        ALA  36   6.720  12.497  12.247
  259    HA   ALA  36           HA       ALA  36   6.433  11.378  14.813
  260    HB1  ALA  36           1HB      ALA  36   5.267  13.948  13.743
  261    HB2  ALA  36           2HB      ALA  36   6.878  13.756  14.433
  262    HB3  ALA  36           3HB      ALA  36   5.453  13.516  15.444
  263    H    VAL  37           H        VAL  37   4.313  11.535  12.112
  264    HA   VAL  37           HA       VAL  37   1.993  10.780  13.731
  265    HB   VAL  37           HB       VAL  37   2.161  11.231  10.742
  266   HG11  VAL  37          1HG1      VAL  37   0.331   9.758  11.364
  267   HG12  VAL  37          2HG1      VAL  37  -0.289  11.328  10.845
  268   HG13  VAL  37          3HG1      VAL  37  -0.226  10.926  12.562
  269   HG21  VAL  37          3HG2      VAL  37   2.625  13.286  11.948
  270   HG22  VAL  37          1HG2      VAL  37   1.165  13.068  12.915
  271   HG23  VAL  37          2HG2      VAL  37   1.039  13.365  11.180
  272    H    HIS  38           H        HIS  38   3.858   9.652  10.944
  273    HA   HIS  38           HA       HIS  38   2.481   7.144  10.816
  274    HB2  HIS  38           2HB      HIS  38   3.228   8.114   8.763
  275    HB3  HIS  38           1HB      HIS  38   4.873   8.280   9.359
  276    HD1  HIS  38           1HD      HIS  38   6.452   6.461   8.789
  277    HD2  HIS  38           2HD      HIS  38   2.481   5.307   8.293
  278    HE1  HIS  38           1HE      HIS  38   6.530   4.189   7.707
  279    HE2  HIS  38           2HE      HIS  38   4.126   3.439   7.569
  280    H    ASP  39           H        ASP  39   5.963   7.795  11.197
  281    HA   ASP  39           HA       ASP  39   6.654   5.137  11.645
  282    HB2  ASP  39           2HB      ASP  39   8.140   7.680  12.332
  283    HB3  ASP  39           1HB      ASP  39   8.856   6.071  12.375
  284    H    VAL  40           H        VAL  40   5.994   7.703  13.969
  285    HA   VAL  40           HA       VAL  40   6.917   6.556  16.297
  286    HB   VAL  40           HB       VAL  40   4.458   8.271  15.917
  287   HG11  VAL  40          1HG1      VAL  40   5.951   7.610  18.456
  288   HG12  VAL  40          2HG1      VAL  40   4.313   7.096  18.049
  289   HG13  VAL  40          3HG1      VAL  40   4.663   8.806  18.305
  290   HG21  VAL  40          3HG2      VAL  40   5.920  10.087  16.610
  291   HG22  VAL  40          1HG2      VAL  40   6.568   9.276  15.184
  292   HG23  VAL  40          2HG2      VAL  40   7.268   8.958  16.773
  293    H    LYS  41           H        LYS  41   3.751   6.028  14.759
  294    HA   LYS  41           HA       LYS  41   3.122   4.036  16.795
  295    HB2  LYS  41           2HB      LYS  41   1.502   5.227  14.555
  296    HB3  LYS  41           1HB      LYS  41   0.935   3.866  15.509
  297    HG2  LYS  41           2HG      LYS  41   1.329   5.362  17.544
  298    HG3  LYS  41           1HG      LYS  41   1.438   6.687  16.381
  299    HD2  LYS  41           2HD      LYS  41  -0.777   6.209  15.559
  300    HD3  LYS  41           1HD      LYS  41  -0.891   4.781  16.587
  301    HE2  LYS  41           2HE      LYS  41  -0.585   6.332  18.557
  302    HE3  LYS  41           1HE      LYS  41  -0.801   7.666  17.426
  303    HZ1  LYS  41           3HZ      LYS  41  -2.857   7.048  18.579
  304    HZ2  LYS  41           1HZ      LYS  41  -2.782   5.500  17.884
  305    HZ3  LYS  41           2HZ      LYS  41  -2.992   6.867  16.900
  306    H    ASP  42           H        ASP  42   4.057   4.238  13.442
  307    HA   ASP  42           HA       ASP  42   3.133   1.798  12.490
  308    HB2  ASP  42           2HB      ASP  42   4.039   3.471  10.988
  309    HB3  ASP  42           1HB      ASP  42   5.639   3.295  11.707
  310    H    VAL  43           H        VAL  43   6.051   2.484  14.346
  311    HA   VAL  43           HA       VAL  43   7.353   0.044  13.934
  312    HB   VAL  43           HB       VAL  43   8.495   1.939  14.934
  313   HG11  VAL  43          1HG1      VAL  43   6.727   1.478  17.330
  314   HG12  VAL  43          2HG1      VAL  43   6.712   2.882  16.264
  315   HG13  VAL  43          3HG1      VAL  43   8.115   2.563  17.281
  316   HG21  VAL  43          3HG2      VAL  43   9.400  -0.280  15.343
  317   HG22  VAL  43          1HG2      VAL  43   8.405  -0.438  16.789
  318   HG23  VAL  43          2HG2      VAL  43   9.689   0.769  16.729
  319    H    LEU  44           H        LEU  44   4.790   0.907  16.203
  320    HA   LEU  44           HA       LEU  44   4.979  -1.755  17.406
  321    HB2  LEU  44           2HB      LEU  44   3.418  -0.843  19.127
  322    HB3  LEU  44           1HB      LEU  44   4.976  -0.046  19.052
  323    HG   LEU  44           HG       LEU  44   3.669   1.663  17.521
  324   HD11  LEU  44          1HD1      LEU  44   1.362   1.978  18.264
  325   HD12  LEU  44          2HD1      LEU  44   1.467   0.493  19.213
  326   HD13  LEU  44          3HD1      LEU  44   1.582   0.427  17.453
  327   HD21  LEU  44          3HD2      LEU  44   3.216   3.014  19.506
  328   HD22  LEU  44          1HD2      LEU  44   4.781   2.209  19.616
  329   HD23  LEU  44          2HD2      LEU  44   3.403   1.586  20.523
  330    H    ASP  45           H        ASP  45   3.034   0.124  15.292
  331    HA   ASP  45           HA       ASP  45   0.677  -1.520  15.551
  332    HB2  ASP  45           2HB      ASP  45   0.589   0.886  14.887
  333    HB3  ASP  45           1HB      ASP  45   1.411   0.469  13.387
  334    H    SER  46           H        SER  46   3.258  -1.065  13.174
  335    HA   SER  46           HA       SER  46   2.482  -3.544  11.819
  336    HB2  SER  46           2HB      SER  46   4.673  -1.644  10.980
  337    HB3  SER  46           1HB      SER  46   3.771  -2.782   9.980
  338    HG   SER  46           HG       SER  46   3.259  -0.299  10.144
  339    H    VAL  47           H        VAL  47   3.385  -4.103  14.257
  340    HA   VAL  47           HA       VAL  47   6.257  -4.355  14.342
  341    HB   VAL  47           HB       VAL  47   5.014  -3.853  16.390
  342   HG11  VAL  47          1HG1      VAL  47   2.958  -5.072  15.931
  343   HG12  VAL  47          2HG1      VAL  47   3.633  -5.547  17.489
  344   HG13  VAL  47          3HG1      VAL  47   3.815  -6.604  16.090
  345   HG21  VAL  47          3HG2      VAL  47   6.057  -5.506  17.865
  346   HG22  VAL  47          1HG2      VAL  47   7.156  -4.974  16.593
  347   HG23  VAL  47          2HG2      VAL  47   6.365  -6.545  16.474
  348    H    LEU  48           H        LEU  48   7.460  -6.162  14.014
  349    HA   LEU  48           HA       LEU  48   6.123  -8.411  12.773
  350    HB2  LEU  48           2HB      LEU  48   8.454  -9.218  12.334
  351    HB3  LEU  48           1HB      LEU  48   8.036  -7.688  11.595
  352    HG   LEU  48           HG       LEU  48   9.211  -6.777  13.841
  353   HD11  LEU  48          1HD1      LEU  48  10.620  -9.369  13.211
  354   HD12  LEU  48          2HD1      LEU  48   9.748  -8.990  14.699
  355   HD13  LEU  48          3HD1      LEU  48  11.220  -8.108  14.286
  356   HD21  LEU  48          3HD2      LEU  48  11.227  -6.458  12.477
  357   HD22  LEU  48          1HD2      LEU  48   9.755  -6.113  11.567
  358   HD23  LEU  48          2HD2      LEU  48  10.614  -7.631  11.312
  Start of MODEL    7
    1    H1   SER   1           1HT      SER   1  10.781   3.448  29.526
    2    H2   SER   1           2HT      SER   1  11.956   2.496  28.772
    3    H3   SER   1           3HT      SER   1  10.594   3.007  27.900
    4    HA   SER   1           HA       SER   1  11.293   5.309  28.138
    5    HB2  SER   1           2HB      SER   1  13.829   4.101  29.277
    6    HB3  SER   1           1HB      SER   1  13.501   5.814  29.019
    7    HG   SER   1           HG       SER   1  13.192   4.868  31.229
    8    H    SER   2           H        SER   2  11.195   5.287  25.942
    9    HA   SER   2           HA       SER   2  13.196   3.761  24.463
   10    HB2  SER   2           2HB      SER   2  11.727   4.481  22.485
   11    HB3  SER   2           1HB      SER   2  11.027   3.348  23.642
   12    HG   SER   2           HG       SER   2   9.500   4.757  23.894
   13    H    LEU   3           H        LEU   3  15.040   4.770  24.031
   14    HA   LEU   3           HA       LEU   3  15.076   7.633  23.516
   15    HB2  LEU   3           2HB      LEU   3  17.317   5.606  23.579
   16    HB3  LEU   3           1HB      LEU   3  17.533   7.327  23.320
   17    HG   LEU   3           HG       LEU   3  16.438   6.067  25.838
   18   HD11  LEU   3          1HD1      LEU   3  19.111   7.341  25.272
   19   HD12  LEU   3          2HD1      LEU   3  18.817   5.623  25.538
   20   HD13  LEU   3          3HD1      LEU   3  18.548   6.776  26.843
   21   HD21  LEU   3          3HD2      LEU   3  17.118   8.934  25.187
   22   HD22  LEU   3          1HD2      LEU   3  16.645   8.326  26.773
   23   HD23  LEU   3          2HD2      LEU   3  15.499   8.279  25.433
   24    H    LEU   4           H        LEU   4  13.765   7.478  21.612
   25    HA   LEU   4           HA       LEU   4  14.779   5.928  19.375
   26    HB2  LEU   4           2HB      LEU   4  12.372   5.960  19.890
   27    HB3  LEU   4           1HB      LEU   4  12.338   7.689  19.603
   28    HG   LEU   4           HG       LEU   4  12.950   7.292  17.242
   29   HD11  LEU   4          1HD1      LEU   4  12.813   5.010  16.344
   30   HD12  LEU   4          2HD1      LEU   4  12.680   4.385  17.989
   31   HD13  LEU   4          3HD1      LEU   4  14.154   5.205  17.473
   32   HD21  LEU   4          3HD2      LEU   4  10.519   5.789  18.189
   33   HD22  LEU   4          1HD2      LEU   4  10.799   6.367  16.547
   34   HD23  LEU   4          2HD2      LEU   4  10.615   7.521  17.868
   35    H    GLU   5           H        GLU   5  14.085   9.332  20.132
   36    HA   GLU   5           HA       GLU   5  15.225  10.127  17.581
   37    HB2  GLU   5           2HB      GLU   5  14.502  12.443  18.322
   38    HB3  GLU   5           1HB      GLU   5  13.229  11.270  18.044
   39    HG2  GLU   5           2HG      GLU   5  12.575  12.358  19.978
   40    HG3  GLU   5           1HG      GLU   5  13.308  10.872  20.575
   41    H    LYS   6           H        LYS   6  16.625   9.214  20.233
   42    HA   LYS   6           HA       LYS   6  18.780  11.207  20.007
   43    HB2  LYS   6           2HB      LYS   6  18.056   9.308  22.235
   44    HB3  LYS   6           1HB      LYS   6  19.633  10.084  22.146
   45    HG2  LYS   6           2HG      LYS   6  17.008  11.557  22.232
   46    HG3  LYS   6           1HG      LYS   6  18.038  11.246  23.634
   47    HD2  LYS   6           2HD      LYS   6  19.812  12.562  22.708
   48    HD3  LYS   6           1HD      LYS   6  18.966  12.712  21.167
   49    HE2  LYS   6           2HE      LYS   6  17.938  13.798  23.784
   50    HE3  LYS   6           1HE      LYS   6  18.845  14.744  22.603
   51    HZ1  LYS   6           3HZ      LYS   6  17.116  14.366  20.985
   52    HZ2  LYS   6           1HZ      LYS   6  16.443  15.035  22.385
   53    HZ3  LYS   6           2HZ      LYS   6  16.252  13.384  22.066
   54    H    GLY   7           H        GLY   7  17.792   8.108  19.170
   55    HA2  GLY   7           2HA      GLY   7  18.945   6.612  17.790
   56    HA3  GLY   7           1HA      GLY   7  20.443   7.445  18.180
   57    H    LEU   8           H        LEU   8  18.064   5.139  19.332
   58    HA   LEU   8           HA       LEU   8  19.260   4.256  21.668
   59    HB2  LEU   8           2HB      LEU   8  17.038   3.562  20.512
   60    HB3  LEU   8           1HB      LEU   8  18.014   2.384  19.661
   61    HG   LEU   8           HG       LEU   8  16.760   1.534  21.680
   62   HD11  LEU   8          1HD1      LEU   8  18.628   0.174  22.512
   63   HD12  LEU   8          2HD1      LEU   8  19.756   1.227  21.660
   64   HD13  LEU   8          3HD1      LEU   8  18.592   0.265  20.753
   65   HD21  LEU   8          3HD2      LEU   8  17.751   1.977  23.879
   66   HD22  LEU   8          1HD2      LEU   8  17.084   3.436  23.144
   67   HD23  LEU   8          2HD2      LEU   8  18.827   3.167  23.144
   68    H    ASP   9           H        ASP   9  21.008   2.961  22.116
   69    HA   ASP   9           HA       ASP   9  23.195   3.206  20.455
   70    HB2  ASP   9           2HB      ASP   9  24.421   1.940  22.021
   71    HB3  ASP   9           1HB      ASP   9  23.150   2.722  22.954
   72    H    GLY  10           H        GLY  10  20.999   0.450  20.708
   73    HA2  GLY  10           2HA      GLY  10  22.486  -1.376  19.166
   74    HA3  GLY  10           1HA      GLY  10  20.743  -1.411  19.386
   75    H    ALA  11           H        ALA  11  20.143   1.084  18.234
   76    HA   ALA  11           HA       ALA  11  20.438   0.367  15.417
   77    HB1  ALA  11           1HB      ALA  11  18.602   1.956  15.036
   78    HB2  ALA  11           2HB      ALA  11  18.609   2.364  16.752
   79    HB3  ALA  11           3HB      ALA  11  18.178   0.735  16.234
   80    H    LYS  12           H        LYS  12  21.983   2.264  17.605
   81    HA   LYS  12           HA       LYS  12  22.439   4.685  16.226
   82    HB2  LYS  12           2HB      LYS  12  22.939   4.075  18.674
   83    HB3  LYS  12           1HB      LYS  12  24.407   3.328  18.066
   84    HG2  LYS  12           2HG      LYS  12  24.927   5.517  18.874
   85    HG3  LYS  12           1HG      LYS  12  25.071   5.522  17.113
   86    HD2  LYS  12           2HD      LYS  12  22.989   6.645  16.865
   87    HD3  LYS  12           1HD      LYS  12  22.584   6.408  18.566
   88    HE2  LYS  12           2HE      LYS  12  24.416   7.879  19.216
   89    HE3  LYS  12           1HE      LYS  12  24.859   8.095  17.524
   90    HZ1  LYS  12           3HZ      LYS  12  23.554   9.954  18.360
   91    HZ2  LYS  12           1HZ      LYS  12  22.271   8.910  18.743
   92    HZ3  LYS  12           2HZ      LYS  12  22.729   9.141  17.123
   93    H    LYS  13           H        LYS  13  23.931   1.534  16.166
   94    HA   LYS  13           HA       LYS  13  26.151   2.221  14.536
   95    HB2  LYS  13           2HB      LYS  13  25.924   0.182  16.016
   96    HB3  LYS  13           1HB      LYS  13  24.853  -0.491  14.799
   97    HG2  LYS  13           2HG      LYS  13  26.898  -1.461  14.319
   98    HG3  LYS  13           1HG      LYS  13  26.800  -0.128  13.171
   99    HD2  LYS  13           2HD      LYS  13  28.223   0.075  15.819
  100    HD3  LYS  13           1HD      LYS  13  29.021  -0.419  14.327
  101    HE2  LYS  13           2HE      LYS  13  28.381   1.716  13.299
  102    HE3  LYS  13           1HE      LYS  13  27.625   2.207  14.815
  103    HZ1  LYS  13           3HZ      LYS  13  29.751   2.118  15.902
  104    HZ2  LYS  13           1HZ      LYS  13  29.871   3.108  14.529
  105    HZ3  LYS  13           2HZ      LYS  13  30.498   1.533  14.496
  106    H    ALA  14           H        ALA  14  22.831   1.464  13.920
  107    HA   ALA  14           HA       ALA  14  23.126   0.814  11.150
  108    HB1  ALA  14           1HB      ALA  14  21.195   0.042  12.430
  109    HB2  ALA  14           2HB      ALA  14  20.692   1.014  11.047
  110    HB3  ALA  14           3HB      ALA  14  20.676   1.710  12.666
  111    H    VAL  15           H        VAL  15  23.337   3.647  12.910
  112    HA   VAL  15           HA       VAL  15  22.837   5.336  10.562
  113    HB   VAL  15           HB       VAL  15  23.553   6.199  13.376
  114   HG11  VAL  15          1HG1      VAL  15  22.540   7.759  11.002
  115   HG12  VAL  15          2HG1      VAL  15  24.150   7.850  11.715
  116   HG13  VAL  15          3HG1      VAL  15  22.749   8.407  12.628
  117   HG21  VAL  15          3HG2      VAL  15  21.186   6.832  13.609
  118   HG22  VAL  15          1HG2      VAL  15  21.396   5.094  13.403
  119   HG23  VAL  15          2HG2      VAL  15  20.847   6.082  12.051
  120    H    GLY  16           H        GLY  16  25.264   4.934  13.134
  121    HA2  GLY  16           2HA      GLY  16  27.547   4.799  13.046
  122    HA3  GLY  16           1HA      GLY  16  27.406   4.527  11.318
  123    H    GLY  17           H        GLY  17  25.843   7.371  12.101
  124    HA2  GLY  17           2HA      GLY  17  26.350   9.587  11.828
  125    HA3  GLY  17           1HA      GLY  17  28.017   9.186  12.228
  126    H    LEU  18           H        LEU  18  29.488   8.945  10.654
  127    HA   LEU  18           HA       LEU  18  28.704   9.769   7.988
  128    HB2  LEU  18           2HB      LEU  18  30.992  10.103   7.549
  129    HB3  LEU  18           1HB      LEU  18  30.733  10.644   9.194
  130    HG   LEU  18           HG       LEU  18  31.863   7.925   8.535
  131   HD11  LEU  18          1HD1      LEU  18  33.329  10.491   9.124
  132   HD12  LEU  18          2HD1      LEU  18  33.327   9.614   7.596
  133   HD13  LEU  18          3HD1      LEU  18  34.064   8.891   9.024
  134   HD21  LEU  18          3HD2      LEU  18  31.938   9.591  11.050
  135   HD22  LEU  18          1HD2      LEU  18  32.676   8.000  10.833
  136   HD23  LEU  18          2HD2      LEU  18  30.920   8.175  10.780
  137    H    GLY  19           H        GLY  19  29.010   6.889   9.652
  138    HA2  GLY  19           2HA      GLY  19  30.181   5.132   7.812
  139    HA3  GLY  19           1HA      GLY  19  28.980   4.686   9.016
  140    H    LYS  20           H        LYS  20  26.703   5.788   8.296
  141    HA   LYS  20           HA       LYS  20  26.099   4.596   5.728
  142    HB2  LYS  20           2HB      LYS  20  24.347   5.968   7.773
  143    HB3  LYS  20           1HB      LYS  20  23.746   5.286   6.268
  144    HG2  LYS  20           2HG      LYS  20  25.266   3.606   8.228
  145    HG3  LYS  20           1HG      LYS  20  23.543   3.911   8.430
  146    HD2  LYS  20           2HD      LYS  20  23.754   1.839   7.288
  147    HD3  LYS  20           1HD      LYS  20  23.216   3.023   6.099
  148    HE2  LYS  20           2HE      LYS  20  25.520   3.245   5.294
  149    HE3  LYS  20           1HE      LYS  20  26.049   2.058   6.485
  150    HZ1  LYS  20           3HZ      LYS  20  25.753   1.037   4.333
  151    HZ2  LYS  20           1HZ      LYS  20  24.143   1.565   4.258
  152    HZ3  LYS  20           2HZ      LYS  20  24.611   0.418   5.422
  153    H    LEU  21           H        LEU  21  26.538   7.710   7.143
  154    HA   LEU  21           HA       LEU  21  26.509   9.828   6.479
  155    HB2  LEU  21           2HB      LEU  21  27.433  10.382   4.280
  156    HB3  LEU  21           1HB      LEU  21  28.382   9.206   5.156
  157    HG   LEU  21           HG       LEU  21  26.864   7.578   3.585
  158   HD11  LEU  21          1HD1      LEU  21  25.849   9.410   2.375
  159   HD12  LEU  21          2HD1      LEU  21  26.934   8.504   1.319
  160   HD13  LEU  21          3HD1      LEU  21  27.442  10.058   1.979
  161   HD21  LEU  21          3HD2      LEU  21  29.260   7.412   3.935
  162   HD22  LEU  21          1HD2      LEU  21  29.525   8.835   2.926
  163   HD23  LEU  21          2HD2      LEU  21  28.883   7.356   2.213
  164    H    GLY  22           H        GLY  22  24.875   8.131   3.778
  165    HA2  GLY  22           2HA      GLY  22  23.078  10.372   3.432
  166    HA3  GLY  22           1HA      GLY  22  23.056   8.863   2.531
  167    H    LYS  23           H        LYS  23  22.885   9.382   6.014
  168    HA   LYS  23           HA       LYS  23  20.113   8.379   6.021
  169    HB2  LYS  23           2HB      LYS  23  21.949   6.697   6.745
  170    HB3  LYS  23           1HB      LYS  23  22.108   7.701   8.178
  171    HG2  LYS  23           2HG      LYS  23  19.487   7.342   8.269
  172    HG3  LYS  23           1HG      LYS  23  19.911   5.889   7.360
  173    HD2  LYS  23           2HD      LYS  23  21.573   5.346   9.136
  174    HD3  LYS  23           1HD      LYS  23  20.968   6.725  10.055
  175    HE2  LYS  23           2HE      LYS  23  19.831   4.896  10.951
  176    HE3  LYS  23           1HE      LYS  23  18.670   5.630   9.847
  177    HZ1  LYS  23           3HZ      LYS  23  18.716   3.229   9.623
  178    HZ2  LYS  23           1HZ      LYS  23  20.367   3.271   9.250
  179    HZ3  LYS  23           2HZ      LYS  23  19.245   3.968   8.192
  180    H    ASP  24           H        ASP  24  21.863  10.938   6.363
  181    HA   ASP  24           HA       ASP  24  21.734  11.838   9.009
  182    HB2  ASP  24           2HB      ASP  24  23.218  12.799   7.315
  183    HB3  ASP  24           1HB      ASP  24  21.829  13.425   6.433
  184    H    ALA  25           H        ALA  25  19.364  11.845   6.488
  185    HA   ALA  25           HA       ALA  25  17.742  13.969   7.397
  186    HB1  ALA  25           1HB      ALA  25  17.642  13.117   5.110
  187    HB2  ALA  25           2HB      ALA  25  16.053  13.099   5.874
  188    HB3  ALA  25           3HB      ALA  25  16.966  11.599   5.701
  189    H    VAL  26           H        VAL  26  18.201  10.848   8.662
  190    HA   VAL  26           HA       VAL  26  15.623  10.407   9.761
  191    HB   VAL  26           HB       VAL  26  18.317   9.401  10.698
  192   HG11  VAL  26          1HG1      VAL  26  16.675   9.340  12.508
  193   HG12  VAL  26          2HG1      VAL  26  17.070   7.715  11.947
  194   HG13  VAL  26          3HG1      VAL  26  15.553   8.473  11.459
  195   HG21  VAL  26          3HG2      VAL  26  17.649   7.319   9.586
  196   HG22  VAL  26          1HG2      VAL  26  17.739   8.665   8.447
  197   HG23  VAL  26          2HG2      VAL  26  16.171   8.100   9.025
  198    H    GLU  27           H        GLU  27  18.583  11.906  11.044
  199    HA   GLU  27           HA       GLU  27  17.256  12.694  13.482
  200    HB2  GLU  27           2HB      GLU  27  20.019  13.198  12.394
  201    HB3  GLU  27           1HB      GLU  27  19.442  13.943  13.880
  202    HG2  GLU  27           2HG      GLU  27  19.007  11.700  14.800
  203    HG3  GLU  27           1HG      GLU  27  19.693  10.996  13.335
  204    H    ASP  28           H        ASP  28  15.757  13.600  11.638
  205    HA   ASP  28           HA       ASP  28  15.762  16.440  12.085
  206    HB2  ASP  28           2HB      ASP  28  17.020  16.498  10.045
  207    HB3  ASP  28           1HB      ASP  28  15.977  15.297   9.290
  208    H    LEU  29           H        LEU  29  14.385  13.632  10.511
  209    HA   LEU  29           HA       LEU  29  11.744  14.572  10.240
  210    HB2  LEU  29           2HB      LEU  29  12.734  12.613   9.047
  211    HB3  LEU  29           1HB      LEU  29  12.674  11.713  10.549
  212    HG   LEU  29           HG       LEU  29  10.209  11.968  10.567
  213   HD11  LEU  29          1HD1      LEU  29  10.043  14.001   9.227
  214   HD12  LEU  29          2HD1      LEU  29   9.078  12.700   8.531
  215   HD13  LEU  29          3HD1      LEU  29  10.631  13.128   7.815
  216   HD21  LEU  29          3HD2      LEU  29   9.789  10.343   8.799
  217   HD22  LEU  29          1HD2      LEU  29  11.267   9.960   9.681
  218   HD23  LEU  29          2HD2      LEU  29  11.362  10.707   8.085
  219    H    GLU  30           H        GLU  30  13.440  12.974  12.882
  220    HA   GLU  30           HA       GLU  30  11.020  12.710  14.435
  221    HB2  GLU  30           2HB      GLU  30  12.813  12.137  16.277
  222    HB3  GLU  30           1HB      GLU  30  12.394  10.982  15.026
  223    HG2  GLU  30           2HG      GLU  30  14.765  10.987  15.340
  224    HG3  GLU  30           1HG      GLU  30  14.395  11.671  13.761
  225    H    SER  31           H        SER  31  13.708  14.916  14.186
  226    HA   SER  31           HA       SER  31  13.235  16.389  16.537
  227    HB2  SER  31           2HB      SER  31  14.452  17.293  13.914
  228    HB3  SER  31           1HB      SER  31  14.587  18.147  15.451
  229    HG   SER  31           HG       SER  31  15.477  15.470  15.028
  230    H    VAL  32           H        VAL  32  12.112  16.888  13.187
  231    HA   VAL  32           HA       VAL  32  10.530  19.166  13.881
  232    HB   VAL  32           HB       VAL  32  11.443  18.732  11.591
  233   HG11  VAL  32          1HG1      VAL  32  10.863  16.332  11.490
  234   HG12  VAL  32          2HG1      VAL  32  10.338  17.246  10.077
  235   HG13  VAL  32          3HG1      VAL  32   9.169  16.785  11.310
  236   HG21  VAL  32          3HG2      VAL  32   8.472  19.186  11.779
  237   HG22  VAL  32          1HG2      VAL  32   9.484  19.586  10.390
  238   HG23  VAL  32          2HG2      VAL  32   9.736  20.407  11.929
  239    H    GLY  33           H        GLY  33  10.127  15.824  14.250
  240    HA2  GLY  33           2HA      GLY  33   8.503  14.894  15.660
  241    HA3  GLY  33           1HA      GLY  33   7.513  16.323  15.427
  242    H    LYS  34           H        LYS  34   8.244  15.724  12.414
  243    HA   LYS  34           HA       LYS  34   5.678  14.846  11.725
  244    HB2  LYS  34           2HB      LYS  34   7.663  16.037  10.374
  245    HB3  LYS  34           1HB      LYS  34   7.895  14.395   9.798
  246    HG2  LYS  34           2HG      LYS  34   5.259  15.834   9.663
  247    HG3  LYS  34           1HG      LYS  34   6.453  15.861   8.367
  248    HD2  LYS  34           2HD      LYS  34   6.282  13.474   8.095
  249    HD3  LYS  34           1HD      LYS  34   5.220  13.351   9.500
  250    HE2  LYS  34           2HE      LYS  34   3.997  13.250   7.354
  251    HE3  LYS  34           1HE      LYS  34   3.501  14.609   8.363
  252    HZ1  LYS  34           3HZ      LYS  34   3.748  15.297   6.080
  253    HZ2  LYS  34           1HZ      LYS  34   5.348  14.738   6.037
  254    HZ3  LYS  34           2HZ      LYS  34   4.931  16.050   7.028
  255    H    GLY  35           H        GLY  35   8.731  13.095  12.026
  256    HA2  GLY  35           2HA      GLY  35   7.826  10.627  10.991
  257    HA3  GLY  35           1HA      GLY  35   9.195  10.847  12.068
  258    H    ALA  36           H        ALA  36   7.582  12.067  14.177
  259    HA   ALA  36           HA       ALA  36   6.845   9.622  15.484
  260    HB1  ALA  36           1HB      ALA  36   6.416  11.020  17.426
  261    HB2  ALA  36           2HB      ALA  36   6.549  12.469  16.431
  262    HB3  ALA  36           3HB      ALA  36   7.961  11.446  16.688
  263    H    VAL  37           H        VAL  37   5.195  12.123  13.767
  264    HA   VAL  37           HA       VAL  37   2.613  11.742  14.888
  265    HB   VAL  37           HB       VAL  37   3.393  12.875  12.191
  266   HG11  VAL  37          1HG1      VAL  37   1.065  12.146  12.210
  267   HG12  VAL  37          2HG1      VAL  37   1.178  13.906  12.174
  268   HG13  VAL  37          3HG1      VAL  37   0.773  13.079  13.679
  269   HG21  VAL  37          3HG2      VAL  37   4.350  14.120  14.060
  270   HG22  VAL  37          1HG2      VAL  37   2.754  14.258  14.800
  271   HG23  VAL  37          2HG2      VAL  37   3.087  15.057  13.262
  272    H    HIS  38           H        HIS  38   4.287  10.343  12.083
  273    HA   HIS  38           HA       HIS  38   1.935   8.605  11.691
  274    HB2  HIS  38           2HB      HIS  38   2.478  10.346   9.886
  275    HB3  HIS  38           1HB      HIS  38   3.864   9.330   9.498
  276    HD1  HIS  38           1HD      HIS  38   2.867   6.563   9.273
  277    HD2  HIS  38           2HD      HIS  38   0.488   9.806   8.184
  278    HE1  HIS  38           1HE      HIS  38   1.148   5.653   7.687
  279    HE2  HIS  38           2HE      HIS  38  -0.114   7.663   6.863
  280    H    ASP  39           H        ASP  39   5.396   8.661  10.778
  281    HA   ASP  39           HA       ASP  39   5.558   5.979  10.104
  282    HB2  ASP  39           2HB      ASP  39   7.231   7.740   9.516
  283    HB3  ASP  39           1HB      ASP  39   7.848   7.640  11.163
  284    H    VAL  40           H        VAL  40   6.412   7.484  13.207
  285    HA   VAL  40           HA       VAL  40   7.328   5.130  14.452
  286    HB   VAL  40           HB       VAL  40   6.136   7.608  15.715
  287   HG11  VAL  40          1HG1      VAL  40   7.765   5.396  16.965
  288   HG12  VAL  40          2HG1      VAL  40   6.067   5.747  17.279
  289   HG13  VAL  40          3HG1      VAL  40   7.309   6.902  17.759
  290   HG21  VAL  40          3HG2      VAL  40   8.102   8.077  14.365
  291   HG22  VAL  40          1HG2      VAL  40   9.001   6.812  15.202
  292   HG23  VAL  40          2HG2      VAL  40   8.478   8.248  16.079
  293    H    LYS  41           H        LYS  41   4.114   6.489  14.091
  294    HA   LYS  41           HA       LYS  41   2.888   4.665  15.934
  295    HB2  LYS  41           2HB      LYS  41   2.011   6.892  14.240
  296    HB3  LYS  41           1HB      LYS  41   0.832   5.591  14.367
  297    HG2  LYS  41           2HG      LYS  41   0.504   7.349  16.059
  298    HG3  LYS  41           1HG      LYS  41   0.822   5.767  16.770
  299    HD2  LYS  41           2HD      LYS  41   3.217   6.451  17.009
  300    HD3  LYS  41           1HD      LYS  41   2.747   8.070  16.492
  301    HE2  LYS  41           2HE      LYS  41   1.624   6.620  18.885
  302    HE3  LYS  41           1HE      LYS  41   2.892   7.842  18.947
  303    HZ1  LYS  41           3HZ      LYS  41   0.140   8.300  17.917
  304    HZ2  LYS  41           1HZ      LYS  41   1.361   9.468  18.084
  305    HZ3  LYS  41           2HZ      LYS  41   0.685   8.736  19.460
  306    H    ASP  42           H        ASP  42   3.947   4.450  12.710
  307    HA   ASP  42           HA       ASP  42   2.167   2.292  11.980
  308    HB2  ASP  42           2HB      ASP  42   4.737   3.246  10.701
  309    HB3  ASP  42           1HB      ASP  42   3.683   2.005  10.035
  310    H    VAL  43           H        VAL  43   5.242   2.720  13.500
  311    HA   VAL  43           HA       VAL  43   6.221   0.069  13.217
  312    HB   VAL  43           HB       VAL  43   6.884   2.085  15.377
  313   HG11  VAL  43          1HG1      VAL  43   9.000   0.857  15.567
  314   HG12  VAL  43          2HG1      VAL  43   8.408  -0.328  14.402
  315   HG13  VAL  43          3HG1      VAL  43   7.612  -0.157  15.967
  316   HG21  VAL  43          3HG2      VAL  43   7.248   3.001  13.141
  317   HG22  VAL  43          1HG2      VAL  43   8.223   1.594  12.720
  318   HG23  VAL  43          2HG2      VAL  43   8.779   2.711  13.964
  319    H    LEU  44           H        LEU  44   3.884   1.534  15.283
  320    HA   LEU  44           HA       LEU  44   3.919  -0.129  17.515
  321    HB2  LEU  44           2HB      LEU  44   1.546   1.143  16.146
  322    HB3  LEU  44           1HB      LEU  44   1.524   0.454  17.757
  323    HG   LEU  44           HG       LEU  44   3.147   2.852  16.891
  324   HD11  LEU  44          1HD1      LEU  44   0.715   2.641  18.660
  325   HD12  LEU  44          2HD1      LEU  44   0.763   3.326  17.034
  326   HD13  LEU  44          3HD1      LEU  44   1.643   4.109  18.347
  327   HD21  LEU  44          3HD2      LEU  44   2.827   1.594  19.615
  328   HD22  LEU  44          1HD2      LEU  44   3.704   3.083  19.255
  329   HD23  LEU  44          2HD2      LEU  44   4.282   1.543  18.617
  330    H    ASP  45           H        ASP  45   2.756  -0.709  14.293
  331    HA   ASP  45           HA       ASP  45   1.089  -2.929  14.809
  332    HB2  ASP  45           2HB      ASP  45   1.009  -1.720  12.697
  333    HB3  ASP  45           1HB      ASP  45   2.668  -2.181  12.338
  334    H    SER  46           H        SER  46   4.531  -2.587  14.679
  335    HA   SER  46           HA       SER  46   4.873  -5.500  14.539
  336    HB2  SER  46           2HB      SER  46   6.163  -4.230  12.893
  337    HB3  SER  46           1HB      SER  46   6.897  -3.279  14.182
  338    HG   SER  46           HG       SER  46   7.423  -5.877  13.356
  339    H    VAL  47           H        VAL  47   5.707  -2.661  16.485
  340    HA   VAL  47           HA       VAL  47   7.339  -4.167  18.290
  341    HB   VAL  47           HB       VAL  47   7.763  -1.778  17.845
  342   HG11  VAL  47          1HG1      VAL  47   5.221  -1.318  19.396
  343   HG12  VAL  47          2HG1      VAL  47   5.482  -0.970  17.688
  344   HG13  VAL  47          3HG1      VAL  47   6.366  -0.065  18.916
  345   HG21  VAL  47          3HG2      VAL  47   7.153  -2.411  20.727
  346   HG22  VAL  47          1HG2      VAL  47   8.206  -1.114  20.163
  347   HG23  VAL  47          2HG2      VAL  47   8.644  -2.797  19.871
  348    H    LEU  48           H        LEU  48   6.894  -4.908  20.311
  349    HA   LEU  48           HA       LEU  48   4.185  -4.507  21.339
  350    HB2  LEU  48           2HB      LEU  48   4.149  -6.829  22.170
  351    HB3  LEU  48           1HB      LEU  48   4.161  -6.730  20.424
  352    HG   LEU  48           HG       LEU  48   6.703  -7.228  21.953
  353   HD11  LEU  48          1HD1      LEU  48   5.083  -8.907  22.694
  354   HD12  LEU  48          2HD1      LEU  48   6.330  -9.621  21.672
  355   HD13  LEU  48          3HD1      LEU  48   4.726  -9.302  21.012
  356   HD21  LEU  48          3HD2      LEU  48   7.371  -8.301  19.870
  357   HD22  LEU  48          1HD2      LEU  48   6.875  -6.635  19.583
  358   HD23  LEU  48          2HD2      LEU  48   5.788  -7.961  19.174
  Start of MODEL    8
    1    H1   SER   1           1HT      SER   1   3.962  26.440   8.618
    2    H2   SER   1           2HT      SER   1   2.996  25.118   8.168
    3    H3   SER   1           3HT      SER   1   2.888  25.754   9.731
    4    HA   SER   1           HA       SER   1   2.146  27.167   7.255
    5    HB2  SER   1           2HB      SER   1  -0.178  26.963   8.267
    6    HB3  SER   1           1HB      SER   1   0.522  25.465   7.651
    7    HG   SER   1           HG       SER   1  -0.512  25.657   9.921
    8    H    SER   2           H        SER   2   0.979  29.174   7.707
    9    HA   SER   2           HA       SER   2   2.272  30.658   9.807
   10    HB2  SER   2           2HB      SER   2   0.692  32.491   8.749
   11    HB3  SER   2           1HB      SER   2   2.130  31.936   7.889
   12    HG   SER   2           HG       SER   2  -0.532  31.627   7.266
   13    H    LEU   3           H        LEU   3   1.520  30.240  11.777
   14    HA   LEU   3           HA       LEU   3  -1.354  29.984  12.237
   15    HB2  LEU   3           2HB      LEU   3   0.969  29.685  14.148
   16    HB3  LEU   3           1HB      LEU   3  -0.704  29.290  14.493
   17    HG   LEU   3           HG       LEU   3   0.939  27.908  12.373
   18   HD11  LEU   3          1HD1      LEU   3   1.109  26.049  13.939
   19   HD12  LEU   3          2HD1      LEU   3   0.303  27.009  15.179
   20   HD13  LEU   3          3HD1      LEU   3   1.891  27.494  14.585
   21   HD21  LEU   3          3HD2      LEU   3  -0.846  26.256  12.436
   22   HD22  LEU   3          1HD2      LEU   3  -1.476  27.848  12.020
   23   HD23  LEU   3          2HD2      LEU   3  -1.699  27.211  13.650
   24    H    LEU   4           H        LEU   4   1.409  31.948  13.175
   25    HA   LEU   4           HA       LEU   4  -0.461  34.054  14.050
   26    HB2  LEU   4           2HB      LEU   4   2.325  33.515  15.107
   27    HB3  LEU   4           1HB      LEU   4   1.315  34.870  15.566
   28    HG   LEU   4           HG       LEU   4  -0.350  33.057  16.394
   29   HD11  LEU   4          1HD1      LEU   4   2.208  31.468  16.329
   30   HD12  LEU   4          2HD1      LEU   4   0.749  31.132  15.397
   31   HD13  LEU   4          3HD1      LEU   4   0.723  30.994  17.155
   32   HD21  LEU   4          3HD2      LEU   4   2.263  33.580  17.800
   33   HD22  LEU   4          1HD2      LEU   4   0.789  32.985  18.563
   34   HD23  LEU   4          2HD2      LEU   4   0.823  34.599  17.853
   35    H    GLU   5           H        GLU   5   0.457  36.280  13.760
   36    HA   GLU   5           HA       GLU   5   1.463  36.658  11.160
   37    HB2  GLU   5           2HB      GLU   5   1.608  38.634  13.447
   38    HB3  GLU   5           1HB      GLU   5   1.715  39.009  11.734
   39    HG2  GLU   5           2HG      GLU   5  -0.450  39.579  12.177
   40    HG3  GLU   5           1HG      GLU   5  -0.646  37.912  11.637
   41    H    LYS   6           H        LYS   6   3.006  36.169  14.207
   42    HA   LYS   6           HA       LYS   6   5.616  36.968  13.697
   43    HB2  LYS   6           2HB      LYS   6   4.900  36.183  15.883
   44    HB3  LYS   6           1HB      LYS   6   4.588  34.577  15.242
   45    HG2  LYS   6           2HG      LYS   6   7.056  34.483  14.666
   46    HG3  LYS   6           1HG      LYS   6   7.235  35.932  15.656
   47    HD2  LYS   6           2HD      LYS   6   6.058  33.325  16.616
   48    HD3  LYS   6           1HD      LYS   6   7.726  33.836  16.881
   49    HE2  LYS   6           2HE      LYS   6   6.963  35.759  18.146
   50    HE3  LYS   6           1HE      LYS   6   5.283  35.332  17.822
   51    HZ1  LYS   6           3HZ      LYS   6   6.177  34.652  20.052
   52    HZ2  LYS   6           1HZ      LYS   6   7.151  33.525  19.246
   53    HZ3  LYS   6           2HZ      LYS   6   5.462  33.408  19.153
   54    H    GLY   7           H        GLY   7   4.000  33.909  12.919
   55    HA2  GLY   7           2HA      GLY   7   6.417  32.932  11.595
   56    HA3  GLY   7           1HA      GLY   7   4.986  31.985  11.978
   57    H    LEU   8           H        LEU   8   4.623  35.086  10.485
   58    HA   LEU   8           HA       LEU   8   3.293  33.979   8.228
   59    HB2  LEU   8           2HB      LEU   8   2.946  36.289   9.293
   60    HB3  LEU   8           1HB      LEU   8   4.386  36.783   8.429
   61    HG   LEU   8           HG       LEU   8   1.999  35.643   6.988
   62   HD11  LEU   8          1HD1      LEU   8   2.541  38.539   7.636
   63   HD12  LEU   8          2HD1      LEU   8   1.241  37.556   8.309
   64   HD13  LEU   8          3HD1      LEU   8   1.260  37.934   6.587
   65   HD21  LEU   8          3HD2      LEU   8   4.228  37.477   6.096
   66   HD22  LEU   8          1HD2      LEU   8   2.928  36.843   5.085
   67   HD23  LEU   8          2HD2      LEU   8   4.132  35.749   5.763
   68    H    ASP   9           H        ASP   9   6.355  35.776   8.549
   69    HA   ASP   9           HA       ASP   9   7.245  35.070   5.923
   70    HB2  ASP   9           2HB      ASP   9   9.408  36.082   6.665
   71    HB3  ASP   9           1HB      ASP   9   8.023  37.144   6.888
   72    H    GLY  10           H        GLY  10   7.511  33.679   9.083
   73    HA2  GLY  10           2HA      GLY  10   9.730  31.963   8.535
   74    HA3  GLY  10           1HA      GLY  10   8.605  31.815   9.879
   75    H    ALA  11           H        ALA  11   6.307  31.760   7.968
   76    HA   ALA  11           HA       ALA  11   6.033  28.991   7.678
   77    HB1  ALA  11           1HB      ALA  11   4.129  30.523   7.782
   78    HB2  ALA  11           2HB      ALA  11   4.047  29.493   6.353
   79    HB3  ALA  11           3HB      ALA  11   4.565  31.173   6.204
   80    H    LYS  12           H        LYS  12   7.116  31.481   5.436
   81    HA   LYS  12           HA       LYS  12   7.514  29.535   3.315
   82    HB2  LYS  12           2HB      LYS  12   8.338  32.447   3.399
   83    HB3  LYS  12           1HB      LYS  12   8.346  31.406   1.986
   84    HG2  LYS  12           2HG      LYS  12   6.425  32.622   1.670
   85    HG3  LYS  12           1HG      LYS  12   5.800  31.178   2.467
   86    HD2  LYS  12           2HD      LYS  12   5.673  32.312   4.570
   87    HD3  LYS  12           1HD      LYS  12   6.530  33.711   3.924
   88    HE2  LYS  12           2HE      LYS  12   4.207  34.261   4.039
   89    HE3  LYS  12           1HE      LYS  12   4.633  34.057   2.342
   90    HZ1  LYS  12           3HZ      LYS  12   3.677  31.817   2.433
   91    HZ2  LYS  12           1HZ      LYS  12   2.535  33.008   2.820
   92    HZ3  LYS  12           2HZ      LYS  12   3.221  32.068   4.047
   93    H    LYS  13           H        LYS  13   9.463  31.678   5.357
   94    HA   LYS  13           HA       LYS  13  11.574  31.550   6.169
   95    HB2  LYS  13           2HB      LYS  13  10.594  29.267   6.841
   96    HB3  LYS  13           1HB      LYS  13  11.539  28.606   5.516
   97    HG2  LYS  13           2HG      LYS  13  12.679  28.354   7.652
   98    HG3  LYS  13           1HG      LYS  13  13.588  29.401   6.560
   99    HD2  LYS  13           2HD      LYS  13  12.863  31.361   7.719
  100    HD3  LYS  13           1HD      LYS  13  11.711  30.433   8.683
  101    HE2  LYS  13           2HE      LYS  13  14.711  30.128   8.773
  102    HE3  LYS  13           1HE      LYS  13  13.737  31.006   9.952
  103    HZ1  LYS  13           3HZ      LYS  13  14.244  28.778  10.730
  104    HZ2  LYS  13           1HZ      LYS  13  13.526  28.108   9.352
  105    HZ3  LYS  13           2HZ      LYS  13  12.576  28.943  10.475
  106    H    ALA  14           H        ALA  14  11.154  32.062   3.327
  107    HA   ALA  14           HA       ALA  14  13.291  30.656   1.955
  108    HB1  ALA  14           1HB      ALA  14  12.528  31.836  -0.031
  109    HB2  ALA  14           2HB      ALA  14  11.441  32.816   0.952
  110    HB3  ALA  14           3HB      ALA  14  11.170  31.080   0.803
  111    H    VAL  15           H        VAL  15  12.492  34.041   2.734
  112    HA   VAL  15           HA       VAL  15  14.976  35.013   1.702
  113    HB   VAL  15           HB       VAL  15  14.318  37.190   2.656
  114   HG11  VAL  15          1HG1      VAL  15  12.103  35.780   1.175
  115   HG12  VAL  15          2HG1      VAL  15  13.523  36.529   0.447
  116   HG13  VAL  15          3HG1      VAL  15  12.329  37.526   1.278
  117   HG21  VAL  15          3HG2      VAL  15  11.913  35.704   3.709
  118   HG22  VAL  15          1HG2      VAL  15  12.148  37.451   3.751
  119   HG23  VAL  15          2HG2      VAL  15  13.209  36.395   4.685
  120    H    GLY  16           H        GLY  16  13.903  33.850   4.772
  121    HA2  GLY  16           2HA      GLY  16  16.425  34.788   5.991
  122    HA3  GLY  16           1HA      GLY  16  14.947  34.491   6.895
  123    H    GLY  17           H        GLY  17  15.939  32.324   4.362
  124    HA2  GLY  17           2HA      GLY  17  16.576  30.323   6.442
  125    HA3  GLY  17           1HA      GLY  17  15.685  29.943   4.978
  126    H    LEU  18           H        LEU  18  18.485  32.056   5.029
  127    HA   LEU  18           HA       LEU  18  19.838  30.365   3.137
  128    HB2  LEU  18           2HB      LEU  18  20.756  32.870   4.550
  129    HB3  LEU  18           1HB      LEU  18  21.645  32.057   3.276
  130    HG   LEU  18           HG       LEU  18  18.915  33.317   2.962
  131   HD11  LEU  18          1HD1      LEU  18  21.629  34.219   2.004
  132   HD12  LEU  18          2HD1      LEU  18  20.667  34.983   3.269
  133   HD13  LEU  18          3HD1      LEU  18  20.085  34.980   1.604
  134   HD21  LEU  18          3HD2      LEU  18  20.764  32.078   0.922
  135   HD22  LEU  18          1HD2      LEU  18  19.246  32.906   0.573
  136   HD23  LEU  18          2HD2      LEU  18  19.238  31.395   1.484
  137    H    GLY  19           H        GLY  19  21.257  31.804   6.064
  138    HA2  GLY  19           2HA      GLY  19  22.154  29.119   6.876
  139    HA3  GLY  19           1HA      GLY  19  23.334  30.412   6.691
  140    H    LYS  20           H        LYS  20  20.092  30.219   8.129
  141    HA   LYS  20           HA       LYS  20  21.041  31.811  10.371
  142    HB2  LYS  20           2HB      LYS  20  18.668  31.811   8.998
  143    HB3  LYS  20           1HB      LYS  20  18.253  30.868  10.424
  144    HG2  LYS  20           2HG      LYS  20  17.723  33.115  10.921
  145    HG3  LYS  20           1HG      LYS  20  19.205  32.744  11.806
  146    HD2  LYS  20           2HD      LYS  20  19.458  34.907  10.802
  147    HD3  LYS  20           1HD      LYS  20  20.494  33.775   9.932
  148    HE2  LYS  20           2HE      LYS  20  18.664  33.530   8.241
  149    HE3  LYS  20           1HE      LYS  20  17.810  34.833   9.062
  150    HZ1  LYS  20           3HZ      LYS  20  20.471  35.016   7.751
  151    HZ2  LYS  20           1HZ      LYS  20  19.744  36.272   8.633
  152    HZ3  LYS  20           2HZ      LYS  20  19.022  35.706   7.207
  153    H    LEU  21           H        LEU  21  22.423  30.024  11.100
  154    HA   LEU  21           HA       LEU  21  21.432  27.557  11.996
  155    HB2  LEU  21           2HB      LEU  21  23.861  29.163  12.741
  156    HB3  LEU  21           1HB      LEU  21  23.493  27.654  13.549
  157    HG   LEU  21           HG       LEU  21  23.558  26.522  11.306
  158   HD11  LEU  21          1HD1      LEU  21  23.172  28.473   9.893
  159   HD12  LEU  21          2HD1      LEU  21  24.681  27.665   9.469
  160   HD13  LEU  21          3HD1      LEU  21  24.714  29.156  10.409
  161   HD21  LEU  21          3HD2      LEU  21  26.016  26.543  11.168
  162   HD22  LEU  21          1HD2      LEU  21  25.433  26.385  12.825
  163   HD23  LEU  21          2HD2      LEU  21  26.047  27.935  12.251
  164    H    GLY  22           H        GLY  22  20.235  27.012  13.657
  165    HA2  GLY  22           2HA      GLY  22  19.783  27.161  16.049
  166    HA3  GLY  22           1HA      GLY  22  20.016  28.902  15.922
  167    H    LYS  23           H        LYS  23  18.580  29.221  13.490
  168    HA   LYS  23           HA       LYS  23  15.853  29.016  14.525
  169    HB2  LYS  23           2HB      LYS  23  16.832  30.479  12.063
  170    HB3  LYS  23           1HB      LYS  23  15.252  30.633  12.819
  171    HG2  LYS  23           2HG      LYS  23  17.897  31.517  13.958
  172    HG3  LYS  23           1HG      LYS  23  16.592  32.546  13.373
  173    HD2  LYS  23           2HD      LYS  23  16.366  30.647  15.704
  174    HD3  LYS  23           1HD      LYS  23  16.688  32.376  15.850
  175    HE2  LYS  23           2HE      LYS  23  14.547  32.857  14.756
  176    HE3  LYS  23           1HE      LYS  23  14.232  31.126  14.618
  177    HZ1  LYS  23           3HZ      LYS  23  14.617  32.571  17.186
  178    HZ2  LYS  23           1HZ      LYS  23  14.191  30.941  17.004
  179    HZ3  LYS  23           2HZ      LYS  23  13.108  32.157  16.534
  180    H    ASP  24           H        ASP  24  17.850  27.119  12.899
  181    HA   ASP  24           HA       ASP  24  15.911  26.135  10.955
  182    HB2  ASP  24           2HB      ASP  24  17.699  24.712  10.148
  183    HB3  ASP  24           1HB      ASP  24  18.323  26.347  10.332
  184    H    ALA  25           H        ALA  25  17.570  25.209  13.910
  185    HA   ALA  25           HA       ALA  25  16.788  22.535  14.044
  186    HB1  ALA  25           1HB      ALA  25  18.579  23.500  15.405
  187    HB2  ALA  25           2HB      ALA  25  17.397  22.640  16.394
  188    HB3  ALA  25           3HB      ALA  25  17.382  24.402  16.335
  189    H    VAL  26           H        VAL  26  15.211  25.436  15.293
  190    HA   VAL  26           HA       VAL  26  13.266  24.247  16.861
  191    HB   VAL  26           HB       VAL  26  13.551  26.588  17.046
  192   HG11  VAL  26          1HG1      VAL  26  14.371  27.091  14.824
  193   HG12  VAL  26          2HG1      VAL  26  13.046  28.176  15.248
  194   HG13  VAL  26          3HG1      VAL  26  12.764  26.827  14.147
  195   HG21  VAL  26          3HG2      VAL  26  10.875  26.070  15.760
  196   HG22  VAL  26          1HG2      VAL  26  11.282  27.467  16.757
  197   HG23  VAL  26          2HG2      VAL  26  11.282  25.851  17.462
  198    H    GLU  27           H        GLU  27  13.014  25.157  13.422
  199    HA   GLU  27           HA       GLU  27  10.368  24.070  13.233
  200    HB2  GLU  27           2HB      GLU  27  12.260  25.264  11.221
  201    HB3  GLU  27           1HB      GLU  27  10.691  24.608  10.766
  202    HG2  GLU  27           2HG      GLU  27   9.528  26.252  11.904
  203    HG3  GLU  27           1HG      GLU  27  10.903  26.654  12.932
  204    H    ASP  28           H        ASP  28  13.605  23.030  12.333
  205    HA   ASP  28           HA       ASP  28  12.872  20.797  10.781
  206    HB2  ASP  28           2HB      ASP  28  15.150  21.636  10.766
  207    HB3  ASP  28           1HB      ASP  28  15.333  21.274  12.477
  208    H    LEU  29           H        LEU  29  13.447  21.186  14.241
  209    HA   LEU  29           HA       LEU  29  13.206  18.517  15.025
  210    HB2  LEU  29           2HB      LEU  29  14.019  20.316  16.478
  211    HB3  LEU  29           1HB      LEU  29  12.410  21.008  16.527
  212    HG   LEU  29           HG       LEU  29  11.606  18.933  17.642
  213   HD11  LEU  29          1HD1      LEU  29  14.541  18.267  17.772
  214   HD12  LEU  29          2HD1      LEU  29  13.325  17.411  16.824
  215   HD13  LEU  29          3HD1      LEU  29  13.243  17.393  18.586
  216   HD21  LEU  29          3HD2      LEU  29  12.165  20.907  18.944
  217   HD22  LEU  29          1HD2      LEU  29  13.852  20.403  19.014
  218   HD23  LEU  29          2HD2      LEU  29  12.612  19.441  19.819
  219    H    GLU  30           H        GLU  30  10.681  21.050  14.962
  220    HA   GLU  30           HA       GLU  30   8.670  19.138  15.680
  221    HB2  GLU  30           2HB      GLU  30   7.085  21.027  15.335
  222    HB3  GLU  30           1HB      GLU  30   8.376  21.362  16.476
  223    HG2  GLU  30           2HG      GLU  30   9.572  22.593  14.697
  224    HG3  GLU  30           1HG      GLU  30   8.191  22.328  13.632
  225    H    SER  31           H        SER  31  10.119  20.033  12.749
  226    HA   SER  31           HA       SER  31   7.976  19.425  10.988
  227    HB2  SER  31           2HB      SER  31  10.031  20.621  10.266
  228    HB3  SER  31           1HB      SER  31  10.959  19.142  10.511
  229    HG   SER  31           HG       SER  31  10.476  18.915   8.448
  230    H    VAL  32           H        VAL  32  10.773  17.503  12.084
  231    HA   VAL  32           HA       VAL  32   9.671  15.066  11.068
  232    HB   VAL  32           HB       VAL  32  11.517  13.944  12.234
  233   HG11  VAL  32          1HG1      VAL  32  13.356  14.991  10.996
  234   HG12  VAL  32          2HG1      VAL  32  12.348  16.412  10.714
  235   HG13  VAL  32          3HG1      VAL  32  11.895  14.854  10.019
  236   HG21  VAL  32          3HG2      VAL  32  11.633  15.331  14.236
  237   HG22  VAL  32          1HG2      VAL  32  12.212  16.692  13.275
  238   HG23  VAL  32          2HG2      VAL  32  13.204  15.244  13.442
  239    H    GLY  33           H        GLY  33   9.366  16.852  14.002
  240    HA2  GLY  33           2HA      GLY  33   8.429  14.816  15.708
  241    HA3  GLY  33           1HA      GLY  33   8.006  16.519  15.824
  242    H    LYS  34           H        LYS  34   6.644  17.008  13.544
  243    HA   LYS  34           HA       LYS  34   4.129  15.774  14.013
  244    HB2  LYS  34           2HB      LYS  34   5.080  17.560  11.769
  245    HB3  LYS  34           1HB      LYS  34   3.419  17.014  11.943
  246    HG2  LYS  34           2HG      LYS  34   3.368  18.096  14.184
  247    HG3  LYS  34           1HG      LYS  34   4.965  18.762  13.841
  248    HD2  LYS  34           2HD      LYS  34   2.529  19.219  12.121
  249    HD3  LYS  34           1HD      LYS  34   3.070  20.327  13.383
  250    HE2  LYS  34           2HE      LYS  34   4.717  19.481  11.001
  251    HE3  LYS  34           1HE      LYS  34   3.806  20.988  11.115
  252    HZ1  LYS  34           3HZ      LYS  34   6.042  20.168  12.887
  253    HZ2  LYS  34           1HZ      LYS  34   5.154  21.607  13.031
  254    HZ3  LYS  34           2HZ      LYS  34   6.121  21.339  11.666
  255    H    GLY  35           H        GLY  35   6.722  15.220  11.726
  256    HA2  GLY  35           2HA      GLY  35   5.263  13.452  10.030
  257    HA3  GLY  35           1HA      GLY  35   7.014  13.586  10.129
  258    H    ALA  36           H        ALA  36   7.003  13.063  13.021
  259    HA   ALA  36           HA       ALA  36   7.381  10.268  12.903
  260    HB1  ALA  36           1HB      ALA  36   8.664  11.721  14.388
  261    HB2  ALA  36           2HB      ALA  36   7.872  10.422  15.280
  262    HB3  ALA  36           3HB      ALA  36   7.205  12.055  15.321
  263    H    VAL  37           H        VAL  37   4.581  12.132  13.432
  264    HA   VAL  37           HA       VAL  37   3.113  10.592  15.217
  265    HB   VAL  37           HB       VAL  37   2.088  12.106  12.805
  266   HG11  VAL  37          1HG1      VAL  37   0.442  10.479  13.570
  267   HG12  VAL  37          2HG1      VAL  37  -0.073  12.120  13.958
  268   HG13  VAL  37          3HG1      VAL  37   0.595  11.084  15.219
  269   HG21  VAL  37          3HG2      VAL  37   3.308  13.513  14.377
  270   HG22  VAL  37          1HG2      VAL  37   2.320  12.906  15.705
  271   HG23  VAL  37          2HG2      VAL  37   1.582  13.874  14.428
  272    H    HIS  38           H        HIS  38   3.497  10.193  11.704
  273    HA   HIS  38           HA       HIS  38   1.939   7.736  11.802
  274    HB2  HIS  38           2HB      HIS  38   2.232   7.635   9.368
  275    HB3  HIS  38           1HB      HIS  38   1.589   9.190   9.872
  276    HD1  HIS  38           1HD      HIS  38   2.669  11.138   8.823
  277    HD2  HIS  38           2HD      HIS  38   5.176   7.821   8.856
  278    HE1  HIS  38           1HE      HIS  38   4.711  11.817   7.523
  279    HE2  HIS  38           2HE      HIS  38   6.083   9.714   7.348
  280    H    ASP  39           H        ASP  39   5.167   8.677  12.142
  281    HA   ASP  39           HA       ASP  39   6.411   6.371  10.993
  282    HB2  ASP  39           2HB      ASP  39   7.636   8.487  11.241
  283    HB3  ASP  39           1HB      ASP  39   7.493   8.370  12.992
  284    H    VAL  40           H        VAL  40   6.086   7.438  14.391
  285    HA   VAL  40           HA       VAL  40   6.859   4.927  15.458
  286    HB   VAL  40           HB       VAL  40   7.024   7.052  16.729
  287   HG11  VAL  40          1HG1      VAL  40   5.053   7.984  17.821
  288   HG12  VAL  40          2HG1      VAL  40   4.029   6.825  16.978
  289   HG13  VAL  40          3HG1      VAL  40   4.900   8.058  16.066
  290   HG21  VAL  40          3HG2      VAL  40   7.109   4.925  17.906
  291   HG22  VAL  40          1HG2      VAL  40   5.355   4.915  18.046
  292   HG23  VAL  40          2HG2      VAL  40   6.298   6.144  18.892
  293    H    LYS  41           H        LYS  41   3.911   6.169  14.242
  294    HA   LYS  41           HA       LYS  41   2.043   4.574  15.596
  295    HB2  LYS  41           2HB      LYS  41   1.632   6.592  14.086
  296    HB3  LYS  41           1HB      LYS  41   1.787   5.483  12.732
  297    HG2  LYS  41           2HG      LYS  41  -0.546   5.899  13.326
  298    HG3  LYS  41           1HG      LYS  41  -0.107   4.201  13.523
  299    HD2  LYS  41           2HD      LYS  41  -1.496   5.098  15.379
  300    HD3  LYS  41           1HD      LYS  41   0.063   4.458  15.903
  301    HE2  LYS  41           2HE      LYS  41  -0.427   6.546  17.047
  302    HE3  LYS  41           1HE      LYS  41   0.963   6.739  15.982
  303    HZ1  LYS  41           3HZ      LYS  41  -1.817   7.605  15.368
  304    HZ2  LYS  41           1HZ      LYS  41  -0.472   7.816  14.357
  305    HZ3  LYS  41           2HZ      LYS  41  -0.548   8.620  15.849
  306    H    ASP  42           H        ASP  42   3.978   3.992  12.691
  307    HA   ASP  42           HA       ASP  42   2.808   1.401  12.238
  308    HB2  ASP  42           2HB      ASP  42   3.727   2.659  10.349
  309    HB3  ASP  42           1HB      ASP  42   5.325   2.625  11.091
  310    H    VAL  43           H        VAL  43   5.619   2.698  13.874
  311    HA   VAL  43           HA       VAL  43   7.072   0.343  14.249
  312    HB   VAL  43           HB       VAL  43   6.860   2.710  16.124
  313   HG11  VAL  43          1HG1      VAL  43   9.027   1.979  16.995
  314   HG12  VAL  43          2HG1      VAL  43   8.956   0.547  15.968
  315   HG13  VAL  43          3HG1      VAL  43   7.781   0.760  17.266
  316   HG21  VAL  43          3HG2      VAL  43   8.818   2.085  13.921
  317   HG22  VAL  43          1HG2      VAL  43   8.946   3.437  15.047
  318   HG23  VAL  43          2HG2      VAL  43   7.598   3.357  13.912
  319    H    LEU  44           H        LEU  44   4.413   1.712  16.164
  320    HA   LEU  44           HA       LEU  44   4.562  -0.394  18.117
  321    HB2  LEU  44           2HB      LEU  44   2.540   0.626  19.071
  322    HB3  LEU  44           1HB      LEU  44   3.835   1.777  18.832
  323    HG   LEU  44           HG       LEU  44   2.565   2.334  16.610
  324   HD11  LEU  44          1HD1      LEU  44   0.135   2.112  16.839
  325   HD12  LEU  44          2HD1      LEU  44   0.364   1.151  18.300
  326   HD13  LEU  44          3HD1      LEU  44   0.930   0.540  16.745
  327   HD21  LEU  44          3HD2      LEU  44   1.581   3.171  19.329
  328   HD22  LEU  44          1HD2      LEU  44   1.268   4.025  17.819
  329   HD23  LEU  44          2HD2      LEU  44   2.917   3.890  18.430
  330    H    ASP  45           H        ASP  45   3.254  -0.202  15.028
  331    HA   ASP  45           HA       ASP  45   1.168  -2.176  15.597
  332    HB2  ASP  45           2HB      ASP  45   0.601  -0.234  14.154
  333    HB3  ASP  45           1HB      ASP  45   1.796  -0.788  12.983
  334    H    SER  46           H        SER  46   3.956  -1.702  13.473
  335    HA   SER  46           HA       SER  46   5.595  -3.087  12.783
  336    HB2  SER  46           2HB      SER  46   4.374  -5.167  14.597
  337    HB3  SER  46           1HB      SER  46   6.002  -5.188  13.914
  338    HG   SER  46           HG       SER  46   5.805  -2.879  15.083
  339    H    VAL  47           H        VAL  47   5.276  -3.383  10.698
  340    HA   VAL  47           HA       VAL  47   3.868  -5.829   9.883
  341    HB   VAL  47           HB       VAL  47   3.704  -3.185   8.412
  342   HG11  VAL  47          1HG1      VAL  47   2.200  -4.372   6.871
  343   HG12  VAL  47          2HG1      VAL  47   2.536  -5.880   7.721
  344   HG13  VAL  47          3HG1      VAL  47   3.830  -5.048   6.858
  345   HG21  VAL  47          3HG2      VAL  47   1.575  -4.761   9.852
  346   HG22  VAL  47          1HG2      VAL  47   1.287  -3.331   8.859
  347   HG23  VAL  47          2HG2      VAL  47   2.238  -3.201  10.338
  348    H    LEU  48           H        LEU  48   5.547  -7.073   9.281
  349    HA   LEU  48           HA       LEU  48   7.706  -5.822   7.728
  350    HB2  LEU  48           2HB      LEU  48   7.649  -8.352   9.368
  351    HB3  LEU  48           1HB      LEU  48   8.958  -7.965   8.269
  352    HG   LEU  48           HG       LEU  48   9.245  -5.809   9.625
  353   HD11  LEU  48          1HD1      LEU  48   8.479  -5.891  11.940
  354   HD12  LEU  48          2HD1      LEU  48   7.588  -7.374  11.596
  355   HD13  LEU  48          3HD1      LEU  48   7.122  -5.863  10.813
  356   HD21  LEU  48          3HD2      LEU  48  10.607  -6.932  11.303
  357   HD22  LEU  48          1HD2      LEU  48  10.806  -7.675   9.715
  358   HD23  LEU  48          2HD2      LEU  48   9.808  -8.461  10.939
  Start of MODEL    9
    1    H1   SER   1           1HT      SER   1  -6.627  26.247  12.179
    2    H2   SER   1           2HT      SER   1  -6.645  25.112  13.438
    3    H3   SER   1           3HT      SER   1  -7.708  26.425  13.475
    4    HA   SER   1           HA       SER   1  -7.723  24.287  11.433
    5    HB2  SER   1           2HB      SER   1  -9.642  24.735  13.730
    6    HB3  SER   1           1HB      SER   1  -9.683  23.415  12.561
    7    HG   SER   1           HG       SER   1  -8.629  23.131  14.777
    8    H    SER   2           H        SER   2  -8.575  25.042   9.609
    9    HA   SER   2           HA       SER   2 -10.256  27.416   9.680
   10    HB2  SER   2           2HB      SER   2 -10.071  26.994   7.085
   11    HB3  SER   2           1HB      SER   2  -8.709  27.673   7.979
   12    HG   SER   2           HG       SER   2  -8.873  25.346   6.612
   13    H    LEU   3           H        LEU   3 -12.295  26.955  10.214
   14    HA   LEU   3           HA       LEU   3 -13.639  24.553   9.440
   15    HB2  LEU   3           2HB      LEU   3 -14.703  27.153  10.561
   16    HB3  LEU   3           1HB      LEU   3 -15.688  25.731  10.293
   17    HG   LEU   3           HG       LEU   3 -14.100  24.522  11.899
   18   HD11  LEU   3          1HD1      LEU   3 -13.385  27.370  12.582
   19   HD12  LEU   3          2HD1      LEU   3 -12.296  26.163  11.900
   20   HD13  LEU   3          3HD1      LEU   3 -12.949  25.946  13.524
   21   HD21  LEU   3          3HD2      LEU   3 -15.825  26.760  12.946
   22   HD22  LEU   3          1HD2      LEU   3 -15.317  25.331  13.845
   23   HD23  LEU   3          2HD2      LEU   3 -16.392  25.164  12.459
   24    H    LEU   4           H        LEU   4 -13.119  27.609   8.050
   25    HA   LEU   4           HA       LEU   4 -14.356  26.908   5.568
   26    HB2  LEU   4           2HB      LEU   4 -16.265  27.719   7.040
   27    HB3  LEU   4           1HB      LEU   4 -15.467  29.276   7.087
   28    HG   LEU   4           HG       LEU   4 -15.694  29.407   4.607
   29   HD11  LEU   4          1HD1      LEU   4 -17.291  27.897   3.519
   30   HD12  LEU   4          2HD1      LEU   4 -17.394  26.949   5.004
   31   HD13  LEU   4          3HD1      LEU   4 -15.872  27.038   4.117
   32   HD21  LEU   4          3HD2      LEU   4 -18.077  29.943   4.642
   33   HD22  LEU   4          1HD2      LEU   4 -17.265  30.531   6.094
   34   HD23  LEU   4          2HD2      LEU   4 -18.255  29.072   6.165
   35    H    GLU   5           H        GLU   5 -13.975  28.819   3.985
   36    HA   GLU   5           HA       GLU   5 -11.321  29.792   4.351
   37    HB2  GLU   5           2HB      GLU   5 -13.412  30.568   2.308
   38    HB3  GLU   5           1HB      GLU   5 -11.749  31.127   2.277
   39    HG2  GLU   5           2HG      GLU   5 -11.922  29.350   0.729
   40    HG3  GLU   5           1HG      GLU   5 -11.037  28.734   2.124
   41    H    LYS   6           H        LYS   6 -14.482  31.071   4.968
   42    HA   LYS   6           HA       LYS   6 -13.413  33.687   5.683
   43    HB2  LYS   6           2HB      LYS   6 -15.581  33.488   4.490
   44    HB3  LYS   6           1HB      LYS   6 -16.238  32.604   5.859
   45    HG2  LYS   6           2HG      LYS   6 -16.032  34.539   7.272
   46    HG3  LYS   6           1HG      LYS   6 -15.218  35.434   5.987
   47    HD2  LYS   6           2HD      LYS   6 -17.564  36.086   6.160
   48    HD3  LYS   6           1HD      LYS   6 -17.236  35.304   4.613
   49    HE2  LYS   6           2HE      LYS   6 -18.196  33.229   5.432
   50    HE3  LYS   6           1HE      LYS   6 -18.452  33.950   7.021
   51    HZ1  LYS   6           3HZ      LYS   6 -19.708  34.920   4.508
   52    HZ2  LYS   6           1HZ      LYS   6 -20.021  35.479   6.079
   53    HZ3  LYS   6           2HZ      LYS   6 -20.468  33.902   5.632
   54    H    GLY   7           H        GLY   7 -13.512  30.728   7.068
   55    HA2  GLY   7           2HA      GLY   7 -14.151  31.729   9.767
   56    HA3  GLY   7           1HA      GLY   7 -14.311  30.057   9.261
   57    H    LEU   8           H        LEU   8 -11.709  32.490   9.154
   58    HA   LEU   8           HA       LEU   8 -10.213  31.301  11.221
   59    HB2  LEU   8           2HB      LEU   8  -8.388  30.299  10.117
   60    HB3  LEU   8           1HB      LEU   8  -9.818  29.606   9.383
   61    HG   LEU   8           HG       LEU   8  -8.307  31.890   8.121
   62   HD11  LEU   8          1HD1      LEU   8  -6.761  30.032   8.389
   63   HD12  LEU   8          2HD1      LEU   8  -7.229  30.205   6.697
   64   HD13  LEU   8          3HD1      LEU   8  -7.940  28.929   7.684
   65   HD21  LEU   8          3HD2      LEU   8 -10.210  29.833   7.010
   66   HD22  LEU   8          1HD2      LEU   8  -9.414  31.115   6.095
   67   HD23  LEU   8          2HD2      LEU   8 -10.592  31.524   7.342
   68    H    ASP   9           H        ASP   9  -8.108  32.370  11.513
   69    HA   ASP   9           HA       ASP   9  -8.284  35.155  10.687
   70    HB2  ASP   9           2HB      ASP   9  -6.385  33.727  12.564
   71    HB3  ASP   9           1HB      ASP   9  -6.349  35.458  12.250
   72    H    GLY  10           H        GLY  10  -6.517  32.316   9.900
   73    HA2  GLY  10           2HA      GLY  10  -4.161  33.631   8.895
   74    HA3  GLY  10           1HA      GLY  10  -4.541  31.923   8.770
   75    H    ALA  11           H        ALA  11  -7.055  33.879   7.622
   76    HA   ALA  11           HA       ALA  11  -6.004  33.701   4.871
   77    HB1  ALA  11           1HB      ALA  11  -8.267  33.356   4.064
   78    HB2  ALA  11           2HB      ALA  11  -8.895  33.467   5.709
   79    HB3  ALA  11           3HB      ALA  11  -7.852  32.119   5.252
   80    H    LYS  12           H        LYS  12  -6.654  35.758   7.287
   81    HA   LYS  12           HA       LYS  12  -7.400  37.938   5.451
   82    HB2  LYS  12           2HB      LYS  12  -8.107  37.509   8.352
   83    HB3  LYS  12           1HB      LYS  12  -8.164  39.105   7.623
   84    HG2  LYS  12           2HG      LYS  12 -10.366  38.261   7.576
   85    HG3  LYS  12           1HG      LYS  12  -9.764  38.155   5.923
   86    HD2  LYS  12           2HD      LYS  12  -9.308  35.776   6.235
   87    HD3  LYS  12           1HD      LYS  12  -9.866  35.881   7.905
   88    HE2  LYS  12           2HE      LYS  12 -11.616  34.960   6.509
   89    HE3  LYS  12           1HE      LYS  12 -12.095  36.547   7.104
   90    HZ1  LYS  12           3HZ      LYS  12 -11.460  37.495   4.965
   91    HZ2  LYS  12           1HZ      LYS  12 -12.639  36.292   4.770
   92    HZ3  LYS  12           2HZ      LYS  12 -11.023  35.956   4.394
   93    H    LYS  13           H        LYS  13  -5.891  37.503   8.655
   94    HA   LYS  13           HA       LYS  13  -3.856  38.053   9.482
   95    HB2  LYS  13           2HB      LYS  13  -3.168  38.131   6.549
   96    HB3  LYS  13           1HB      LYS  13  -1.975  38.331   7.826
   97    HG2  LYS  13           2HG      LYS  13  -3.751  35.919   7.565
   98    HG3  LYS  13           1HG      LYS  13  -2.138  36.031   6.864
   99    HD2  LYS  13           2HD      LYS  13  -2.617  36.518   9.788
  100    HD3  LYS  13           1HD      LYS  13  -2.388  34.889   9.151
  101    HE2  LYS  13           2HE      LYS  13  -0.265  35.637   9.907
  102    HE3  LYS  13           1HE      LYS  13  -0.232  35.684   8.149
  103    HZ1  LYS  13           3HZ      LYS  13  -0.554  38.066   8.216
  104    HZ2  LYS  13           1HZ      LYS  13   0.789  37.641   9.156
  105    HZ3  LYS  13           2HZ      LYS  13  -0.677  38.040   9.905
  106    H    ALA  14           H        ALA  14  -5.825  40.249   8.345
  107    HA   ALA  14           HA       ALA  14  -4.131  42.504   7.897
  108    HB1  ALA  14           1HB      ALA  14  -6.168  43.835   8.079
  109    HB2  ALA  14           2HB      ALA  14  -7.043  42.430   8.689
  110    HB3  ALA  14           3HB      ALA  14  -6.419  42.433   7.039
  111    H    VAL  15           H        VAL  15  -6.073  41.412  10.656
  112    HA   VAL  15           HA       VAL  15  -4.630  43.277  12.398
  113    HB   VAL  15           HB       VAL  15  -6.948  41.460  13.107
  114   HG11  VAL  15          1HG1      VAL  15  -7.200  42.922  15.053
  115   HG12  VAL  15          2HG1      VAL  15  -5.782  43.841  14.548
  116   HG13  VAL  15          3HG1      VAL  15  -5.615  42.152  15.028
  117   HG21  VAL  15          3HG2      VAL  15  -8.364  43.459  12.940
  118   HG22  VAL  15          1HG2      VAL  15  -7.627  43.051  11.389
  119   HG23  VAL  15          2HG2      VAL  15  -6.982  44.382  12.350
  120    H    GLY  16           H        GLY  16  -4.936  39.955  11.547
  121    HA2  GLY  16           2HA      GLY  16  -3.625  38.887  13.866
  122    HA3  GLY  16           1HA      GLY  16  -3.991  38.025  12.379
  123    H    GLY  17           H        GLY  17  -1.866  40.667  13.481
  124    HA2  GLY  17           2HA      GLY  17   0.257  39.612  11.749
  125    HA3  GLY  17           1HA      GLY  17   0.254  41.184  12.540
  126    H    LEU  18           H        LEU  18   0.827  41.341  14.722
  127    HA   LEU  18           HA       LEU  18   2.430  39.064  15.645
  128    HB2  LEU  18           2HB      LEU  18   3.480  40.765  17.181
  129    HB3  LEU  18           1HB      LEU  18   3.783  40.982  15.470
  130    HG   LEU  18           HG       LEU  18   1.843  42.692  15.551
  131   HD11  LEU  18          1HD1      LEU  18   1.556  43.806  17.711
  132   HD12  LEU  18          2HD1      LEU  18   2.546  42.565  18.480
  133   HD13  LEU  18          3HD1      LEU  18   0.995  42.135  17.759
  134   HD21  LEU  18          3HD2      LEU  18   4.468  43.260  16.919
  135   HD22  LEU  18          1HD2      LEU  18   3.386  44.467  16.220
  136   HD23  LEU  18          2HD2      LEU  18   4.173  43.279  15.179
  137    H    GLY  19           H        GLY  19  -0.561  40.212  16.052
  138    HA2  GLY  19           2HA      GLY  19  -0.760  39.913  18.933
  139    HA3  GLY  19           1HA      GLY  19  -2.081  40.258  17.823
  140    H    LYS  20           H        LYS  20  -0.328  37.754  16.589
  141    HA   LYS  20           HA       LYS  20  -1.976  35.722  17.939
  142    HB2  LYS  20           2HB      LYS  20  -1.114  35.773  15.033
  143    HB3  LYS  20           1HB      LYS  20  -1.990  34.462  15.810
  144    HG2  LYS  20           2HG      LYS  20  -3.049  37.271  15.582
  145    HG3  LYS  20           1HG      LYS  20  -3.390  35.992  14.417
  146    HD2  LYS  20           2HD      LYS  20  -4.000  35.789  17.362
  147    HD3  LYS  20           1HD      LYS  20  -5.164  36.335  16.155
  148    HE2  LYS  20           2HE      LYS  20  -4.918  34.184  14.980
  149    HE3  LYS  20           1HE      LYS  20  -3.804  33.641  16.236
  150    HZ1  LYS  20           3HZ      LYS  20  -6.640  34.415  16.684
  151    HZ2  LYS  20           1HZ      LYS  20  -5.566  33.823  17.859
  152    HZ3  LYS  20           2HZ      LYS  20  -6.064  32.820  16.586
  153    H    LEU  21           H        LEU  21  -0.500  34.933  19.357
  154    HA   LEU  21           HA       LEU  21   2.200  34.365  18.366
  155    HB2  LEU  21           2HB      LEU  21   2.729  34.047  20.814
  156    HB3  LEU  21           1HB      LEU  21   2.312  35.669  20.311
  157    HG   LEU  21           HG       LEU  21  -0.049  35.158  21.171
  158   HD11  LEU  21          1HD1      LEU  21   0.176  32.738  21.355
  159   HD12  LEU  21          2HD1      LEU  21  -0.205  33.463  22.917
  160   HD13  LEU  21          3HD1      LEU  21   1.443  32.940  22.566
  161   HD21  LEU  21          3HD2      LEU  21   1.474  36.671  22.292
  162   HD22  LEU  21          1HD2      LEU  21   2.265  35.312  23.094
  163   HD23  LEU  21          2HD2      LEU  21   0.588  35.707  23.473
  164    H    GLY  22           H        GLY  22  -0.694  32.802  18.931
  165    HA2  GLY  22           2HA      GLY  22   0.131  30.352  20.045
  166    HA3  GLY  22           1HA      GLY  22  -1.316  30.600  19.082
  167    H    LYS  23           H        LYS  23   0.682  31.626  16.927
  168    HA   LYS  23           HA       LYS  23   0.888  29.079  15.601
  169    HB2  LYS  23           2HB      LYS  23   1.834  30.470  13.714
  170    HB3  LYS  23           1HB      LYS  23   0.200  30.875  14.212
  171    HG2  LYS  23           2HG      LYS  23   1.239  32.937  13.871
  172    HG3  LYS  23           1HG      LYS  23   1.263  32.725  15.619
  173    HD2  LYS  23           2HD      LYS  23   3.398  33.553  15.016
  174    HD3  LYS  23           1HD      LYS  23   3.615  31.836  15.356
  175    HE2  LYS  23           2HE      LYS  23   3.393  31.440  12.871
  176    HE3  LYS  23           1HE      LYS  23   3.490  33.189  12.667
  177    HZ1  LYS  23           3HZ      LYS  23   5.665  32.360  12.385
  178    HZ2  LYS  23           1HZ      LYS  23   5.564  31.364  13.750
  179    HZ3  LYS  23           2HZ      LYS  23   5.652  33.050  13.928
  180    H    ASP  24           H        ASP  24   2.927  30.998  17.543
  181    HA   ASP  24           HA       ASP  24   5.366  30.531  16.110
  182    HB2  ASP  24           2HB      ASP  24   5.049  32.583  17.371
  183    HB3  ASP  24           1HB      ASP  24   4.858  31.672  18.864
  184    H    ALA  25           H        ALA  25   4.205  29.432  19.297
  185    HA   ALA  25           HA       ALA  25   6.566  27.931  19.795
  186    HB1  ALA  25           1HB      ALA  25   5.428  27.154  21.801
  187    HB2  ALA  25           2HB      ALA  25   3.903  27.812  21.203
  188    HB3  ALA  25           3HB      ALA  25   5.237  28.897  21.597
  189    H    VAL  26           H        VAL  26   3.596  27.150  18.190
  190    HA   VAL  26           HA       VAL  26   3.884  24.314  18.747
  191    HB   VAL  26           HB       VAL  26   1.658  25.365  18.880
  192   HG11  VAL  26          1HG1      VAL  26   1.928  25.696  15.899
  193   HG12  VAL  26          2HG1      VAL  26   1.849  26.989  17.095
  194   HG13  VAL  26          3HG1      VAL  26   0.452  25.945  16.831
  195   HG21  VAL  26          3HG2      VAL  26   1.924  23.245  16.759
  196   HG22  VAL  26          1HG2      VAL  26   0.442  23.643  17.629
  197   HG23  VAL  26          2HG2      VAL  26   1.826  22.984  18.500
  198    H    GLU  27           H        GLU  27   4.483  26.524  16.103
  199    HA   GLU  27           HA       GLU  27   3.989  24.807  13.963
  200    HB2  GLU  27           2HB      GLU  27   5.371  26.333  12.613
  201    HB3  GLU  27           1HB      GLU  27   4.190  27.173  13.610
  202    HG2  GLU  27           2HG      GLU  27   5.970  27.705  15.226
  203    HG3  GLU  27           1HG      GLU  27   7.140  26.910  14.170
  204    H    ASP  28           H        ASP  28   7.068  25.383  15.664
  205    HA   ASP  28           HA       ASP  28   8.559  23.719  13.905
  206    HB2  ASP  28           2HB      ASP  28   9.603  25.501  15.250
  207    HB3  ASP  28           1HB      ASP  28   9.226  24.602  16.718
  208    H    LEU  29           H        LEU  29   6.755  23.153  16.824
  209    HA   LEU  29           HA       LEU  29   7.924  20.627  17.441
  210    HB2  LEU  29           2HB      LEU  29   5.295  21.816  18.324
  211    HB3  LEU  29           1HB      LEU  29   6.038  20.386  19.011
  212    HG   LEU  29           HG       LEU  29   7.165  23.183  19.127
  213   HD11  LEU  29          1HD1      LEU  29   5.210  22.879  20.554
  214   HD12  LEU  29          2HD1      LEU  29   6.681  23.021  21.518
  215   HD13  LEU  29          3HD1      LEU  29   5.944  21.439  21.263
  216   HD21  LEU  29          3HD2      LEU  29   8.936  21.511  19.016
  217   HD22  LEU  29          1HD2      LEU  29   8.182  20.608  20.330
  218   HD23  LEU  29          2HD2      LEU  29   8.842  22.217  20.630
  219    H    GLU  30           H        GLU  30   4.870  21.612  15.896
  220    HA   GLU  30           HA       GLU  30   4.167  18.837  15.460
  221    HB2  GLU  30           2HB      GLU  30   2.086  19.743  14.474
  222    HB3  GLU  30           1HB      GLU  30   2.388  20.323  16.103
  223    HG2  GLU  30           2HG      GLU  30   1.741  22.260  15.115
  224    HG3  GLU  30           1HG      GLU  30   3.476  22.344  14.821
  225    H    SER  31           H        SER  31   6.160  20.919  13.888
  226    HA   SER  31           HA       SER  31   5.575  20.461  11.176
  227    HB2  SER  31           2HB      SER  31   7.191  22.173  11.914
  228    HB3  SER  31           1HB      SER  31   8.273  20.904  12.489
  229    HG   SER  31           HG       SER  31   8.439  21.917  10.194
  230    H    VAL  32           H        VAL  32   7.984  18.873  13.265
  231    HA   VAL  32           HA       VAL  32   8.475  16.730  11.480
  232    HB   VAL  32           HB       VAL  32   9.649  15.663  13.348
  233   HG11  VAL  32          1HG1      VAL  32  10.835  17.359  12.104
  234   HG12  VAL  32          2HG1      VAL  32  11.281  17.458  13.807
  235   HG13  VAL  32          3HG1      VAL  32  10.153  18.627  13.121
  236   HG21  VAL  32          3HG2      VAL  32   8.572  17.926  15.029
  237   HG22  VAL  32          1HG2      VAL  32   9.728  16.701  15.553
  238   HG23  VAL  32          2HG2      VAL  32   8.077  16.237  15.137
  239    H    GLY  33           H        GLY  33   5.911  17.415  13.560
  240    HA2  GLY  33           2HA      GLY  33   5.177  14.887  14.528
  241    HA3  GLY  33           1HA      GLY  33   4.091  16.248  14.304
  242    H    LYS  34           H        LYS  34   4.517  16.447  11.435
  243    HA   LYS  34           HA       LYS  34   2.479  14.697  10.597
  244    HB2  LYS  34           2HB      LYS  34   4.321  16.573   9.183
  245    HB3  LYS  34           1HB      LYS  34   3.413  15.408   8.228
  246    HG2  LYS  34           2HG      LYS  34   1.994  17.201   8.190
  247    HG3  LYS  34           1HG      LYS  34   1.372  16.325   9.586
  248    HD2  LYS  34           2HD      LYS  34   1.487  18.617  10.190
  249    HD3  LYS  34           1HD      LYS  34   2.815  17.806  11.021
  250    HE2  LYS  34           2HE      LYS  34   4.405  18.634   9.455
  251    HE3  LYS  34           1HE      LYS  34   3.134  19.220   8.385
  252    HZ1  LYS  34           3HZ      LYS  34   4.122  21.025   9.628
  253    HZ2  LYS  34           1HZ      LYS  34   3.738  20.271  11.097
  254    HZ3  LYS  34           2HZ      LYS  34   2.503  20.826  10.083
  255    H    GLY  35           H        GLY  35   5.889  14.257  10.801
  256    HA2  GLY  35           2HA      GLY  35   5.707  11.810   9.173
  257    HA3  GLY  35           1HA      GLY  35   7.199  12.619   9.632
  258    H    ALA  36           H        ALA  36   6.754  12.996  12.332
  259    HA   ALA  36           HA       ALA  36   7.726  10.567  13.333
  260    HB1  ALA  36           1HB      ALA  36   7.624  11.614  15.525
  261    HB2  ALA  36           2HB      ALA  36   6.597  12.896  14.881
  262    HB3  ALA  36           3HB      ALA  36   8.264  12.735  14.324
  263    H    VAL  37           H        VAL  37   4.483  12.015  13.562
  264    HA   VAL  37           HA       VAL  37   3.434  10.155  15.391
  265    HB   VAL  37           HB       VAL  37   2.003  11.792  13.288
  266   HG11  VAL  37          1HG1      VAL  37  -0.052  11.336  14.550
  267   HG12  VAL  37          2HG1      VAL  37   0.841  10.235  15.601
  268   HG13  VAL  37          3HG1      VAL  37   0.643   9.855  13.891
  269   HG21  VAL  37          3HG2      VAL  37   1.404  13.224  15.175
  270   HG22  VAL  37          1HG2      VAL  37   3.154  13.099  15.000
  271   HG23  VAL  37          2HG2      VAL  37   2.327  12.184  16.262
  272    H    HIS  38           H        HIS  38   3.421  10.167  11.834
  273    HA   HIS  38           HA       HIS  38   1.985   7.728  11.599
  274    HB2  HIS  38           2HB      HIS  38   2.271   9.459   9.766
  275    HB3  HIS  38           1HB      HIS  38   3.913   8.856   9.557
  276    HD1  HIS  38           1HD      HIS  38   0.448   8.250   8.560
  277    HD2  HIS  38           2HD      HIS  38   3.987   6.060   8.687
  278    HE1  HIS  38           1HE      HIS  38   0.055   6.230   7.111
  279    HE2  HIS  38           2HE      HIS  38   2.119   4.814   7.398
  280    H    ASP  39           H        ASP  39   5.402   8.559  11.763
  281    HA   ASP  39           HA       ASP  39   6.519   6.067  11.166
  282    HB2  ASP  39           2HB      ASP  39   7.873   8.091  11.311
  283    HB3  ASP  39           1HB      ASP  39   7.516   8.237  13.026
  284    H    VAL  40           H        VAL  40   5.946   7.479  14.393
  285    HA   VAL  40           HA       VAL  40   6.650   5.210  15.858
  286    HB   VAL  40           HB       VAL  40   4.699   7.393  16.616
  287   HG11  VAL  40          1HG1      VAL  40   5.183   6.760  18.941
  288   HG12  VAL  40          2HG1      VAL  40   6.132   5.393  18.360
  289   HG13  VAL  40          3HG1      VAL  40   4.398   5.455  18.049
  290   HG21  VAL  40          3HG2      VAL  40   6.605   8.386  17.783
  291   HG22  VAL  40          1HG2      VAL  40   6.916   8.244  16.054
  292   HG23  VAL  40          2HG2      VAL  40   7.648   7.099  17.180
  293    H    LYS  41           H        LYS  41   3.472   6.246  14.653
  294    HA   LYS  41           HA       LYS  41   1.961   4.194  15.820
  295    HB2  LYS  41           2HB      LYS  41   0.899   6.151  14.849
  296    HB3  LYS  41           1HB      LYS  41   1.504   5.731  13.256
  297    HG2  LYS  41           2HG      LYS  41  -0.203   3.733  14.625
  298    HG3  LYS  41           1HG      LYS  41  -0.979   5.203  14.031
  299    HD2  LYS  41           2HD      LYS  41  -0.223   4.773  11.798
  300    HD3  LYS  41           1HD      LYS  41   0.782   3.428  12.343
  301    HE2  LYS  41           2HE      LYS  41  -2.223   3.528  12.559
  302    HE3  LYS  41           1HE      LYS  41  -1.339   2.726  11.261
  303    HZ1  LYS  41           3HZ      LYS  41  -0.270   1.320  12.966
  304    HZ2  LYS  41           1HZ      LYS  41  -1.956   1.124  12.911
  305    HZ3  LYS  41           2HZ      LYS  41  -1.258   2.034  14.150
  306    H    ASP  42           H        ASP  42   3.586   4.366  12.676
  307    HA   ASP  42           HA       ASP  42   2.702   1.892  11.676
  308    HB2  ASP  42           2HB      ASP  42   3.783   3.714  10.338
  309    HB3  ASP  42           1HB      ASP  42   5.324   3.275  11.070
  310    H    VAL  43           H        VAL  43   5.543   2.796  13.551
  311    HA   VAL  43           HA       VAL  43   6.806   0.276  13.515
  312    HB   VAL  43           HB       VAL  43   7.030   2.521  15.527
  313   HG11  VAL  43          1HG1      VAL  43   8.832   0.140  15.087
  314   HG12  VAL  43          2HG1      VAL  43   7.803   0.422  16.491
  315   HG13  VAL  43          3HG1      VAL  43   9.166   1.495  16.167
  316   HG21  VAL  43          3HG2      VAL  43   7.639   3.159  13.250
  317   HG22  VAL  43          1HG2      VAL  43   8.757   1.797  13.162
  318   HG23  VAL  43          2HG2      VAL  43   9.053   3.111  14.302
  319    H    LEU  44           H        LEU  44   4.484   1.731  15.781
  320    HA   LEU  44           HA       LEU  44   4.810  -0.374  17.672
  321    HB2  LEU  44           2HB      LEU  44   2.948   0.612  18.891
  322    HB3  LEU  44           1HB      LEU  44   4.161   1.796  18.461
  323    HG   LEU  44           HG       LEU  44   2.564   2.333  16.469
  324   HD11  LEU  44          1HD1      LEU  44   0.203   2.006  17.013
  325   HD12  LEU  44          2HD1      LEU  44   0.659   1.041  18.416
  326   HD13  LEU  44          3HD1      LEU  44   1.036   0.467  16.791
  327   HD21  LEU  44          3HD2      LEU  44   3.109   3.864  18.289
  328   HD22  LEU  44          1HD2      LEU  44   1.888   3.099  19.306
  329   HD23  LEU  44          2HD2      LEU  44   1.405   3.972  17.853
  330    H    ASP  45           H        ASP  45   2.770  -0.006  14.868
  331    HA   ASP  45           HA       ASP  45   1.203  -2.324  15.701
  332    HB2  ASP  45           2HB      ASP  45  -0.146  -2.032  13.749
  333    HB3  ASP  45           1HB      ASP  45   0.093  -0.445  14.461
  334    H    SER  46           H        SER  46   4.069  -1.643  14.124
  335    HA   SER  46           HA       SER  46   4.167  -3.950  12.419
  336    HB2  SER  46           2HB      SER  46   5.433  -1.817  12.005
  337    HB3  SER  46           1HB      SER  46   6.443  -2.204  13.394
  338    HG   SER  46           HG       SER  46   6.960  -2.882  11.010
  339    H    VAL  47           H        VAL  47   5.321  -3.048  15.620
  340    HA   VAL  47           HA       VAL  47   6.653  -5.608  15.977
  341    HB   VAL  47           HB       VAL  47   7.365  -4.733  18.155
  342   HG11  VAL  47          1HG1      VAL  47   8.795  -2.926  17.337
  343   HG12  VAL  47          2HG1      VAL  47   7.802  -2.798  15.885
  344   HG13  VAL  47          3HG1      VAL  47   8.724  -4.269  16.197
  345   HG21  VAL  47          3HG2      VAL  47   6.886  -2.393  18.760
  346   HG22  VAL  47          1HG2      VAL  47   5.433  -3.391  18.732
  347   HG23  VAL  47          2HG2      VAL  47   5.769  -2.285  17.401
  348    H    LEU  48           H        LEU  48   6.315  -6.640  18.200
  349    HA   LEU  48           HA       LEU  48   3.426  -6.998  18.589
  350    HB2  LEU  48           2HB      LEU  48   5.751  -8.838  19.180
  351    HB3  LEU  48           1HB      LEU  48   4.104  -9.168  19.674
  352    HG   LEU  48           HG       LEU  48   3.496  -9.073  17.194
  353   HD11  LEU  48          1HD1      LEU  48   5.540  -7.966  16.412
  354   HD12  LEU  48          2HD1      LEU  48   5.275  -9.511  15.605
  355   HD13  LEU  48          3HD1      LEU  48   6.478  -9.380  16.888
  356   HD21  LEU  48          3HD2      LEU  48   5.340 -11.242  18.183
  357   HD22  LEU  48          1HD2      LEU  48   4.215 -11.380  16.833
  358   HD23  LEU  48          2HD2      LEU  48   3.603 -11.142  18.469
  Start of MODEL   10
    1    H1   SER   1           1HT      SER   1  11.784  -6.346  37.093
    2    H2   SER   1           2HT      SER   1  10.371  -7.271  36.934
    3    H3   SER   1           3HT      SER   1  11.476  -7.186  35.650
    4    HA   SER   1           HA       SER   1  11.923  -8.448  38.289
    5    HB2  SER   1           2HB      SER   1  11.726  -9.627  35.503
    6    HB3  SER   1           1HB      SER   1  12.098 -10.532  36.968
    7    HG   SER   1           HG       SER   1   9.824  -9.107  37.304
    8    H    SER   2           H        SER   2  13.922  -7.858  38.905
    9    HA   SER   2           HA       SER   2  15.988  -7.629  36.832
   10    HB2  SER   2           2HB      SER   2  16.007  -6.644  39.692
   11    HB3  SER   2           1HB      SER   2  17.268  -6.356  38.493
   12    HG   SER   2           HG       SER   2  15.869  -5.117  37.309
   13    H    LEU   3           H        LEU   3  15.639  -8.904  40.145
   14    HA   LEU   3           HA       LEU   3  18.161 -10.075  40.299
   15    HB2  LEU   3           2HB      LEU   3  17.470 -11.100  42.297
   16    HB3  LEU   3           1HB      LEU   3  16.605  -9.581  42.206
   17    HG   LEU   3           HG       LEU   3  15.387 -12.246  41.475
   18   HD11  LEU   3          1HD1      LEU   3  14.246 -12.127  43.635
   19   HD12  LEU   3          2HD1      LEU   3  15.178 -10.688  44.047
   20   HD13  LEU   3          3HD1      LEU   3  15.998 -12.233  43.828
   21   HD21  LEU   3          3HD2      LEU   3  14.292 -10.330  40.435
   22   HD22  LEU   3          1HD2      LEU   3  14.141  -9.551  42.009
   23   HD23  LEU   3          2HD2      LEU   3  13.266 -11.046  41.677
   24    H    LEU   4           H        LEU   4  15.384 -11.251  38.649
   25    HA   LEU   4           HA       LEU   4  15.674 -14.004  38.803
   26    HB2  LEU   4           2HB      LEU   4  13.820 -12.727  37.694
   27    HB3  LEU   4           1HB      LEU   4  14.886 -12.460  36.330
   28    HG   LEU   4           HG       LEU   4  14.287 -15.265  37.222
   29   HD11  LEU   4          1HD1      LEU   4  12.116 -14.196  37.020
   30   HD12  LEU   4          2HD1      LEU   4  12.388 -15.296  35.669
   31   HD13  LEU   4          3HD1      LEU   4  12.557 -13.556  35.438
   32   HD21  LEU   4          3HD2      LEU   4  16.029 -14.908  35.539
   33   HD22  LEU   4          1HD2      LEU   4  14.884 -14.023  34.532
   34   HD23  LEU   4          2HD2      LEU   4  14.635 -15.742  34.849
   35    H    GLU   5           H        GLU   5  17.240 -11.747  36.561
   36    HA   GLU   5           HA       GLU   5  19.273 -13.816  36.032
   37    HB2  GLU   5           2HB      GLU   5  17.906 -13.122  34.039
   38    HB3  GLU   5           1HB      GLU   5  18.514 -11.485  34.247
   39    HG2  GLU   5           2HG      GLU   5  20.805 -12.333  33.898
   40    HG3  GLU   5           1HG      GLU   5  20.140 -13.937  33.604
   41    H    LYS   6           H        LYS   6  18.810 -11.616  38.079
   42    HA   LYS   6           HA       LYS   6  20.011 -10.191  39.346
   43    HB2  LYS   6           2HB      LYS   6  22.359 -10.827  37.550
   44    HB3  LYS   6           1HB      LYS   6  22.431 -10.055  39.128
   45    HG2  LYS   6           2HG      LYS   6  21.526 -12.093  40.153
   46    HG3  LYS   6           1HG      LYS   6  21.509 -12.867  38.569
   47    HD2  LYS   6           2HD      LYS   6  23.979 -12.450  38.446
   48    HD3  LYS   6           1HD      LYS   6  23.907 -11.924  40.130
   49    HE2  LYS   6           2HE      LYS   6  23.213 -14.645  39.035
   50    HE3  LYS   6           1HE      LYS   6  24.578 -14.229  40.068
   51    HZ1  LYS   6           3HZ      LYS   6  22.938 -13.586  41.794
   52    HZ2  LYS   6           1HZ      LYS   6  22.898 -15.237  41.400
   53    HZ3  LYS   6           2HZ      LYS   6  21.701 -14.193  40.804
   54    H    GLY   7           H        GLY   7  20.484  -9.836  35.879
   55    HA2  GLY   7           2HA      GLY   7  19.717  -7.013  36.177
   56    HA3  GLY   7           1HA      GLY   7  21.123  -7.428  35.201
   57    H    LEU   8           H        LEU   8  17.969  -9.002  35.550
   58    HA   LEU   8           HA       LEU   8  17.829  -9.759  32.846
   59    HB2  LEU   8           2HB      LEU   8  16.636 -10.937  34.614
   60    HB3  LEU   8           1HB      LEU   8  15.631  -9.529  34.899
   61    HG   LEU   8           HG       LEU   8  14.710  -9.776  32.595
   62   HD11  LEU   8          1HD1      LEU   8  16.570 -10.982  31.591
   63   HD12  LEU   8          2HD1      LEU   8  15.061 -11.878  31.413
   64   HD13  LEU   8          3HD1      LEU   8  16.242 -12.371  32.629
   65   HD21  LEU   8          3HD2      LEU   8  13.510 -10.652  34.519
   66   HD22  LEU   8          1HD2      LEU   8  14.405 -12.168  34.406
   67   HD23  LEU   8          2HD2      LEU   8  13.293 -11.702  33.117
   68    H    ASP   9           H        ASP   9  16.279  -7.078  34.594
   69    HA   ASP   9           HA       ASP   9  14.828  -6.176  32.307
   70    HB2  ASP   9           2HB      ASP   9  14.149  -4.302  33.637
   71    HB3  ASP   9           1HB      ASP   9  14.147  -5.715  34.684
   72    H    GLY  10           H        GLY  10  18.050  -5.992  33.188
   73    HA2  GLY  10           2HA      GLY  10  18.761  -3.482  32.063
   74    HA3  GLY  10           1HA      GLY  10  19.850  -4.834  32.347
   75    H    ALA  11           H        ALA  11  18.206  -6.668  30.736
   76    HA   ALA  11           HA       ALA  11  19.385  -6.165  28.188
   77    HB1  ALA  11           1HB      ALA  11  17.302  -8.205  28.960
   78    HB2  ALA  11           2HB      ALA  11  19.048  -8.431  29.057
   79    HB3  ALA  11           3HB      ALA  11  18.272  -8.216  27.487
   80    H    LYS  12           H        LYS  12  16.429  -5.296  29.666
   81    HA   LYS  12           HA       LYS  12  15.255  -4.561  27.060
   82    HB2  LYS  12           2HB      LYS  12  13.858  -4.873  29.727
   83    HB3  LYS  12           1HB      LYS  12  13.090  -4.575  28.176
   84    HG2  LYS  12           2HG      LYS  12  14.651  -7.051  28.874
   85    HG3  LYS  12           1HG      LYS  12  12.894  -6.912  28.926
   86    HD2  LYS  12           2HD      LYS  12  14.291  -6.188  26.399
   87    HD3  LYS  12           1HD      LYS  12  14.163  -7.895  26.821
   88    HE2  LYS  12           2HE      LYS  12  12.307  -7.243  25.404
   89    HE3  LYS  12           1HE      LYS  12  11.730  -7.658  27.014
   90    HZ1  LYS  12           3HZ      LYS  12  10.684  -5.654  26.074
   91    HZ2  LYS  12           1HZ      LYS  12  12.192  -4.877  26.073
   92    HZ3  LYS  12           2HZ      LYS  12  11.480  -5.353  27.538
   93    H    LYS  13           H        LYS  13  17.213  -3.224  29.073
   94    HA   LYS  13           HA       LYS  13  15.713  -1.016  30.153
   95    HB2  LYS  13           2HB      LYS  13  17.878  -2.287  31.039
   96    HB3  LYS  13           1HB      LYS  13  18.691  -1.026  30.125
   97    HG2  LYS  13           2HG      LYS  13  18.496  -0.336  32.409
   98    HG3  LYS  13           1HG      LYS  13  17.429   0.664  31.421
   99    HD2  LYS  13           2HD      LYS  13  15.507  -0.525  32.134
  100    HD3  LYS  13           1HD      LYS  13  16.482  -1.794  32.878
  101    HE2  LYS  13           2HE      LYS  13  17.337  -0.146  34.496
  102    HE3  LYS  13           1HE      LYS  13  16.297   1.080  33.773
  103    HZ1  LYS  13           3HZ      LYS  13  14.372  -0.105  34.454
  104    HZ2  LYS  13           1HZ      LYS  13  15.385   0.019  35.807
  105    HZ3  LYS  13           2HZ      LYS  13  15.282  -1.448  34.956
  106    H    ALA  14           H        ALA  14  18.111  -1.485  27.588
  107    HA   ALA  14           HA       ALA  14  18.087   1.386  27.030
  108    HB1  ALA  14           1HB      ALA  14  20.021   0.944  25.622
  109    HB2  ALA  14           2HB      ALA  14  19.827  -0.790  25.880
  110    HB3  ALA  14           3HB      ALA  14  20.251   0.263  27.230
  111    H    VAL  15           H        VAL  15  16.519  -1.384  26.000
  112    HA   VAL  15           HA       VAL  15  16.422  -1.206  23.236
  113    HB   VAL  15           HB       VAL  15  14.177  -2.041  25.084
  114   HG11  VAL  15          1HG1      VAL  15  14.623  -2.632  22.159
  115   HG12  VAL  15          2HG1      VAL  15  13.357  -1.609  22.836
  116   HG13  VAL  15          3HG1      VAL  15  13.360  -3.341  23.167
  117   HG21  VAL  15          3HG2      VAL  15  16.213  -3.311  25.479
  118   HG22  VAL  15          1HG2      VAL  15  16.344  -3.667  23.757
  119   HG23  VAL  15          2HG2      VAL  15  14.997  -4.320  24.693
  120    H    GLY  16           H        GLY  16  14.386   0.456  25.627
  121    HA2  GLY  16           2HA      GLY  16  12.771   1.727  23.628
  122    HA3  GLY  16           1HA      GLY  16  12.757   2.069  25.348
  123    H    GLY  17           H        GLY  17  15.908   2.297  24.349
  124    HA2  GLY  17           2HA      GLY  17  15.607   5.193  23.846
  125    HA3  GLY  17           1HA      GLY  17  16.862   4.535  24.880
  126    H    LEU  18           H        LEU  18  16.714   2.306  22.574
  127    HA   LEU  18           HA       LEU  18  19.214   2.713  21.560
  128    HB2  LEU  18           2HB      LEU  18  16.880   1.337  20.239
  129    HB3  LEU  18           1HB      LEU  18  18.534   1.221  19.669
  130    HG   LEU  18           HG       LEU  18  17.555   0.291  22.368
  131   HD11  LEU  18          1HD1      LEU  18  18.331  -1.266  19.906
  132   HD12  LEU  18          2HD1      LEU  18  16.702  -1.094  20.558
  133   HD13  LEU  18          3HD1      LEU  18  17.932  -1.955  21.481
  134   HD21  LEU  18          3HD2      LEU  18  20.240   0.007  21.026
  135   HD22  LEU  18          1HD2      LEU  18  19.771  -0.725  22.560
  136   HD23  LEU  18          2HD2      LEU  18  19.876   1.032  22.417
  137    H    GLY  19           H        GLY  19  16.244   3.408  19.695
  138    HA2  GLY  19           2HA      GLY  19  17.870   5.026  17.874
  139    HA3  GLY  19           1HA      GLY  19  16.240   4.449  17.566
  140    H    LYS  20           H        LYS  20  16.804   5.840  20.658
  141    HA   LYS  20           HA       LYS  20  15.621   8.368  19.744
  142    HB2  LYS  20           2HB      LYS  20  14.632   6.560  21.921
  143    HB3  LYS  20           1HB      LYS  20  14.317   8.284  21.992
  144    HG2  LYS  20           2HG      LYS  20  13.543   6.565  19.647
  145    HG3  LYS  20           1HG      LYS  20  12.485   6.864  21.026
  146    HD2  LYS  20           2HD      LYS  20  11.828   8.464  19.453
  147    HD3  LYS  20           1HD      LYS  20  12.885   9.354  20.547
  148    HE2  LYS  20           2HE      LYS  20  14.758   8.841  18.908
  149    HE3  LYS  20           1HE      LYS  20  13.495   8.333  17.787
  150    HZ1  LYS  20           3HZ      LYS  20  12.501  10.552  18.026
  151    HZ2  LYS  20           1HZ      LYS  20  14.061  10.603  17.372
  152    HZ3  LYS  20           2HZ      LYS  20  13.814  11.020  18.998
  153    H    LEU  21           H        LEU  21  16.058   7.476  23.084
  154    HA   LEU  21           HA       LEU  21  17.397   9.916  23.611
  155    HB2  LEU  21           2HB      LEU  21  16.819   7.513  25.327
  156    HB3  LEU  21           1HB      LEU  21  17.683   8.910  25.934
  157    HG   LEU  21           HG       LEU  21  15.652  10.291  25.255
  158   HD11  LEU  21          1HD1      LEU  21  14.358   7.574  25.145
  159   HD12  LEU  21          2HD1      LEU  21  14.628   8.639  23.764
  160   HD13  LEU  21          3HD1      LEU  21  13.534   9.132  25.059
  161   HD21  LEU  21          3HD2      LEU  21  14.420   9.684  27.288
  162   HD22  LEU  21          1HD2      LEU  21  16.159   9.775  27.564
  163   HD23  LEU  21          2HD2      LEU  21  15.373   8.204  27.407
  164    H    GLY  22           H        GLY  22  18.538   6.879  22.619
  165    HA2  GLY  22           2HA      GLY  22  21.123   6.872  23.721
  166    HA3  GLY  22           1HA      GLY  22  20.658   6.122  22.200
  167    H    LYS  23           H        LYS  23  19.700   8.710  21.144
  168    HA   LYS  23           HA       LYS  23  22.309   9.976  20.636
  169    HB2  LYS  23           2HB      LYS  23  19.832   9.845  18.909
  170    HB3  LYS  23           1HB      LYS  23  21.230  10.845  18.542
  171    HG2  LYS  23           2HG      LYS  23  22.616   8.795  18.461
  172    HG3  LYS  23           1HG      LYS  23  21.150   7.840  18.697
  173    HD2  LYS  23           2HD      LYS  23  21.793   7.999  16.321
  174    HD3  LYS  23           1HD      LYS  23  20.212   8.720  16.635
  175    HE2  LYS  23           2HE      LYS  23  21.214  10.940  16.662
  176    HE3  LYS  23           1HE      LYS  23  22.810  10.238  16.407
  177    HZ1  LYS  23           3HZ      LYS  23  20.547   9.963  14.502
  178    HZ2  LYS  23           1HZ      LYS  23  22.153   9.478  14.256
  179    HZ3  LYS  23           2HZ      LYS  23  21.771  11.125  14.369
  180    H    ASP  24           H        ASP  24  18.835  10.671  20.842
  181    HA   ASP  24           HA       ASP  24  17.648  12.508  21.416
  182    HB2  ASP  24           2HB      ASP  24  18.696  11.927  23.625
  183    HB3  ASP  24           1HB      ASP  24  19.950  13.116  23.282
  184    H    ALA  25           H        ALA  25  18.058  13.274  19.257
  185    HA   ALA  25           HA       ALA  25  18.987  15.936  19.097
  186    HB1  ALA  25           1HB      ALA  25  21.207  14.887  19.259
  187    HB2  ALA  25           2HB      ALA  25  20.960  15.674  17.700
  188    HB3  ALA  25           3HB      ALA  25  20.844  13.919  17.829
  189    H    VAL  26           H        VAL  26  18.188  12.928  17.492
  190    HA   VAL  26           HA       VAL  26  17.722  14.167  14.929
  191    HB   VAL  26           HB       VAL  26  18.538  11.852  15.078
  192   HG11  VAL  26          1HG1      VAL  26  17.384  11.119  17.075
  193   HG12  VAL  26          2HG1      VAL  26  17.021  10.036  15.731
  194   HG13  VAL  26          3HG1      VAL  26  15.831  11.232  16.247
  195   HG21  VAL  26          3HG2      VAL  26  17.039  10.869  13.416
  196   HG22  VAL  26          1HG2      VAL  26  17.355  12.570  13.076
  197   HG23  VAL  26          2HG2      VAL  26  15.820  12.085  13.795
  198    H    GLU  27           H        GLU  27  15.936  13.566  17.784
  199    HA   GLU  27           HA       GLU  27  13.321  13.463  16.743
  200    HB2  GLU  27           2HB      GLU  27  12.933  14.606  19.185
  201    HB3  GLU  27           1HB      GLU  27  13.089  12.882  18.896
  202    HG2  GLU  27           2HG      GLU  27  15.474  14.591  19.503
  203    HG3  GLU  27           1HG      GLU  27  14.459  13.921  20.781
  204    H    ASP  28           H        ASP  28  15.503  15.998  16.687
  205    HA   ASP  28           HA       ASP  28  13.826  18.244  16.903
  206    HB2  ASP  28           2HB      ASP  28  16.271  18.427  16.762
  207    HB3  ASP  28           1HB      ASP  28  16.231  17.818  15.112
  208    H    LEU  29           H        LEU  29  14.517  16.047  14.239
  209    HA   LEU  29           HA       LEU  29  12.930  17.479  12.320
  210    HB2  LEU  29           2HB      LEU  29  13.942  14.633  12.243
  211    HB3  LEU  29           1HB      LEU  29  13.347  15.557  10.877
  212    HG   LEU  29           HG       LEU  29  15.848  16.190  12.449
  213   HD11  LEU  29          1HD1      LEU  29  15.498  14.973   9.712
  214   HD12  LEU  29          2HD1      LEU  29  16.089  14.144  11.153
  215   HD13  LEU  29          3HD1      LEU  29  17.033  15.451  10.436
  216   HD21  LEU  29          3HD2      LEU  29  16.294  17.773  10.626
  217   HD22  LEU  29          1HD2      LEU  29  14.830  18.187  11.520
  218   HD23  LEU  29          2HD2      LEU  29  14.711  17.413   9.940
  219    H    GLU  30           H        GLU  30  12.307  15.298  14.835
  220    HA   GLU  30           HA       GLU  30   9.935  14.135  13.612
  221    HB2  GLU  30           2HB      GLU  30  11.250  13.669  16.292
  222    HB3  GLU  30           1HB      GLU  30   9.853  12.786  15.694
  223    HG2  GLU  30           2HG      GLU  30  11.124  11.789  13.954
  224    HG3  GLU  30           1HG      GLU  30  12.499  12.849  14.268
  225    H    SER  31           H        SER  31  10.772  16.044  16.503
  226    HA   SER  31           HA       SER  31   8.128  16.172  17.482
  227    HB2  SER  31           2HB      SER  31  10.155  16.509  18.875
  228    HB3  SER  31           1HB      SER  31  10.412  18.061  18.079
  229    HG   SER  31           HG       SER  31   9.065  17.733  20.209
  230    H    VAL  32           H        VAL  32  10.069  18.873  16.135
  231    HA   VAL  32           HA       VAL  32   7.677  20.407  15.707
  232    HB   VAL  32           HB       VAL  32   9.102  22.134  14.757
  233   HG11  VAL  32          1HG1      VAL  32  10.304  20.899  17.229
  234   HG12  VAL  32          2HG1      VAL  32   8.935  22.008  17.177
  235   HG13  VAL  32          3HG1      VAL  32  10.538  22.562  16.696
  236   HG21  VAL  32          3HG2      VAL  32  11.520  21.840  14.570
  237   HG22  VAL  32          1HG2      VAL  32  10.653  20.731  13.509
  238   HG23  VAL  32          2HG2      VAL  32  11.351  20.143  15.018
  239    H    GLY  33           H        GLY  33   9.317  18.022  13.987
  240    HA2  GLY  33           2HA      GLY  33   8.516  18.802  11.346
  241    HA3  GLY  33           1HA      GLY  33   9.056  17.199  11.839
  242    H    LYS  34           H        LYS  34   7.158  16.860  13.934
  243    HA   LYS  34           HA       LYS  34   5.012  16.380  14.468
  244    HB2  LYS  34           2HB      LYS  34   4.568  18.669  13.497
  245    HB3  LYS  34           1HB      LYS  34   4.162  17.873  11.985
  246    HG2  LYS  34           2HG      LYS  34   2.167  18.447  13.239
  247    HG3  LYS  34           1HG      LYS  34   2.329  16.698  13.087
  248    HD2  LYS  34           2HD      LYS  34   1.624  17.346  15.340
  249    HD3  LYS  34           1HD      LYS  34   3.206  16.568  15.357
  250    HE2  LYS  34           2HE      LYS  34   3.133  18.521  16.841
  251    HE3  LYS  34           1HE      LYS  34   4.298  18.730  15.536
  252    HZ1  LYS  34           3HZ      LYS  34   2.952  20.266  14.467
  253    HZ2  LYS  34           1HZ      LYS  34   2.756  20.670  16.103
  254    HZ3  LYS  34           2HZ      LYS  34   1.549  19.791  15.296
  255    H    GLY  35           H        GLY  35   6.554  15.307  11.755
  256    HA2  GLY  35           2HA      GLY  35   4.432  13.699  10.644
  257    HA3  GLY  35           1HA      GLY  35   6.126  13.663  10.181
  258    H    ALA  36           H        ALA  36   6.544  13.381  13.273
  259    HA   ALA  36           HA       ALA  36   7.241  10.691  13.243
  260    HB1  ALA  36           1HB      ALA  36   8.194  12.301  14.801
  261    HB2  ALA  36           2HB      ALA  36   7.554  10.896  15.653
  262    HB3  ALA  36           3HB      ALA  36   6.650  12.412  15.646
  263    H    VAL  37           H        VAL  37   4.190  12.169  13.908
  264    HA   VAL  37           HA       VAL  37   2.909  10.247  15.450
  265    HB   VAL  37           HB       VAL  37   1.683  11.890  13.224
  266   HG11  VAL  37          1HG1      VAL  37  -0.413  11.647  14.458
  267   HG12  VAL  37          2HG1      VAL  37   0.394  10.614  15.637
  268   HG13  VAL  37          3HG1      VAL  37   0.223  10.075  13.967
  269   HG21  VAL  37          3HG2      VAL  37   1.116  13.488  15.013
  270   HG22  VAL  37          1HG2      VAL  37   2.855  13.315  14.792
  271   HG23  VAL  37          2HG2      VAL  37   2.055  12.523  16.149
  272    H    HIS  38           H        HIS  38   3.618  10.250  11.998
  273    HA   HIS  38           HA       HIS  38   2.002   7.856  11.589
  274    HB2  HIS  38           2HB      HIS  38   3.704   9.396   9.620
  275    HB3  HIS  38           1HB      HIS  38   2.619   8.071   9.222
  276    HD1  HIS  38           1HD      HIS  38   2.746  11.596   9.131
  277    HD2  HIS  38           2HD      HIS  38  -0.191   8.823  10.111
  278    HE1  HIS  38           1HE      HIS  38   0.560  12.834   8.956
  279    HE2  HIS  38           2HE      HIS  38  -1.178  11.190   9.757
  280    H    ASP  39           H        ASP  39   5.383   8.870  11.487
  281    HA   ASP  39           HA       ASP  39   6.462   6.463  10.532
  282    HB2  ASP  39           2HB      ASP  39   7.683   8.698  12.153
  283    HB3  ASP  39           1HB      ASP  39   8.618   7.339  11.537
  284    H    VAL  40           H        VAL  40   5.926   7.615  13.845
  285    HA   VAL  40           HA       VAL  40   7.155   5.287  15.010
  286    HB   VAL  40           HB       VAL  40   5.384   7.355  16.332
  287   HG11  VAL  40          1HG1      VAL  40   6.409   6.617  18.415
  288   HG12  VAL  40          2HG1      VAL  40   7.347   5.406  17.541
  289   HG13  VAL  40          3HG1      VAL  40   5.591   5.276  17.615
  290   HG21  VAL  40          3HG2      VAL  40   8.392   7.235  16.125
  291   HG22  VAL  40          1HG2      VAL  40   7.470   8.405  17.070
  292   HG23  VAL  40          2HG2      VAL  40   7.337   8.390  15.311
  293    H    LYS  41           H        LYS  41   3.978   6.201  13.979
  294    HA   LYS  41           HA       LYS  41   2.390   4.488  15.520
  295    HB2  LYS  41           2HB      LYS  41   1.592   6.342  14.024
  296    HB3  LYS  41           1HB      LYS  41   1.901   5.291  12.649
  297    HG2  LYS  41           2HG      LYS  41  -0.409   5.166  13.093
  298    HG3  LYS  41           1HG      LYS  41   0.288   3.657  13.681
  299    HD2  LYS  41           2HD      LYS  41   0.207   4.436  15.950
  300    HD3  LYS  41           1HD      LYS  41  -0.284   6.048  15.425
  301    HE2  LYS  41           2HE      LYS  41  -2.346   5.041  14.469
  302    HE3  LYS  41           1HE      LYS  41  -1.866   3.496  15.164
  303    HZ1  LYS  41           3HZ      LYS  41  -3.473   4.748  16.525
  304    HZ2  LYS  41           1HZ      LYS  41  -2.317   5.966  16.749
  305    HZ3  LYS  41           2HZ      LYS  41  -2.034   4.406  17.356
  306    H    ASP  42           H        ASP  42   4.280   3.920  12.627
  307    HA   ASP  42           HA       ASP  42   3.169   1.391  11.963
  308    HB2  ASP  42           2HB      ASP  42   4.459   2.878  10.398
  309    HB3  ASP  42           1HB      ASP  42   5.925   2.421  11.259
  310    H    VAL  43           H        VAL  43   5.517   2.433  14.255
  311    HA   VAL  43           HA       VAL  43   7.032   0.043  14.450
  312    HB   VAL  43           HB       VAL  43   6.685   2.208  16.528
  313   HG11  VAL  43          1HG1      VAL  43   8.831   0.110  16.198
  314   HG12  VAL  43          2HG1      VAL  43   7.609   0.163  17.469
  315   HG13  VAL  43          3HG1      VAL  43   8.847   1.415  17.384
  316   HG21  VAL  43          3HG2      VAL  43   8.733   1.900  14.338
  317   HG22  VAL  43          1HG2      VAL  43   8.794   3.108  15.621
  318   HG23  VAL  43          2HG2      VAL  43   7.485   3.138  14.441
  319    H    LEU  44           H        LEU  44   4.414   1.374  16.492
  320    HA   LEU  44           HA       LEU  44   4.287  -1.088  18.002
  321    HB2  LEU  44           2HB      LEU  44   2.491  -0.073  19.271
  322    HB3  LEU  44           1HB      LEU  44   3.849   1.023  19.156
  323    HG   LEU  44           HG       LEU  44   1.546   1.302  17.257
  324   HD11  LEU  44          1HD1      LEU  44   1.700   2.394  20.067
  325   HD12  LEU  44          2HD1      LEU  44   0.544   1.199  19.475
  326   HD13  LEU  44          3HD1      LEU  44   0.506   2.849  18.853
  327   HD21  LEU  44          3HD2      LEU  44   2.229   3.650  17.320
  328   HD22  LEU  44          1HD2      LEU  44   3.576   2.609  16.861
  329   HD23  LEU  44          2HD2      LEU  44   3.482   3.258  18.498
  330    H    ASP  45           H        ASP  45   3.099  -0.044  15.075
  331    HA   ASP  45           HA       ASP  45   0.694  -1.638  15.068
  332    HB2  ASP  45           2HB      ASP  45   0.673   0.226  13.585
  333    HB3  ASP  45           1HB      ASP  45   2.236  -0.212  12.900
  334    H    SER  46           H        SER  46   3.786  -1.826  13.318
  335    HA   SER  46           HA       SER  46   3.441  -4.743  13.208
  336    HB2  SER  46           2HB      SER  46   5.201  -2.966  11.499
  337    HB3  SER  46           1HB      SER  46   4.999  -4.709  11.314
  338    HG   SER  46           HG       SER  46   2.808  -2.908  11.193
  339    H    VAL  47           H        VAL  47   4.271  -5.314  15.154
  340    HA   VAL  47           HA       VAL  47   6.871  -4.285  15.979
  341    HB   VAL  47           HB       VAL  47   5.013  -4.476  17.631
  342   HG11  VAL  47          1HG1      VAL  47   5.381  -7.443  17.240
  343   HG12  VAL  47          2HG1      VAL  47   3.950  -6.504  16.819
  344   HG13  VAL  47          3HG1      VAL  47   4.413  -6.694  18.509
  345   HG21  VAL  47          3HG2      VAL  47   7.421  -6.187  18.205
  346   HG22  VAL  47          1HG2      VAL  47   6.335  -5.508  19.419
  347   HG23  VAL  47          2HG2      VAL  47   7.306  -4.438  18.406
  348    H    LEU  48           H        LEU  48   5.524  -6.906  14.320
  349    HA   LEU  48           HA       LEU  48   8.009  -8.458  14.619
  350    HB2  LEU  48           2HB      LEU  48   5.251  -9.425  13.845
  351    HB3  LEU  48           1HB      LEU  48   6.689 -10.424  13.906
  352    HG   LEU  48           HG       LEU  48   5.435  -9.044  16.282
  353   HD11  LEU  48          1HD1      LEU  48   4.036 -10.851  15.428
  354   HD12  LEU  48          2HD1      LEU  48   4.774 -11.296  16.967
  355   HD13  LEU  48          3HD1      LEU  48   5.418 -11.946  15.459
  356   HD21  LEU  48          3HD2      LEU  48   7.708 -11.020  16.100
  357   HD22  LEU  48          1HD2      LEU  48   6.988 -10.414  17.595
  358   HD23  LEU  48          2HD2      LEU  48   7.846  -9.312  16.516
  Start of MODEL   11
    1    H1   SER   1           1HT      SER   1  -7.570   7.857  21.711
    2    H2   SER   1           2HT      SER   1  -8.188   7.670  20.147
    3    H3   SER   1           3HT      SER   1  -9.179   7.368  21.479
    4    HA   SER   1           HA       SER   1  -8.070   9.975  20.639
    5    HB2  SER   1           2HB      SER   1 -10.926   8.974  20.772
    6    HB3  SER   1           1HB      SER   1 -10.398  10.555  20.195
    7    HG   SER   1           HG       SER   1  -9.705   9.691  18.370
    8    H    SER   2           H        SER   2  -9.896  11.588  21.857
    9    HA   SER   2           HA       SER   2 -10.174  12.738  23.794
   10    HB2  SER   2           2HB      SER   2 -10.325   9.974  25.031
   11    HB3  SER   2           1HB      SER   2 -10.907  11.469  25.763
   12    HG   SER   2           HG       SER   2 -12.682  11.253  24.665
   13    H    LEU   3           H        LEU   3  -7.595  12.584  22.983
   14    HA   LEU   3           HA       LEU   3  -5.799  11.543  24.934
   15    HB2  LEU   3           2HB      LEU   3  -5.384  12.053  22.445
   16    HB3  LEU   3           1HB      LEU   3  -5.176  13.717  22.945
   17    HG   LEU   3           HG       LEU   3  -3.495  11.468  24.050
   18   HD11  LEU   3          1HD1      LEU   3  -3.213  11.540  21.632
   19   HD12  LEU   3          2HD1      LEU   3  -1.770  12.135  22.452
   20   HD13  LEU   3          3HD1      LEU   3  -2.894  13.274  21.710
   21   HD21  LEU   3          3HD2      LEU   3  -3.083  14.459  23.969
   22   HD22  LEU   3          1HD2      LEU   3  -1.940  13.277  24.611
   23   HD23  LEU   3          2HD2      LEU   3  -3.505  13.505  25.391
   24    H    LEU   4           H        LEU   4  -6.586  14.893  24.031
   25    HA   LEU   4           HA       LEU   4  -6.301  15.698  26.832
   26    HB2  LEU   4           2HB      LEU   4  -4.134  16.118  25.675
   27    HB3  LEU   4           1HB      LEU   4  -4.979  17.135  24.524
   28    HG   LEU   4           HG       LEU   4  -5.629  18.630  26.422
   29   HD11  LEU   4          1HD1      LEU   4  -5.411  16.995  28.227
   30   HD12  LEU   4          2HD1      LEU   4  -4.429  18.429  28.530
   31   HD13  LEU   4          3HD1      LEU   4  -3.666  16.939  27.967
   32   HD21  LEU   4          3HD2      LEU   4  -3.753  19.162  24.967
   33   HD22  LEU   4          1HD2      LEU   4  -2.676  18.205  25.985
   34   HD23  LEU   4          2HD2      LEU   4  -3.424  19.668  26.623
   35    H    GLU   5           H        GLU   5  -6.643  17.401  23.755
   36    HA   GLU   5           HA       GLU   5  -9.181  18.542  24.650
   37    HB2  GLU   5           2HB      GLU   5  -7.510  19.148  22.193
   38    HB3  GLU   5           1HB      GLU   5  -8.935  20.039  22.714
   39    HG2  GLU   5           2HG      GLU   5  -6.336  19.828  24.218
   40    HG3  GLU   5           1HG      GLU   5  -6.888  21.218  23.284
   41    H    LYS   6           H        LYS   6  -9.546  15.973  24.332
   42    HA   LYS   6           HA       LYS   6 -10.489  14.245  23.231
   43    HB2  LYS   6           2HB      LYS   6 -11.678  16.482  21.583
   44    HB3  LYS   6           1HB      LYS   6 -12.158  14.798  21.437
   45    HG2  LYS   6           2HG      LYS   6 -12.408  16.494  23.915
   46    HG3  LYS   6           1HG      LYS   6 -13.719  16.057  22.817
   47    HD2  LYS   6           2HD      LYS   6 -13.299  13.676  23.326
   48    HD3  LYS   6           1HD      LYS   6 -12.063  14.168  24.485
   49    HE2  LYS   6           2HE      LYS   6 -14.122  13.694  25.650
   50    HE3  LYS   6           1HE      LYS   6 -13.773  15.418  25.739
   51    HZ1  LYS   6           3HZ      LYS   6 -16.117  14.938  25.257
   52    HZ2  LYS   6           1HZ      LYS   6 -15.664  14.172  23.814
   53    HZ3  LYS   6           2HZ      LYS   6 -15.385  15.832  24.020
   54    H    GLY   7           H        GLY   7 -10.331  16.159  20.317
   55    HA2  GLY   7           2HA      GLY   7  -7.914  14.929  19.347
   56    HA3  GLY   7           1HA      GLY   7  -9.377  14.299  18.592
   57    H    LEU   8           H        LEU   8  -8.401  17.501  19.684
   58    HA   LEU   8           HA       LEU   8  -9.842  19.085  18.076
   59    HB2  LEU   8           2HB      LEU   8  -8.365  19.850  19.875
   60    HB3  LEU   8           1HB      LEU   8  -6.971  19.563  18.852
   61    HG   LEU   8           HG       LEU   8  -7.825  21.286  17.273
   62   HD11  LEU   8          1HD1      LEU   8  -9.856  21.775  19.452
   63   HD12  LEU   8          2HD1      LEU   8 -10.189  21.190  17.822
   64   HD13  LEU   8          3HD1      LEU   8  -9.574  22.826  18.063
   65   HD21  LEU   8          3HD2      LEU   8  -6.139  21.835  18.942
   66   HD22  LEU   8          1HD2      LEU   8  -7.402  22.194  20.118
   67   HD23  LEU   8          2HD2      LEU   8  -7.226  23.197  18.678
   68    H    ASP   9           H        ASP   9  -6.451  18.333  17.196
   69    HA   ASP   9           HA       ASP   9  -7.183  18.957  14.428
   70    HB2  ASP   9           2HB      ASP   9  -5.252  20.160  15.575
   71    HB3  ASP   9           1HB      ASP   9  -4.380  18.632  15.488
   72    H    GLY  10           H        GLY  10  -6.360  16.381  16.498
   73    HA2  GLY  10           2HA      GLY  10  -5.024  14.646  14.718
   74    HA3  GLY  10           1HA      GLY  10  -5.860  14.163  16.187
   75    H    ALA  11           H        ALA  11  -8.324  15.530  14.930
   76    HA   ALA  11           HA       ALA  11  -9.537  13.204  13.918
   77    HB1  ALA  11           1HB      ALA  11 -10.792  15.030  14.962
   78    HB2  ALA  11           2HB      ALA  11 -11.424  14.635  13.363
   79    HB3  ALA  11           3HB      ALA  11 -10.420  16.067  13.585
   80    H    LYS  12           H        LYS  12  -7.713  15.730  12.348
   81    HA   LYS  12           HA       LYS  12  -8.482  14.635   9.718
   82    HB2  LYS  12           2HB      LYS  12  -7.160  17.301  10.229
   83    HB3  LYS  12           1HB      LYS  12  -7.829  16.721   8.712
   84    HG2  LYS  12           2HG      LYS  12  -9.559  18.021   9.304
   85    HG3  LYS  12           1HG      LYS  12 -10.030  16.615  10.261
   86    HD2  LYS  12           2HD      LYS  12 -10.086  18.786  11.504
   87    HD3  LYS  12           1HD      LYS  12  -9.056  17.553  12.237
   88    HE2  LYS  12           2HE      LYS  12  -7.088  18.583  11.240
   89    HE3  LYS  12           1HE      LYS  12  -8.102  19.791  10.455
   90    HZ1  LYS  12           3HZ      LYS  12  -8.581  20.811  12.462
   91    HZ2  LYS  12           1HZ      LYS  12  -6.934  20.421  12.610
   92    HZ3  LYS  12           2HZ      LYS  12  -8.111  19.473  13.385
   93    H    LYS  13           H        LYS  13  -6.414  13.648  11.664
   94    HA   LYS  13           HA       LYS  13  -3.876  14.386  10.577
   95    HB2  LYS  13           2HB      LYS  13  -4.789  12.967  12.848
   96    HB3  LYS  13           1HB      LYS  13  -3.715  11.888  11.967
   97    HG2  LYS  13           2HG      LYS  13  -2.486  13.160  13.621
   98    HG3  LYS  13           1HG      LYS  13  -1.971  13.609  11.993
   99    HD2  LYS  13           2HD      LYS  13  -3.536  15.557  12.131
  100    HD3  LYS  13           1HD      LYS  13  -3.812  15.141  13.824
  101    HE2  LYS  13           2HE      LYS  13  -2.153  16.852  13.764
  102    HE3  LYS  13           1HE      LYS  13  -1.349  15.342  14.192
  103    HZ1  LYS  13           3HZ      LYS  13  -0.854  15.170  11.705
  104    HZ2  LYS  13           1HZ      LYS  13   0.035  16.303  12.604
  105    HZ3  LYS  13           2HZ      LYS  13  -1.256  16.811  11.635
  106    H    ALA  14           H        ALA  14  -6.286  12.230   9.573
  107    HA   ALA  14           HA       ALA  14  -4.572  10.436   8.128
  108    HB1  ALA  14           1HB      ALA  14  -6.811   9.743   8.821
  109    HB2  ALA  14           2HB      ALA  14  -6.626   9.646   7.069
  110    HB3  ALA  14           3HB      ALA  14  -7.518  10.986   7.789
  111    H    VAL  15           H        VAL  15  -3.206  11.747   6.956
  112    HA   VAL  15           HA       VAL  15  -2.433  13.056   5.283
  113    HB   VAL  15           HB       VAL  15  -5.119  12.628   3.964
  114   HG11  VAL  15          1HG1      VAL  15  -3.934  13.099   1.880
  115   HG12  VAL  15          2HG1      VAL  15  -2.450  13.401   2.784
  116   HG13  VAL  15          3HG1      VAL  15  -3.839  14.468   2.988
  117   HG21  VAL  15          3HG2      VAL  15  -4.041  10.797   2.756
  118   HG22  VAL  15          1HG2      VAL  15  -4.063  10.502   4.493
  119   HG23  VAL  15          2HG2      VAL  15  -2.575  11.032   3.708
  120    H    GLY  16           H        GLY  16  -2.420  14.785   6.789
  121    HA2  GLY  16           2HA      GLY  16  -4.640  16.680   6.652
  122    HA3  GLY  16           1HA      GLY  16  -3.311  16.723   7.799
  123    H    GLY  17           H        GLY  17  -2.492  16.192   4.525
  124    HA2  GLY  17           2HA      GLY  17  -1.151  18.770   4.456
  125    HA3  GLY  17           1HA      GLY  17  -0.911  17.438   3.335
  126    H    LEU  18           H        LEU  18  -3.757  19.343   4.334
  127    HA   LEU  18           HA       LEU  18  -4.380  19.709   1.496
  128    HB2  LEU  18           2HB      LEU  18  -6.612  20.369   2.187
  129    HB3  LEU  18           1HB      LEU  18  -6.194  18.807   2.852
  130    HG   LEU  18           HG       LEU  18  -5.980  21.328   4.491
  131   HD11  LEU  18          1HD1      LEU  18  -8.204  20.792   5.383
  132   HD12  LEU  18          2HD1      LEU  18  -8.375  19.524   4.171
  133   HD13  LEU  18          3HD1      LEU  18  -8.260  21.210   3.672
  134   HD21  LEU  18          3HD2      LEU  18  -6.294  18.412   5.203
  135   HD22  LEU  18          1HD2      LEU  18  -6.259  19.745   6.358
  136   HD23  LEU  18          2HD2      LEU  18  -4.832  19.382   5.385
  137    H    GLY  19           H        GLY  19  -4.210  21.575   4.498
  138    HA2  GLY  19           2HA      GLY  19  -3.046  23.806   3.015
  139    HA3  GLY  19           1HA      GLY  19  -4.522  24.123   3.925
  140    H    LYS  20           H        LYS  20  -1.637  22.176   4.559
  141    HA   LYS  20           HA       LYS  20  -1.801  22.671   7.343
  142    HB2  LYS  20           2HB      LYS  20   0.321  21.403   7.458
  143    HB3  LYS  20           1HB      LYS  20  -0.936  20.581   6.550
  144    HG2  LYS  20           2HG      LYS  20   0.139  21.377   4.454
  145    HG3  LYS  20           1HG      LYS  20   1.454  22.030   5.438
  146    HD2  LYS  20           2HD      LYS  20   1.806  19.751   6.369
  147    HD3  LYS  20           1HD      LYS  20   0.598  19.145   5.237
  148    HE2  LYS  20           2HE      LYS  20   1.964  19.864   3.361
  149    HE3  LYS  20           1HE      LYS  20   3.148  20.557   4.468
  150    HZ1  LYS  20           3HZ      LYS  20   3.415  18.268   5.401
  151    HZ2  LYS  20           1HZ      LYS  20   3.965  18.457   3.804
  152    HZ3  LYS  20           2HZ      LYS  20   2.482  17.689   4.104
  153    H    LEU  21           H        LEU  21  -0.241  24.339   4.779
  154    HA   LEU  21           HA       LEU  21   1.684  25.675   6.452
  155    HB2  LEU  21           2HB      LEU  21   0.777  26.259   3.632
  156    HB3  LEU  21           1HB      LEU  21   2.109  27.059   4.442
  157    HG   LEU  21           HG       LEU  21   1.978  24.125   3.743
  158   HD11  LEU  21          1HD1      LEU  21   3.623  26.371   2.592
  159   HD12  LEU  21          2HD1      LEU  21   2.276  25.555   1.797
  160   HD13  LEU  21          3HD1      LEU  21   3.757  24.667   2.160
  161   HD21  LEU  21          3HD2      LEU  21   3.226  24.493   5.800
  162   HD22  LEU  21          1HD2      LEU  21   4.183  25.748   5.013
  163   HD23  LEU  21          2HD2      LEU  21   4.318  24.072   4.481
  164    H    GLY  22           H        GLY  22  -1.616  26.002   5.804
  165    HA2  GLY  22           2HA      GLY  22  -2.005  28.772   5.765
  166    HA3  GLY  22           1HA      GLY  22  -3.186  27.591   6.310
  167    H    LYS  23           H        LYS  23  -2.573  26.658   8.591
  168    HA   LYS  23           HA       LYS  23  -2.192  28.989  10.299
  169    HB2  LYS  23           2HB      LYS  23  -3.044  27.628  12.115
  170    HB3  LYS  23           1HB      LYS  23  -4.126  27.524  10.736
  171    HG2  LYS  23           2HG      LYS  23  -3.273  25.336  10.178
  172    HG3  LYS  23           1HG      LYS  23  -2.073  25.445  11.470
  173    HD2  LYS  23           2HD      LYS  23  -3.867  25.578  13.126
  174    HD3  LYS  23           1HD      LYS  23  -5.068  25.474  11.838
  175    HE2  LYS  23           2HE      LYS  23  -4.191  23.254  11.233
  176    HE3  LYS  23           1HE      LYS  23  -3.042  23.361  12.566
  177    HZ1  LYS  23           3HZ      LYS  23  -4.859  23.442  14.122
  178    HZ2  LYS  23           1HZ      LYS  23  -5.035  22.071  13.132
  179    HZ3  LYS  23           2HZ      LYS  23  -5.993  23.449  12.866
  180    H    ASP  24           H        ASP  24  -0.352  26.591   8.979
  181    HA   ASP  24           HA       ASP  24   1.863  26.141   9.122
  182    HB2  ASP  24           2HB      ASP  24   2.138  28.508   9.800
  183    HB3  ASP  24           1HB      ASP  24   1.941  28.025  11.482
  184    H    ALA  25           H        ALA  25   0.163  26.151  12.214
  185    HA   ALA  25           HA       ALA  25   1.905  24.285  13.476
  186    HB1  ALA  25           1HB      ALA  25   0.267  24.255  15.264
  187    HB2  ALA  25           2HB      ALA  25  -0.901  25.081  14.234
  188    HB3  ALA  25           3HB      ALA  25   0.573  25.910  14.736
  189    H    VAL  26           H        VAL  26   1.545  22.992  11.264
  190    HA   VAL  26           HA       VAL  26  -0.077  20.685  12.106
  191    HB   VAL  26           HB       VAL  26   0.274  21.555   9.225
  192   HG11  VAL  26          1HG1      VAL  26  -1.319  19.750   8.736
  193   HG12  VAL  26          2HG1      VAL  26  -1.318  19.297  10.440
  194   HG13  VAL  26          3HG1      VAL  26   0.157  19.142   9.486
  195   HG21  VAL  26          3HG2      VAL  26  -2.179  21.662  10.980
  196   HG22  VAL  26          1HG2      VAL  26  -2.144  22.000   9.250
  197   HG23  VAL  26          2HG2      VAL  26  -1.270  23.044  10.370
  198    H    GLU  27           H        GLU  27   2.439  21.740   9.813
  199    HA   GLU  27           HA       GLU  27   3.841  19.295   9.740
  200    HB2  GLU  27           2HB      GLU  27   4.642  22.138   9.144
  201    HB3  GLU  27           1HB      GLU  27   5.800  20.819   9.039
  202    HG2  GLU  27           2HG      GLU  27   3.211  20.913   7.513
  203    HG3  GLU  27           1HG      GLU  27   4.759  21.472   6.879
  204    H    ASP  28           H        ASP  28   3.699  21.832  12.047
  205    HA   ASP  28           HA       ASP  28   6.081  21.623  13.427
  206    HB2  ASP  28           2HB      ASP  28   4.534  23.328  14.049
  207    HB3  ASP  28           1HB      ASP  28   3.272  22.152  14.397
  208    H    LEU  29           H        LEU  29   3.066  19.922  14.243
  209    HA   LEU  29           HA       LEU  29   4.141  18.321  16.262
  210    HB2  LEU  29           2HB      LEU  29   1.739  18.755  15.925
  211    HB3  LEU  29           1HB      LEU  29   1.768  17.752  14.488
  212    HG   LEU  29           HG       LEU  29   2.373  15.801  15.893
  213   HD11  LEU  29          1HD1      LEU  29   1.925  17.721  18.176
  214   HD12  LEU  29          2HD1      LEU  29   3.455  16.964  17.733
  215   HD13  LEU  29          3HD1      LEU  29   2.122  15.975  18.327
  216   HD21  LEU  29          3HD2      LEU  29  -0.136  17.256  16.721
  217   HD22  LEU  29          1HD2      LEU  29   0.167  15.529  16.913
  218   HD23  LEU  29          2HD2      LEU  29   0.048  16.228  15.299
  219    H    GLU  30           H        GLU  30   4.084  17.897  12.813
  220    HA   GLU  30           HA       GLU  30   4.792  15.118  12.871
  221    HB2  GLU  30           2HB      GLU  30   5.191  17.017  10.562
  222    HB3  GLU  30           1HB      GLU  30   4.970  15.274  10.503
  223    HG2  GLU  30           2HG      GLU  30   2.908  17.349  11.194
  224    HG3  GLU  30           1HG      GLU  30   2.965  16.329   9.758
  225    H    SER  31           H        SER  31   6.521  18.134  12.151
  226    HA   SER  31           HA       SER  31   8.979  16.872  11.544
  227    HB2  SER  31           2HB      SER  31   8.479  19.752  12.322
  228    HB3  SER  31           1HB      SER  31   9.904  19.125  11.492
  229    HG   SER  31           HG       SER  31   7.261  19.386  10.541
  230    H    VAL  32           H        VAL  32   7.653  18.145  14.558
  231    HA   VAL  32           HA       VAL  32  10.074  18.337  15.980
  232    HB   VAL  32           HB       VAL  32   8.739  18.175  18.051
  233   HG11  VAL  32          1HG1      VAL  32   7.531  19.940  15.929
  234   HG12  VAL  32          2HG1      VAL  32   8.946  20.316  16.911
  235   HG13  VAL  32          3HG1      VAL  32   7.361  20.162  17.670
  236   HG21  VAL  32          3HG2      VAL  32   7.114  16.503  17.321
  237   HG22  VAL  32          1HG2      VAL  32   6.417  17.669  16.196
  238   HG23  VAL  32          2HG2      VAL  32   6.310  17.949  17.935
  239    H    GLY  33           H        GLY  33   8.257  15.584  15.011
  240    HA2  GLY  33           2HA      GLY  33  10.032  13.892  16.660
  241    HA3  GLY  33           1HA      GLY  33   8.410  13.413  16.171
  242    H    LYS  34           H        LYS  34  10.169  15.142  13.820
  243    HA   LYS  34           HA       LYS  34  10.829  14.589  11.715
  244    HB2  LYS  34           2HB      LYS  34  12.154  12.558  13.457
  245    HB3  LYS  34           1HB      LYS  34  12.248  12.342  11.714
  246    HG2  LYS  34           2HG      LYS  34  14.200  13.510  12.603
  247    HG3  LYS  34           1HG      LYS  34  13.297  14.513  11.471
  248    HD2  LYS  34           2HD      LYS  34  12.254  15.690  13.349
  249    HD3  LYS  34           1HD      LYS  34  13.156  14.680  14.481
  250    HE2  LYS  34           2HE      LYS  34  15.251  15.565  13.664
  251    HE3  LYS  34           1HE      LYS  34  14.410  16.493  12.425
  252    HZ1  LYS  34           3HZ      LYS  34  15.081  17.804  14.396
  253    HZ2  LYS  34           1HZ      LYS  34  14.013  16.885  15.342
  254    HZ3  LYS  34           2HZ      LYS  34  13.415  17.860  14.088
  255    H    GLY  35           H        GLY  35   8.227  13.925  12.224
  256    HA2  GLY  35           2HA      GLY  35   6.684  12.768  10.800
  257    HA3  GLY  35           1HA      GLY  35   7.863  11.466  10.644
  258    H    ALA  36           H        ALA  36   6.456  13.181  13.418
  259    HA   ALA  36           HA       ALA  36   6.606  11.080  15.207
  260    HB1  ALA  36           1HB      ALA  36   6.231  13.399  15.870
  261    HB2  ALA  36           2HB      ALA  36   5.036  12.323  16.594
  262    HB3  ALA  36           3HB      ALA  36   4.597  13.326  15.212
  263    H    VAL  37           H        VAL  37   3.609  12.168  13.586
  264    HA   VAL  37           HA       VAL  37   2.030  10.050  14.533
  265    HB   VAL  37           HB       VAL  37   1.606  11.659  12.008
  266   HG11  VAL  37          1HG1      VAL  37  -0.336  10.121  13.729
  267   HG12  VAL  37          2HG1      VAL  37   0.183   9.698  12.098
  268   HG13  VAL  37          3HG1      VAL  37  -0.773  11.154  12.369
  269   HG21  VAL  37          3HG2      VAL  37   1.910  13.128  13.921
  270   HG22  VAL  37          1HG2      VAL  37   0.708  12.215  14.837
  271   HG23  VAL  37          2HG2      VAL  37   0.224  13.131  13.410
  272    H    HIS  38           H        HIS  38   4.113  10.318  11.755
  273    HA   HIS  38           HA       HIS  38   3.071   8.032  10.380
  274    HB2  HIS  38           2HB      HIS  38   4.157   9.881   9.179
  275    HB3  HIS  38           1HB      HIS  38   5.669   9.546  10.009
  276    HD1  HIS  38           1HD      HIS  38   3.890   8.831   6.959
  277    HD2  HIS  38           2HD      HIS  38   6.716   6.848   9.280
  278    HE1  HIS  38           1HE      HIS  38   4.901   7.083   5.459
  279    HE2  HIS  38           2HE      HIS  38   6.781   6.085   6.811
  280    H    ASP  39           H        ASP  39   6.285   8.625  11.798
  281    HA   ASP  39           HA       ASP  39   7.099   5.949  11.467
  282    HB2  ASP  39           2HB      ASP  39   8.253   8.230  13.065
  283    HB3  ASP  39           1HB      ASP  39   9.040   6.659  12.931
  284    H    VAL  40           H        VAL  40   6.062   7.725  14.379
  285    HA   VAL  40           HA       VAL  40   6.642   5.717  16.230
  286    HB   VAL  40           HB       VAL  40   4.482   7.828  16.337
  287   HG11  VAL  40          1HG1      VAL  40   4.458   7.443  18.763
  288   HG12  VAL  40          2HG1      VAL  40   5.560   6.084  18.550
  289   HG13  VAL  40          3HG1      VAL  40   3.935   6.015  17.867
  290   HG21  VAL  40          3HG2      VAL  40   7.243   7.723  17.546
  291   HG22  VAL  40          1HG2      VAL  40   6.066   9.016  17.775
  292   HG23  VAL  40          2HG2      VAL  40   6.748   8.717  16.177
  293    H    LYS  41           H        LYS  41   3.644   6.296  14.401
  294    HA   LYS  41           HA       LYS  41   2.265   4.132  15.679
  295    HB2  LYS  41           2HB      LYS  41   1.246   6.241  14.611
  296    HB3  LYS  41           1HB      LYS  41   1.452   5.409  13.076
  297    HG2  LYS  41           2HG      LYS  41   0.034   3.587  13.862
  298    HG3  LYS  41           1HG      LYS  41  -0.169   4.408  15.411
  299    HD2  LYS  41           2HD      LYS  41  -2.104   4.917  14.163
  300    HD3  LYS  41           1HD      LYS  41  -1.100   6.365  14.087
  301    HE2  LYS  41           2HE      LYS  41  -1.953   5.978  11.900
  302    HE3  LYS  41           1HE      LYS  41  -0.245   5.542  11.877
  303    HZ1  LYS  41           3HZ      LYS  41  -0.900   3.208  12.141
  304    HZ2  LYS  41           1HZ      LYS  41  -1.547   3.885  10.728
  305    HZ3  LYS  41           2HZ      LYS  41  -2.533   3.658  12.088
  306    H    ASP  42           H        ASP  42   4.289   4.480  12.899
  307    HA   ASP  42           HA       ASP  42   3.422   2.093  11.568
  308    HB2  ASP  42           2HB      ASP  42   4.422   4.006  10.356
  309    HB3  ASP  42           1HB      ASP  42   5.953   3.702  11.167
  310    H    VAL  43           H        VAL  43   6.059   2.949  13.758
  311    HA   VAL  43           HA       VAL  43   7.471   0.511  13.522
  312    HB   VAL  43           HB       VAL  43   7.447   2.506  15.795
  313   HG11  VAL  43          1HG1      VAL  43   9.375   0.257  15.223
  314   HG12  VAL  43          2HG1      VAL  43   8.240   0.336  16.570
  315   HG13  VAL  43          3HG1      VAL  43   9.571   1.488  16.473
  316   HG21  VAL  43          3HG2      VAL  43   9.343   2.131  13.478
  317   HG22  VAL  43          1HG2      VAL  43   9.561   3.275  14.805
  318   HG23  VAL  43          2HG2      VAL  43   8.206   3.462  13.692
  319    H    LEU  44           H        LEU  44   4.848   1.540  15.662
  320    HA   LEU  44           HA       LEU  44   4.959  -1.060  16.998
  321    HB2  LEU  44           2HB      LEU  44   3.242  -0.052  18.541
  322    HB3  LEU  44           1HB      LEU  44   4.828   0.681  18.575
  323    HG   LEU  44           HG       LEU  44   3.848   2.459  16.997
  324   HD11  LEU  44          1HD1      LEU  44   1.795   1.282  16.407
  325   HD12  LEU  44          2HD1      LEU  44   1.447   2.825  17.188
  326   HD13  LEU  44          3HD1      LEU  44   1.281   1.321  18.095
  327   HD21  LEU  44          3HD2      LEU  44   4.453   2.878  19.312
  328   HD22  LEU  44          1HD2      LEU  44   2.896   2.245  19.847
  329   HD23  LEU  44          2HD2      LEU  44   2.964   3.725  18.890
  330    H    ASP  45           H        ASP  45   3.963  -0.598  14.217
  331    HA   ASP  45           HA       ASP  45   1.132  -0.848  14.251
  332    HB2  ASP  45           2HB      ASP  45   2.384  -0.064  12.264
  333    HB3  ASP  45           1HB      ASP  45   3.062  -1.679  12.071
  334    H    SER  46           H        SER  46   3.753  -3.229  13.868
  335    HA   SER  46           HA       SER  46   1.824  -5.389  13.811
  336    HB2  SER  46           2HB      SER  46   3.909  -5.360  12.387
  337    HB3  SER  46           1HB      SER  46   4.838  -5.620  13.860
  338    HG   SER  46           HG       SER  46   2.823  -7.330  12.814
  339    H    VAL  47           H        VAL  47   1.137  -4.572  16.029
  340    HA   VAL  47           HA       VAL  47   2.566  -6.142  18.072
  341    HB   VAL  47           HB       VAL  47   0.363  -4.087  18.449
  342   HG11  VAL  47          1HG1      VAL  47   0.333  -5.826  20.170
  343   HG12  VAL  47          2HG1      VAL  47   0.847  -4.275  20.834
  344   HG13  VAL  47          3HG1      VAL  47   2.039  -5.532  20.502
  345   HG21  VAL  47          3HG2      VAL  47   2.126  -2.699  19.461
  346   HG22  VAL  47          1HG2      VAL  47   2.433  -3.033  17.756
  347   HG23  VAL  47          2HG2      VAL  47   3.323  -3.908  19.001
  348    H    LEU  48           H        LEU  48  -0.262  -5.841  16.154
  349    HA   LEU  48           HA       LEU  48  -1.711  -7.896  17.611
  350    HB2  LEU  48           2HB      LEU  48  -2.444  -6.234  15.197
  351    HB3  LEU  48           1HB      LEU  48  -3.475  -7.481  15.867
  352    HG   LEU  48           HG       LEU  48  -3.422  -6.149  18.046
  353   HD11  LEU  48          1HD1      LEU  48  -1.526  -4.715  17.560
  354   HD12  LEU  48          2HD1      LEU  48  -2.977  -3.751  17.829
  355   HD13  LEU  48          3HD1      LEU  48  -2.385  -4.015  16.189
  356   HD21  LEU  48          3HD2      LEU  48  -4.721  -4.916  15.623
  357   HD22  LEU  48          1HD2      LEU  48  -5.194  -4.655  17.301
  358   HD23  LEU  48          2HD2      LEU  48  -5.367  -6.252  16.574
  Start of MODEL   12
    1    H1   SER   1           1HT      SER   1 -15.889  15.025  11.635
    2    H2   SER   1           2HT      SER   1 -17.100  14.059  10.946
    3    H3   SER   1           3HT      SER   1 -15.771  13.340  11.698
    4    HA   SER   1           HA       SER   1 -17.770  15.014  13.069
    5    HB2  SER   1           2HB      SER   1 -18.429  12.784  14.095
    6    HB3  SER   1           1HB      SER   1 -18.865  12.999  12.400
    7    HG   SER   1           HG       SER   1 -17.819  11.202  12.108
    8    H    SER   2           H        SER   2 -17.633  14.598  15.467
    9    HA   SER   2           HA       SER   2 -14.862  14.906  16.253
   10    HB2  SER   2           2HB      SER   2 -17.326  14.958  18.006
   11    HB3  SER   2           1HB      SER   2 -15.734  15.618  18.381
   12    HG   SER   2           HG       SER   2 -17.750  16.852  17.225
   13    H    LEU   3           H        LEU   3 -13.909  12.909  16.111
   14    HA   LEU   3           HA       LEU   3 -15.099  10.585  17.339
   15    HB2  LEU   3           2HB      LEU   3 -12.344  10.998  16.171
   16    HB3  LEU   3           1HB      LEU   3 -13.021   9.453  16.657
   17    HG   LEU   3           HG       LEU   3 -14.060  11.205  14.427
   18   HD11  LEU   3          1HD1      LEU   3 -11.917  10.144  13.911
   19   HD12  LEU   3          2HD1      LEU   3 -13.229   9.455  12.954
   20   HD13  LEU   3          3HD1      LEU   3 -12.592   8.573  14.342
   21   HD21  LEU   3          3HD2      LEU   3 -14.920   8.454  15.315
   22   HD22  LEU   3          1HD2      LEU   3 -15.529   9.326  13.909
   23   HD23  LEU   3          2HD2      LEU   3 -15.842   9.941  15.533
   24    H    LEU   4           H        LEU   4 -13.032  13.126  18.272
   25    HA   LEU   4           HA       LEU   4 -12.848  12.299  20.976
   26    HB2  LEU   4           2HB      LEU   4 -11.133  10.827  19.747
   27    HB3  LEU   4           1HB      LEU   4 -10.228  12.303  19.472
   28    HG   LEU   4           HG       LEU   4 -10.119  12.609  21.958
   29   HD11  LEU   4          1HD1      LEU   4 -12.038  11.253  22.582
   30   HD12  LEU   4          2HD1      LEU   4 -10.575  10.660  23.368
   31   HD13  LEU   4          3HD1      LEU   4 -11.234   9.807  21.970
   32   HD21  LEU   4          3HD2      LEU   4  -8.260  11.672  20.680
   33   HD22  LEU   4          1HD2      LEU   4  -8.945  10.056  20.864
   34   HD23  LEU   4          2HD2      LEU   4  -8.372  10.939  22.278
   35    H    GLU   5           H        GLU   5 -11.349  13.932  22.180
   36    HA   GLU   5           HA       GLU   5 -11.860  16.565  21.488
   37    HB2  GLU   5           2HB      GLU   5  -9.439  15.534  22.988
   38    HB3  GLU   5           1HB      GLU   5  -9.994  17.201  22.974
   39    HG2  GLU   5           2HG      GLU   5 -10.895  16.516  24.938
   40    HG3  GLU   5           1HG      GLU   5 -12.221  16.106  23.854
   41    H    LYS   6           H        LYS   6  -8.813  14.776  20.967
   42    HA   LYS   6           HA       LYS   6  -7.925  16.621  18.969
   43    HB2  LYS   6           2HB      LYS   6  -6.329  15.244  20.249
   44    HB3  LYS   6           1HB      LYS   6  -7.003  13.792  19.523
   45    HG2  LYS   6           2HG      LYS   6  -6.034  14.187  17.485
   46    HG3  LYS   6           1HG      LYS   6  -5.966  15.932  17.737
   47    HD2  LYS   6           2HD      LYS   6  -4.270  13.914  19.201
   48    HD3  LYS   6           1HD      LYS   6  -3.741  14.856  17.806
   49    HE2  LYS   6           2HE      LYS   6  -4.653  15.975  20.457
   50    HE3  LYS   6           1HE      LYS   6  -2.984  15.871  19.896
   51    HZ1  LYS   6           3HZ      LYS   6  -3.346  17.483  18.273
   52    HZ2  LYS   6           1HZ      LYS   6  -4.189  18.082  19.619
   53    HZ3  LYS   6           2HZ      LYS   6  -5.035  17.342  18.356
   54    H    GLY   7           H        GLY   7  -9.107  16.884  17.263
   55    HA2  GLY   7           2HA      GLY   7  -9.597  15.484  15.108
   56    HA3  GLY   7           1HA      GLY   7 -10.685  14.645  16.213
   57    H    LEU   8           H        LEU   8 -11.783  16.559  17.712
   58    HA   LEU   8           HA       LEU   8 -13.444  18.007  15.869
   59    HB2  LEU   8           2HB      LEU   8 -14.545  18.912  17.893
   60    HB3  LEU   8           1HB      LEU   8 -14.482  17.164  17.864
   61    HG   LEU   8           HG       LEU   8 -12.378  17.477  19.384
   62   HD11  LEU   8          1HD1      LEU   8 -12.525  19.435  20.842
   63   HD12  LEU   8          2HD1      LEU   8 -13.823  20.083  19.838
   64   HD13  LEU   8          3HD1      LEU   8 -12.201  19.894  19.170
   65   HD21  LEU   8          3HD2      LEU   8 -15.169  17.987  20.396
   66   HD22  LEU   8          1HD2      LEU   8 -13.808  17.404  21.354
   67   HD23  LEU   8          2HD2      LEU   8 -14.463  16.408  20.054
   68    H    ASP   9           H        ASP   9 -10.639  18.630  17.776
   69    HA   ASP   9           HA       ASP   9 -10.688  21.485  17.469
   70    HB2  ASP   9           2HB      ASP   9  -8.511  21.465  18.480
   71    HB3  ASP   9           1HB      ASP   9  -9.475  20.254  19.318
   72    H    GLY  10           H        GLY  10  -9.587  18.761  15.666
   73    HA2  GLY  10           2HA      GLY  10  -7.843  20.240  13.920
   74    HA3  GLY  10           1HA      GLY  10  -8.342  18.565  13.729
   75    H    ALA  11           H        ALA  11 -11.187  19.227  13.894
   76    HA   ALA  11           HA       ALA  11 -11.767  19.499  11.186
   77    HB1  ALA  11           1HB      ALA  11 -13.285  18.517  12.873
   78    HB2  ALA  11           2HB      ALA  11 -14.077  19.694  11.829
   79    HB3  ALA  11           3HB      ALA  11 -13.624  20.141  13.473
   80    H    LYS  12           H        LYS  12 -11.810  21.947  13.750
   81    HA   LYS  12           HA       LYS  12 -12.617  24.010  11.880
   82    HB2  LYS  12           2HB      LYS  12 -11.895  24.115  14.811
   83    HB3  LYS  12           1HB      LYS  12 -12.350  25.526  13.870
   84    HG2  LYS  12           2HG      LYS  12 -14.299  24.919  14.988
   85    HG3  LYS  12           1HG      LYS  12 -14.516  24.278  13.361
   86    HD2  LYS  12           2HD      LYS  12 -13.948  22.060  14.093
   87    HD3  LYS  12           1HD      LYS  12 -13.512  22.652  15.696
   88    HE2  LYS  12           2HE      LYS  12 -16.260  22.665  14.454
   89    HE3  LYS  12           1HE      LYS  12 -15.698  21.614  15.755
   90    HZ1  LYS  12           3HZ      LYS  12 -15.261  23.750  17.023
   91    HZ2  LYS  12           1HZ      LYS  12 -16.890  23.324  16.796
   92    HZ3  LYS  12           2HZ      LYS  12 -16.188  24.530  15.833
   93    H    LYS  13           H        LYS  13  -9.777  22.509  12.556
   94    HA   LYS  13           HA       LYS  13  -8.131  24.921  12.324
   95    HB2  LYS  13           2HB      LYS  13  -7.630  23.438  14.190
   96    HB3  LYS  13           1HB      LYS  13  -7.420  22.087  13.091
   97    HG2  LYS  13           2HG      LYS  13  -5.702  24.419  12.580
   98    HG3  LYS  13           1HG      LYS  13  -5.406  23.555  14.089
   99    HD2  LYS  13           2HD      LYS  13  -5.362  21.434  12.704
  100    HD3  LYS  13           1HD      LYS  13  -5.318  22.476  11.281
  101    HE2  LYS  13           2HE      LYS  13  -3.272  23.506  12.057
  102    HE3  LYS  13           1HE      LYS  13  -3.330  22.562  13.543
  103    HZ1  LYS  13           3HZ      LYS  13  -2.820  21.601  10.790
  104    HZ2  LYS  13           1HZ      LYS  13  -3.244  20.546  12.055
  105    HZ3  LYS  13           2HZ      LYS  13  -1.827  21.462  12.167
  106    H    ALA  14           H        ALA  14  -8.807  21.838  10.781
  107    HA   ALA  14           HA       ALA  14  -6.803  21.939   8.802
  108    HB1  ALA  14           1HB      ALA  14  -7.982  19.883   9.378
  109    HB2  ALA  14           2HB      ALA  14  -8.118  20.228   7.653
  110    HB3  ALA  14           3HB      ALA  14  -9.479  20.550   8.728
  111    H    VAL  15           H        VAL  15 -10.013  23.332   8.989
  112    HA   VAL  15           HA       VAL  15 -10.210  24.083   6.259
  113    HB   VAL  15           HB       VAL  15 -12.169  23.964   7.753
  114   HG11  VAL  15          1HG1      VAL  15 -11.205  24.854   9.787
  115   HG12  VAL  15          2HG1      VAL  15 -12.626  25.794   9.331
  116   HG13  VAL  15          3HG1      VAL  15 -11.011  26.436   9.030
  117   HG21  VAL  15          3HG2      VAL  15 -12.359  25.249   5.717
  118   HG22  VAL  15          1HG2      VAL  15 -11.704  26.675   6.520
  119   HG23  VAL  15          2HG2      VAL  15 -13.274  26.034   7.004
  120    H    GLY  16           H        GLY  16  -8.515  25.390   8.968
  121    HA2  GLY  16           2HA      GLY  16  -8.101  27.992   7.749
  122    HA3  GLY  16           1HA      GLY  16  -7.406  27.419   9.259
  123    H    GLY  17           H        GLY  17  -6.548  24.905   7.833
  124    HA2  GLY  17           2HA      GLY  17  -3.941  25.917   7.101
  125    HA3  GLY  17           1HA      GLY  17  -4.406  24.230   7.243
  126    H    LEU  18           H        LEU  18  -6.517  26.091   5.338
  127    HA   LEU  18           HA       LEU  18  -5.633  24.755   2.931
  128    HB2  LEU  18           2HB      LEU  18  -7.864  26.745   3.362
  129    HB3  LEU  18           1HB      LEU  18  -7.578  25.845   1.885
  130    HG   LEU  18           HG       LEU  18  -8.331  24.647   4.554
  131   HD11  LEU  18          1HD1      LEU  18  -9.918  24.986   2.014
  132   HD12  LEU  18          2HD1      LEU  18 -10.157  25.885   3.513
  133   HD13  LEU  18          3HD1      LEU  18 -10.459  24.147   3.467
  134   HD21  LEU  18          3HD2      LEU  18  -6.919  23.145   3.264
  135   HD22  LEU  18          1HD2      LEU  18  -7.947  23.366   1.849
  136   HD23  LEU  18          2HD2      LEU  18  -8.583  22.561   3.284
  137    H    GLY  19           H        GLY  19  -5.219  27.800   4.458
  138    HA2  GLY  19           2HA      GLY  19  -3.135  28.775   3.114
  139    HA3  GLY  19           1HA      GLY  19  -4.445  29.159   2.005
  140    H    LYS  20           H        LYS  20  -3.695  29.431   5.479
  141    HA   LYS  20           HA       LYS  20  -4.671  32.200   5.378
  142    HB2  LYS  20           2HB      LYS  20  -5.350  30.150   7.497
  143    HB3  LYS  20           1HB      LYS  20  -5.692  31.869   7.633
  144    HG2  LYS  20           2HG      LYS  20  -6.808  30.025   5.529
  145    HG3  LYS  20           1HG      LYS  20  -7.663  30.588   6.966
  146    HD2  LYS  20           2HD      LYS  20  -7.578  32.863   6.195
  147    HD3  LYS  20           1HD      LYS  20  -6.536  32.411   4.844
  148    HE2  LYS  20           2HE      LYS  20  -8.794  32.717   4.053
  149    HE3  LYS  20           1HE      LYS  20  -8.361  31.012   3.948
  150    HZ1  LYS  20           3HZ      LYS  20 -10.006  32.262   6.086
  151    HZ2  LYS  20           1HZ      LYS  20  -9.588  30.618   6.003
  152    HZ3  LYS  20           2HZ      LYS  20 -10.588  31.301   4.813
  153    H    LEU  21           H        LEU  21  -3.286  33.604   6.230
  154    HA   LEU  21           HA       LEU  21  -0.765  32.778   7.206
  155    HB2  LEU  21           2HB      LEU  21  -2.113  35.476   7.361
  156    HB3  LEU  21           1HB      LEU  21  -0.421  35.179   7.708
  157    HG   LEU  21           HG       LEU  21  -1.769  34.823   5.029
  158   HD11  LEU  21          1HD1      LEU  21  -1.456  37.161   5.650
  159   HD12  LEU  21          2HD1      LEU  21  -0.370  36.700   4.340
  160   HD13  LEU  21          3HD1      LEU  21   0.248  36.851   5.985
  161   HD21  LEU  21          3HD2      LEU  21   0.488  34.393   4.181
  162   HD22  LEU  21          1HD2      LEU  21  -0.013  33.172   5.352
  163   HD23  LEU  21          2HD2      LEU  21   1.114  34.442   5.831
  164    H    GLY  22           H        GLY  22  -0.247  32.069   9.140
  165    HA2  GLY  22           2HA      GLY  22  -0.364  32.475  11.588
  166    HA3  GLY  22           1HA      GLY  22  -2.104  32.629  11.369
  167    H    LYS  23           H        LYS  23  -2.503  30.555   9.558
  168    HA   LYS  23           HA       LYS  23  -2.101  28.215  11.268
  169    HB2  LYS  23           2HB      LYS  23  -3.797  28.536   8.782
  170    HB3  LYS  23           1HB      LYS  23  -3.768  27.126   9.830
  171    HG2  LYS  23           2HG      LYS  23  -4.705  29.882  10.594
  172    HG3  LYS  23           1HG      LYS  23  -5.732  28.493  10.239
  173    HD2  LYS  23           2HD      LYS  23  -4.635  27.293  12.135
  174    HD3  LYS  23           1HD      LYS  23  -3.802  28.796  12.536
  175    HE2  LYS  23           2HE      LYS  23  -5.993  29.905  12.788
  176    HE3  LYS  23           1HE      LYS  23  -6.785  28.362  12.474
  177    HZ1  LYS  23           3HZ      LYS  23  -5.161  29.152  14.816
  178    HZ2  LYS  23           1HZ      LYS  23  -5.435  27.520  14.442
  179    HZ3  LYS  23           2HZ      LYS  23  -6.743  28.540  14.772
  180    H    ASP  24           H        ASP  24  -0.995  29.701   8.429
  181    HA   ASP  24           HA       ASP  24  -0.175  27.627   6.795
  182    HB2  ASP  24           2HB      ASP  24  -0.092  30.000   6.168
  183    HB3  ASP  24           1HB      ASP  24   1.212  30.266   7.317
  184    H    ALA  25           H        ALA  25   1.671  29.219   9.389
  185    HA   ALA  25           HA       ALA  25   3.959  27.563   9.147
  186    HB1  ALA  25           1HB      ALA  25   4.661  28.540  11.264
  187    HB2  ALA  25           2HB      ALA  25   3.039  29.188  11.515
  188    HB3  ALA  25           3HB      ALA  25   4.029  29.777  10.180
  189    H    VAL  26           H        VAL  26   0.920  27.144  10.698
  190    HA   VAL  26           HA       VAL  26   1.732  25.205  12.631
  191    HB   VAL  26           HB       VAL  26  -1.034  25.553  11.464
  192   HG11  VAL  26          1HG1      VAL  26  -0.095  24.499  14.129
  193   HG12  VAL  26          2HG1      VAL  26  -0.746  23.542  12.798
  194   HG13  VAL  26          3HG1      VAL  26  -1.776  24.701  13.635
  195   HG21  VAL  26          3HG2      VAL  26   0.217  27.020  13.783
  196   HG22  VAL  26          1HG2      VAL  26  -1.471  27.123  13.284
  197   HG23  VAL  26          2HG2      VAL  26  -0.197  27.714  12.216
  198    H    GLU  27           H        GLU  27   0.032  24.986   9.508
  199    HA   GLU  27           HA       GLU  27   0.081  22.187   9.281
  200    HB2  GLU  27           2HB      GLU  27   0.026  24.363   7.187
  201    HB3  GLU  27           1HB      GLU  27  -0.115  22.654   6.796
  202    HG2  GLU  27           2HG      GLU  27  -1.976  24.120   8.650
  203    HG3  GLU  27           1HG      GLU  27  -2.272  23.884   6.927
  204    H    ASP  28           H        ASP  28   2.441  24.651   8.568
  205    HA   ASP  28           HA       ASP  28   4.208  23.103   7.017
  206    HB2  ASP  28           2HB      ASP  28   4.263  25.563   7.104
  207    HB3  ASP  28           1HB      ASP  28   4.806  25.490   8.777
  208    H    LEU  29           H        LEU  29   4.121  23.763  10.530
  209    HA   LEU  29           HA       LEU  29   6.476  22.215  11.016
  210    HB2  LEU  29           2HB      LEU  29   6.068  22.550  13.357
  211    HB3  LEU  29           1HB      LEU  29   5.781  24.053  12.509
  212    HG   LEU  29           HG       LEU  29   3.263  23.222  12.602
  213   HD11  LEU  29          1HD1      LEU  29   4.513  21.900  15.006
  214   HD12  LEU  29          2HD1      LEU  29   3.769  21.075  13.638
  215   HD13  LEU  29          3HD1      LEU  29   2.783  22.075  14.704
  216   HD21  LEU  29          3HD2      LEU  29   3.003  24.516  14.665
  217   HD22  LEU  29          1HD2      LEU  29   4.093  25.306  13.528
  218   HD23  LEU  29          2HD2      LEU  29   4.747  24.445  14.924
  219    H    GLU  30           H        GLU  30   3.047  21.535  10.937
  220    HA   GLU  30           HA       GLU  30   3.413  18.856  11.961
  221    HB2  GLU  30           2HB      GLU  30   1.041  20.354  10.875
  222    HB3  GLU  30           1HB      GLU  30   0.963  18.637  11.258
  223    HG2  GLU  30           2HG      GLU  30   1.508  19.076  13.560
  224    HG3  GLU  30           1HG      GLU  30   1.763  20.785  13.207
  225    H    SER  31           H        SER  31   4.284  20.219   9.183
  226    HA   SER  31           HA       SER  31   3.649  17.942   7.488
  227    HB2  SER  31           2HB      SER  31   3.663  20.227   6.511
  228    HB3  SER  31           1HB      SER  31   5.376  20.370   6.913
  229    HG   SER  31           HG       SER  31   4.635  19.612   4.685
  230    H    VAL  32           H        VAL  32   6.402  19.447   9.128
  231    HA   VAL  32           HA       VAL  32   8.210  17.360   8.317
  232    HB   VAL  32           HB       VAL  32   9.051  19.632   8.720
  233   HG11  VAL  32          1HG1      VAL  32   7.613  20.313  10.541
  234   HG12  VAL  32          2HG1      VAL  32   9.305  20.484  11.009
  235   HG13  VAL  32          3HG1      VAL  32   8.356  19.122  11.608
  236   HG21  VAL  32          3HG2      VAL  32  10.192  17.576  10.604
  237   HG22  VAL  32          1HG2      VAL  32  11.012  19.037  10.052
  238   HG23  VAL  32          2HG2      VAL  32  10.594  17.774   8.897
  239    H    GLY  33           H        GLY  33   6.125  18.023  11.030
  240    HA2  GLY  33           2HA      GLY  33   7.185  15.798  12.578
  241    HA3  GLY  33           1HA      GLY  33   5.848  16.846  13.033
  242    H    LYS  34           H        LYS  34   5.363  15.945   9.921
  243    HA   LYS  34           HA       LYS  34   3.080  14.398  10.480
  244    HB2  LYS  34           2HB      LYS  34   3.521  15.791   8.431
  245    HB3  LYS  34           1HB      LYS  34   4.617  14.533   7.883
  246    HG2  LYS  34           2HG      LYS  34   2.767  12.947   7.798
  247    HG3  LYS  34           1HG      LYS  34   1.660  14.204   8.364
  248    HD2  LYS  34           2HD      LYS  34   2.281  15.562   6.381
  249    HD3  LYS  34           1HD      LYS  34   3.258  14.211   5.806
  250    HE2  LYS  34           2HE      LYS  34   1.238  12.802   5.758
  251    HE3  LYS  34           1HE      LYS  34   0.276  14.189   6.268
  252    HZ1  LYS  34           3HZ      LYS  34   0.180  13.857   3.873
  253    HZ2  LYS  34           1HZ      LYS  34   1.864  14.022   3.763
  254    HZ3  LYS  34           2HZ      LYS  34   0.915  15.341   4.246
  255    H    GLY  35           H        GLY  35   6.279  13.511   9.197
  256    HA2  GLY  35           2HA      GLY  35   5.779  10.731   9.018
  257    HA3  GLY  35           1HA      GLY  35   7.359  11.495   9.043
  258    H    ALA  36           H        ALA  36   6.718  12.767  11.670
  259    HA   ALA  36           HA       ALA  36   7.814  10.779  13.357
  260    HB1  ALA  36           1HB      ALA  36   8.182  13.164  13.750
  261    HB2  ALA  36           2HB      ALA  36   7.468  12.393  15.167
  262    HB3  ALA  36           3HB      ALA  36   6.467  13.379  14.102
  263    H    VAL  37           H        VAL  37   4.590  12.307  13.369
  264    HA   VAL  37           HA       VAL  37   3.421  10.630  15.288
  265    HB   VAL  37           HB       VAL  37   2.036  12.011  12.974
  266   HG11  VAL  37          1HG1      VAL  37   0.642  10.320  14.053
  267   HG12  VAL  37          2HG1      VAL  37   0.048  11.946  14.393
  268   HG13  VAL  37          3HG1      VAL  37   0.949  11.060  15.623
  269   HG21  VAL  37          3HG2      VAL  37   1.636  13.847  14.550
  270   HG22  VAL  37          1HG2      VAL  37   3.360  13.588  14.282
  271   HG23  VAL  37          2HG2      VAL  37   2.602  13.009  15.765
  272    H    HIS  38           H        HIS  38   3.810  10.316  11.824
  273    HA   HIS  38           HA       HIS  38   2.233   8.002  11.448
  274    HB2  HIS  38           2HB      HIS  38   2.965   9.445   9.597
  275    HB3  HIS  38           1HB      HIS  38   4.637   8.991   9.892
  276    HD1  HIS  38           1HD      HIS  38   5.484   6.892   8.799
  277    HD2  HIS  38           2HD      HIS  38   1.357   7.335   8.472
  278    HE1  HIS  38           1HE      HIS  38   4.731   5.111   7.188
  279    HE2  HIS  38           2HE      HIS  38   2.231   5.381   7.012
  280    H    ASP  39           H        ASP  39   5.677   8.461  12.162
  281    HA   ASP  39           HA       ASP  39   6.458   5.764  11.916
  282    HB2  ASP  39           2HB      ASP  39   8.066   7.603  11.860
  283    HB3  ASP  39           1HB      ASP  39   7.701   7.996  13.538
  284    H    VAL  40           H        VAL  40   5.318   7.649  14.674
  285    HA   VAL  40           HA       VAL  40   5.796   5.561  16.586
  286    HB   VAL  40           HB       VAL  40   4.002   7.977  16.936
  287   HG11  VAL  40          1HG1      VAL  40   5.562   6.338  18.931
  288   HG12  VAL  40          2HG1      VAL  40   3.814   6.311  18.708
  289   HG13  VAL  40          3HG1      VAL  40   4.605   7.772  19.299
  290   HG21  VAL  40          3HG2      VAL  40   6.184   8.694  16.123
  291   HG22  VAL  40          1HG2      VAL  40   6.972   7.761  17.395
  292   HG23  VAL  40          2HG2      VAL  40   5.958   9.143  17.814
  293    H    LYS  41           H        LYS  41   4.086   5.016  14.201
  294    HA   LYS  41           HA       LYS  41   2.194   3.406  15.680
  295    HB2  LYS  41           2HB      LYS  41   0.935   5.490  15.016
  296    HB3  LYS  41           1HB      LYS  41   1.226   5.056  13.334
  297    HG2  LYS  41           2HG      LYS  41   0.054   2.908  13.743
  298    HG3  LYS  41           1HG      LYS  41  -0.332   3.473  15.368
  299    HD2  LYS  41           2HD      LYS  41  -1.557   5.364  14.417
  300    HD3  LYS  41           1HD      LYS  41  -1.168   4.799  12.790
  301    HE2  LYS  41           2HE      LYS  41  -2.755   3.272  14.851
  302    HE3  LYS  41           1HE      LYS  41  -3.434   4.145  13.479
  303    HZ1  LYS  41           3HZ      LYS  41  -2.337   2.653  11.978
  304    HZ2  LYS  41           1HZ      LYS  41  -3.218   1.737  13.097
  305    HZ3  LYS  41           2HZ      LYS  41  -1.532   1.865  13.248
  306    H    ASP  42           H        ASP  42   3.538   4.378  12.570
  307    HA   ASP  42           HA       ASP  42   3.078   2.157  11.013
  308    HB2  ASP  42           2HB      ASP  42   4.083   4.119  10.068
  309    HB3  ASP  42           1HB      ASP  42   5.481   3.988  11.131
  310    H    VAL  43           H        VAL  43   5.778   2.672  13.263
  311    HA   VAL  43           HA       VAL  43   6.686  -0.065  12.840
  312    HB   VAL  43           HB       VAL  43   7.852   2.015  14.698
  313   HG11  VAL  43          1HG1      VAL  43   8.581  -0.262  15.156
  314   HG12  VAL  43          2HG1      VAL  43   9.905   0.698  14.494
  315   HG13  VAL  43          3HG1      VAL  43   9.058  -0.462  13.469
  316   HG21  VAL  43          3HG2      VAL  43   7.817   2.927  12.453
  317   HG22  VAL  43          1HG2      VAL  43   8.549   1.452  11.817
  318   HG23  VAL  43          2HG2      VAL  43   9.468   2.496  12.902
  319    H    LEU  44           H        LEU  44   4.505   1.531  14.794
  320    HA   LEU  44           HA       LEU  44   5.051   0.100  17.245
  321    HB2  LEU  44           2HB      LEU  44   4.239   2.416  17.277
  322    HB3  LEU  44           1HB      LEU  44   2.754   1.905  16.501
  323    HG   LEU  44           HG       LEU  44   2.224   0.512  18.488
  324   HD11  LEU  44          1HD1      LEU  44   4.668   1.844  19.654
  325   HD12  LEU  44          2HD1      LEU  44   4.481   0.125  19.302
  326   HD13  LEU  44          3HD1      LEU  44   3.496   0.881  20.554
  327   HD21  LEU  44          3HD2      LEU  44   1.626   2.372  19.947
  328   HD22  LEU  44          1HD2      LEU  44   1.319   2.771  18.256
  329   HD23  LEU  44          2HD2      LEU  44   2.738   3.426  19.073
  330    H    ASP  45           H        ASP  45   2.632   0.013  14.656
  331    HA   ASP  45           HA       ASP  45   1.017  -2.001  15.884
  332    HB2  ASP  45           2HB      ASP  45   1.211  -1.154  12.984
  333    HB3  ASP  45           1HB      ASP  45  -0.013  -2.239  13.628
  334    H    SER  46           H        SER  46   3.989  -2.043  14.273
  335    HA   SER  46           HA       SER  46   3.831  -4.589  13.031
  336    HB2  SER  46           2HB      SER  46   6.297  -3.084  13.929
  337    HB3  SER  46           1HB      SER  46   6.217  -4.353  12.704
  338    HG   SER  46           HG       SER  46   5.882  -2.786  11.355
  339    H    VAL  47           H        VAL  47   3.388  -6.318  14.228
  340    HA   VAL  47           HA       VAL  47   5.294  -7.136  16.241
  341    HB   VAL  47           HB       VAL  47   3.600  -5.844  17.525
  342   HG11  VAL  47          1HG1      VAL  47   1.344  -6.761  17.810
  343   HG12  VAL  47          2HG1      VAL  47   1.679  -7.949  16.551
  344   HG13  VAL  47          3HG1      VAL  47   1.653  -6.230  16.157
  345   HG21  VAL  47          3HG2      VAL  47   3.651  -8.808  18.078
  346   HG22  VAL  47          1HG2      VAL  47   3.143  -7.568  19.226
  347   HG23  VAL  47          2HG2      VAL  47   4.809  -7.606  18.649
  348    H    LEU  48           H        LEU  48   5.079  -9.434  16.726
  349    HA   LEU  48           HA       LEU  48   4.234 -10.890  14.392
  350    HB2  LEU  48           2HB      LEU  48   5.527 -11.767  16.975
  351    HB3  LEU  48           1HB      LEU  48   5.097 -12.880  15.692
  352    HG   LEU  48           HG       LEU  48   6.623 -11.498  14.181
  353   HD11  LEU  48          1HD1      LEU  48   7.581 -10.457  16.842
  354   HD12  LEU  48          2HD1      LEU  48   6.794  -9.511  15.579
  355   HD13  LEU  48          3HD1      LEU  48   8.383 -10.223  15.290
  356   HD21  LEU  48          3HD2      LEU  48   7.833 -12.983  16.508
  357   HD22  LEU  48          1HD2      LEU  48   8.627 -12.648  14.971
  358   HD23  LEU  48          2HD2      LEU  48   7.218 -13.706  15.022
  Start of MODEL   13
    1    H1   SER   1           1HT      SER   1  13.657   0.587   9.128
    2    H2   SER   1           2HT      SER   1  14.015  -0.381   7.787
    3    H3   SER   1           3HT      SER   1  13.270   1.127   7.570
    4    HA   SER   1           HA       SER   1  15.602   1.229   7.002
    5    HB2  SER   1           2HB      SER   1  16.170   3.116   8.612
    6    HB3  SER   1           1HB      SER   1  14.625   3.264   7.775
    7    HG   SER   1           HG       SER   1  14.444   3.708  10.025
    8    H    SER   2           H        SER   2  15.155  -1.131   8.966
    9    HA   SER   2           HA       SER   2  17.825  -0.998  10.191
   10    HB2  SER   2           2HB      SER   2  16.798  -2.511  11.999
   11    HB3  SER   2           1HB      SER   2  16.353  -0.804  12.034
   12    HG   SER   2           HG       SER   2  14.372  -1.275  11.307
   13    H    LEU   3           H        LEU   3  18.770  -3.188  10.610
   14    HA   LEU   3           HA       LEU   3  17.813  -5.164   8.660
   15    HB2  LEU   3           2HB      LEU   3  20.666  -4.251   9.033
   16    HB3  LEU   3           1HB      LEU   3  20.201  -5.659   8.100
   17    HG   LEU   3           HG       LEU   3  19.372  -2.821   7.473
   18   HD11  LEU   3          1HD1      LEU   3  21.766  -3.179   7.149
   19   HD12  LEU   3          2HD1      LEU   3  20.931  -3.001   5.606
   20   HD13  LEU   3          3HD1      LEU   3  21.424  -4.601   6.163
   21   HD21  LEU   3          3HD2      LEU   3  19.033  -5.377   5.907
   22   HD22  LEU   3          1HD2      LEU   3  18.583  -3.761   5.365
   23   HD23  LEU   3          2HD2      LEU   3  17.748  -4.497   6.732
   24    H    LEU   4           H        LEU   4  20.727  -5.225  10.656
   25    HA   LEU   4           HA       LEU   4  19.606  -7.576  12.025
   26    HB2  LEU   4           2HB      LEU   4  21.282  -8.191  10.327
   27    HB3  LEU   4           1HB      LEU   4  22.452  -7.143  11.106
   28    HG   LEU   4           HG       LEU   4  22.369  -8.577  13.122
   29   HD11  LEU   4          1HD1      LEU   4  21.283 -10.759  12.996
   30   HD12  LEU   4          2HD1      LEU   4  20.609 -10.339  11.421
   31   HD13  LEU   4          3HD1      LEU   4  20.110  -9.449  12.861
   32   HD21  LEU   4          3HD2      LEU   4  22.996 -10.029  10.549
   33   HD22  LEU   4          1HD2      LEU   4  23.585 -10.469  12.152
   34   HD23  LEU   4          2HD2      LEU   4  24.079  -8.942  11.420
   35    H    GLU   5           H        GLU   5  20.052  -7.841  14.163
   36    HA   GLU   5           HA       GLU   5  20.402  -5.691  15.855
   37    HB2  GLU   5           2HB      GLU   5  19.471  -7.803  16.603
   38    HB3  GLU   5           1HB      GLU   5  21.001  -8.617  16.322
   39    HG2  GLU   5           2HG      GLU   5  20.733  -8.264  18.670
   40    HG3  GLU   5           1HG      GLU   5  22.027  -7.222  18.084
   41    H    LYS   6           H        LYS   6  22.849  -8.082  14.872
   42    HA   LYS   6           HA       LYS   6  24.913  -6.559  16.256
   43    HB2  LYS   6           2HB      LYS   6  25.092  -9.220  14.832
   44    HB3  LYS   6           1HB      LYS   6  26.341  -8.501  15.845
   45    HG2  LYS   6           2HG      LYS   6  24.804  -8.612  17.767
   46    HG3  LYS   6           1HG      LYS   6  23.608  -9.397  16.737
   47    HD2  LYS   6           2HD      LYS   6  24.741 -11.087  18.001
   48    HD3  LYS   6           1HD      LYS   6  25.251 -11.216  16.317
   49    HE2  LYS   6           2HE      LYS   6  27.341 -10.181  16.786
   50    HE3  LYS   6           1HE      LYS   6  26.816  -9.710  18.401
   51    HZ1  LYS   6           3HZ      LYS   6  28.281 -11.627  18.468
   52    HZ2  LYS   6           1HZ      LYS   6  27.224 -12.500  17.467
   53    HZ3  LYS   6           2HZ      LYS   6  26.729 -12.036  19.023
   54    H    GLY   7           H        GLY   7  23.569  -5.750  13.686
   55    HA2  GLY   7           2HA      GLY   7  26.036  -5.007  12.313
   56    HA3  GLY   7           1HA      GLY   7  24.834  -5.882  11.372
   57    H    LEU   8           H        LEU   8  24.120  -3.566  13.900
   58    HA   LEU   8           HA       LEU   8  22.931  -1.805  11.861
   59    HB2  LEU   8           2HB      LEU   8  21.621  -3.123  13.860
   60    HB3  LEU   8           1HB      LEU   8  21.967  -1.592  14.636
   61    HG   LEU   8           HG       LEU   8  20.465  -1.914  12.034
   62   HD11  LEU   8          1HD1      LEU   8  18.498  -1.295  13.319
   63   HD12  LEU   8          2HD1      LEU   8  19.460  -1.251  14.795
   64   HD13  LEU   8          3HD1      LEU   8  19.215  -2.778  13.947
   65   HD21  LEU   8          3HD2      LEU   8  20.947   0.520  13.747
   66   HD22  LEU   8          1HD2      LEU   8  19.919   0.450  12.316
   67   HD23  LEU   8          2HD2      LEU   8  21.660   0.206  12.163
   68    H    ASP   9           H        ASP   9  24.183  -0.070  11.608
   69    HA   ASP   9           HA       ASP   9  26.154   0.718  13.472
   70    HB2  ASP   9           2HB      ASP   9  25.041   2.240  11.109
   71    HB3  ASP   9           1HB      ASP   9  26.503   2.664  11.996
   72    H    GLY  10           H        GLY  10  22.847   1.572  13.079
   73    HA2  GLY  10           2HA      GLY  10  22.783   4.044  14.395
   74    HA3  GLY  10           1HA      GLY  10  21.452   2.895  14.322
   75    H    ALA  11           H        ALA  11  23.101   0.802  15.627
   76    HA   ALA  11           HA       ALA  11  22.229   1.220  18.257
   77    HB1  ALA  11           1HB      ALA  11  23.430  -0.820  18.805
   78    HB2  ALA  11           2HB      ALA  11  24.312  -0.730  17.280
   79    HB3  ALA  11           3HB      ALA  11  22.570  -1.000  17.275
   80    H    LYS  12           H        LYS  12  25.340   1.849  16.709
   81    HA   LYS  12           HA       LYS  12  26.384   2.713  19.310
   82    HB2  LYS  12           2HB      LYS  12  28.591   2.509  18.470
   83    HB3  LYS  12           1HB      LYS  12  27.731   1.068  17.958
   84    HG2  LYS  12           2HG      LYS  12  27.742   3.297  16.036
   85    HG3  LYS  12           1HG      LYS  12  29.304   2.543  16.350
   86    HD2  LYS  12           2HD      LYS  12  26.817   1.018  15.580
   87    HD3  LYS  12           1HD      LYS  12  28.027   1.573  14.421
   88    HE2  LYS  12           2HE      LYS  12  29.729   0.296  15.788
   89    HE3  LYS  12           1HE      LYS  12  28.371  -0.426  16.650
   90    HZ1  LYS  12           3HZ      LYS  12  28.950  -0.635  13.743
   91    HZ2  LYS  12           1HZ      LYS  12  27.541  -1.228  14.476
   92    HZ3  LYS  12           2HZ      LYS  12  29.046  -1.879  14.886
   93    H    LYS  13           H        LYS  13  25.646   3.880  16.073
   94    HA   LYS  13           HA       LYS  13  27.031   6.366  16.489
   95    HB2  LYS  13           2HB      LYS  13  26.797   5.293  14.248
   96    HB3  LYS  13           1HB      LYS  13  25.077   5.649  14.294
   97    HG2  LYS  13           2HG      LYS  13  26.898   7.934  14.719
   98    HG3  LYS  13           1HG      LYS  13  26.891   7.224  13.106
   99    HD2  LYS  13           2HD      LYS  13  24.249   7.746  14.333
  100    HD3  LYS  13           1HD      LYS  13  25.197   9.160  13.875
  101    HE2  LYS  13           2HE      LYS  13  23.680   8.432  12.080
  102    HE3  LYS  13           1HE      LYS  13  25.373   8.349  11.598
  103    HZ1  LYS  13           3HZ      LYS  13  25.343   5.978  11.984
  104    HZ2  LYS  13           1HZ      LYS  13  24.126   6.397  10.887
  105    HZ3  LYS  13           2HZ      LYS  13  23.723   6.044  12.492
  106    H    ALA  14           H        ALA  14  23.673   5.274  16.631
  107    HA   ALA  14           HA       ALA  14  22.722   7.988  16.995
  108    HB1  ALA  14           1HB      ALA  14  20.490   7.014  17.035
  109    HB2  ALA  14           2HB      ALA  14  21.190   5.394  17.058
  110    HB3  ALA  14           3HB      ALA  14  21.410   6.428  15.648
  111    H    VAL  15           H        VAL  15  24.253   5.969  19.016
  112    HA   VAL  15           HA       VAL  15  22.625   6.793  21.322
  113    HB   VAL  15           HB       VAL  15  23.225   4.361  21.138
  114   HG11  VAL  15          1HG1      VAL  15  26.004   5.361  21.722
  115   HG12  VAL  15          2HG1      VAL  15  25.465   4.535  20.257
  116   HG13  VAL  15          3HG1      VAL  15  25.484   3.677  21.797
  117   HG21  VAL  15          3HG2      VAL  15  23.761   4.101  23.498
  118   HG22  VAL  15          1HG2      VAL  15  22.582   5.392  23.262
  119   HG23  VAL  15          2HG2      VAL  15  24.272   5.787  23.577
  120    H    GLY  16           H        GLY  16  25.586   7.355  19.669
  121    HA2  GLY  16           2HA      GLY  16  26.449   9.651  20.303
  122    HA3  GLY  16           1HA      GLY  16  26.566   8.987  21.926
  123    H    GLY  17           H        GLY  17  27.445   6.355  20.925
  124    HA2  GLY  17           2HA      GLY  17  29.349   5.244  20.315
  125    HA3  GLY  17           1HA      GLY  17  29.788   6.658  19.365
  126    H    LEU  18           H        LEU  18  31.530   7.697  19.982
  127    HA   LEU  18           HA       LEU  18  32.400   7.400  22.771
  128    HB2  LEU  18           2HB      LEU  18  34.703   7.754  21.913
  129    HB3  LEU  18           1HB      LEU  18  33.934   6.291  21.334
  130    HG   LEU  18           HG       LEU  18  33.368   7.693  19.220
  131   HD11  LEU  18          1HD1      LEU  18  35.003   9.433  18.702
  132   HD12  LEU  18          2HD1      LEU  18  35.669   9.294  20.328
  133   HD13  LEU  18          3HD1      LEU  18  34.019   9.869  20.097
  134   HD21  LEU  18          3HD2      LEU  18  35.504   7.077  18.218
  135   HD22  LEU  18          1HD2      LEU  18  34.893   5.791  19.261
  136   HD23  LEU  18          2HD2      LEU  18  36.196   6.839  19.821
  137    H    GLY  19           H        GLY  19  30.891   9.482  20.868
  138    HA2  GLY  19           2HA      GLY  19  32.316  11.855  21.881
  139    HA3  GLY  19           1HA      GLY  19  31.246  11.844  20.486
  140    H    LYS  20           H        LYS  20  29.045  10.626  21.314
  141    HA   LYS  20           HA       LYS  20  27.131  10.734  22.514
  142    HB2  LYS  20           2HB      LYS  20  28.870  11.881  24.694
  143    HB3  LYS  20           1HB      LYS  20  27.184  11.426  24.892
  144    HG2  LYS  20           2HG      LYS  20  27.752   9.106  24.352
  145    HG3  LYS  20           1HG      LYS  20  29.448   9.572  24.180
  146    HD2  LYS  20           2HD      LYS  20  27.798   9.863  26.689
  147    HD3  LYS  20           1HD      LYS  20  28.976   8.586  26.382
  148    HE2  LYS  20           2HE      LYS  20  30.765  10.188  26.288
  149    HE3  LYS  20           1HE      LYS  20  29.628  11.530  26.397
  150    HZ1  LYS  20           3HZ      LYS  20  30.713  11.045  28.523
  151    HZ2  LYS  20           1HZ      LYS  20  30.044   9.484  28.509
  152    HZ3  LYS  20           2HZ      LYS  20  29.030  10.839  28.608
  153    H    LEU  21           H        LEU  21  29.009  13.702  23.147
  154    HA   LEU  21           HA       LEU  21  26.773  15.351  23.553
  155    HB2  LEU  21           2HB      LEU  21  29.110  15.843  24.263
  156    HB3  LEU  21           1HB      LEU  21  29.507  16.188  22.591
  157    HG   LEU  21           HG       LEU  21  27.904  18.058  22.599
  158   HD11  LEU  21          1HD1      LEU  21  27.558  17.365  25.512
  159   HD12  LEU  21          2HD1      LEU  21  26.335  17.205  24.252
  160   HD13  LEU  21          3HD1      LEU  21  26.920  18.802  24.714
  161   HD21  LEU  21          3HD2      LEU  21  30.235  18.478  23.151
  162   HD22  LEU  21          1HD2      LEU  21  29.904  18.138  24.848
  163   HD23  LEU  21          2HD2      LEU  21  29.172  19.540  24.072
  164    H    GLY  22           H        GLY  22  28.071  14.099  20.646
  165    HA2  GLY  22           2HA      GLY  22  27.282  16.094  18.817
  166    HA3  GLY  22           1HA      GLY  22  27.463  14.385  18.446
  167    H    LYS  23           H        LYS  23  25.457  13.861  20.688
  168    HA   LYS  23           HA       LYS  23  23.132  13.753  19.035
  169    HB2  LYS  23           2HB      LYS  23  23.598  13.166  21.958
  170    HB3  LYS  23           1HB      LYS  23  22.042  12.938  21.171
  171    HG2  LYS  23           2HG      LYS  23  24.547  11.612  20.182
  172    HG3  LYS  23           1HG      LYS  23  23.532  10.899  21.434
  173    HD2  LYS  23           2HD      LYS  23  22.419  11.751  18.775
  174    HD3  LYS  23           1HD      LYS  23  23.129  10.155  19.021
  175    HE2  LYS  23           2HE      LYS  23  20.797   9.897  19.331
  176    HE3  LYS  23           1HE      LYS  23  21.516   9.860  20.937
  177    HZ1  LYS  23           3HZ      LYS  23  20.934  12.293  21.061
  178    HZ2  LYS  23           1HZ      LYS  23  19.624  11.222  21.084
  179    HZ3  LYS  23           2HZ      LYS  23  20.000  12.066  19.666
  180    H    ASP  24           H        ASP  24  24.402  16.052  21.244
  181    HA   ASP  24           HA       ASP  24  22.215  17.166  22.477
  182    HB2  ASP  24           2HB      ASP  24  24.515  17.821  22.970
  183    HB3  ASP  24           1HB      ASP  24  24.646  18.604  21.400
  184    H    ALA  25           H        ALA  25  23.590  18.250  19.379
  185    HA   ALA  25           HA       ALA  25  21.520  20.172  18.948
  186    HB1  ALA  25           1HB      ALA  25  23.584  19.105  17.024
  187    HB2  ALA  25           2HB      ALA  25  23.786  20.502  18.083
  188    HB3  ALA  25           3HB      ALA  25  22.588  20.540  16.787
  189    H    VAL  26           H        VAL  26  21.870  16.818  18.268
  190    HA   VAL  26           HA       VAL  26  20.093  16.833  15.985
  191    HB   VAL  26           HB       VAL  26  21.211  14.462  17.493
  192   HG11  VAL  26          1HG1      VAL  26  19.268  13.921  16.117
  193   HG12  VAL  26          2HG1      VAL  26  20.738  13.217  15.446
  194   HG13  VAL  26          3HG1      VAL  26  20.042  14.666  14.719
  195   HG21  VAL  26          3HG2      VAL  26  22.280  15.845  15.033
  196   HG22  VAL  26          1HG2      VAL  26  22.920  14.366  15.748
  197   HG23  VAL  26          2HG2      VAL  26  23.004  15.885  16.639
  198    H    GLU  27           H        GLU  27  19.856  16.403  19.419
  199    HA   GLU  27           HA       GLU  27  17.592  14.747  19.519
  200    HB2  GLU  27           2HB      GLU  27  18.638  16.740  21.519
  201    HB3  GLU  27           1HB      GLU  27  17.285  15.664  21.839
  202    HG2  GLU  27           2HG      GLU  27  18.926  13.790  21.155
  203    HG3  GLU  27           1HG      GLU  27  20.166  15.006  21.460
  204    H    ASP  28           H        ASP  28  17.859  18.040  18.678
  205    HA   ASP  28           HA       ASP  28  15.143  18.716  19.360
  206    HB2  ASP  28           2HB      ASP  28  17.084  20.355  19.228
  207    HB3  ASP  28           1HB      ASP  28  16.969  20.211  17.479
  208    H    LEU  29           H        LEU  29  16.733  17.151  16.767
  209    HA   LEU  29           HA       LEU  29  14.475  17.650  14.949
  210    HB2  LEU  29           2HB      LEU  29  16.726  18.209  14.111
  211    HB3  LEU  29           1HB      LEU  29  17.217  16.541  14.343
  212    HG   LEU  29           HG       LEU  29  15.527  15.841  12.668
  213   HD11  LEU  29          1HD1      LEU  29  13.953  17.683  12.899
  214   HD12  LEU  29          2HD1      LEU  29  14.507  17.553  11.229
  215   HD13  LEU  29          3HD1      LEU  29  15.158  18.813  12.279
  216   HD21  LEU  29          3HD2      LEU  29  16.745  16.668  10.720
  217   HD22  LEU  29          1HD2      LEU  29  17.848  16.216  12.021
  218   HD23  LEU  29          2HD2      LEU  29  17.494  17.918  11.715
  219    H    GLU  30           H        GLU  30  16.339  15.099  16.516
  220    HA   GLU  30           HA       GLU  30  15.110  12.923  15.180
  221    HB2  GLU  30           2HB      GLU  30  16.029  11.547  17.018
  222    HB3  GLU  30           1HB      GLU  30  17.226  12.637  16.330
  223    HG2  GLU  30           2HG      GLU  30  16.886  14.180  18.195
  224    HG3  GLU  30           1HG      GLU  30  15.706  13.073  18.892
  225    H    SER  31           H        SER  31  14.115  14.939  17.797
  226    HA   SER  31           HA       SER  31  12.289  13.170  19.038
  227    HB2  SER  31           2HB      SER  31  11.317  15.478  19.837
  228    HB3  SER  31           1HB      SER  31  12.903  14.943  20.398
  229    HG   SER  31           HG       SER  31  13.734  16.617  19.461
  230    H    VAL  32           H        VAL  32  11.926  15.610  16.490
  231    HA   VAL  32           HA       VAL  32   9.103  15.096  16.246
  232    HB   VAL  32           HB       VAL  32  10.030  17.323  15.711
  233   HG11  VAL  32          1HG1      VAL  32  12.131  16.675  14.705
  234   HG12  VAL  32          2HG1      VAL  32  11.208  17.701  13.607
  235   HG13  VAL  32          3HG1      VAL  32  11.278  15.959  13.338
  236   HG21  VAL  32          3HG2      VAL  32   7.883  16.694  14.776
  237   HG22  VAL  32          1HG2      VAL  32   8.678  15.961  13.383
  238   HG23  VAL  32          2HG2      VAL  32   8.773  17.702  13.639
  239    H    GLY  33           H        GLY  33  12.029  13.836  14.916
  240    HA2  GLY  33           2HA      GLY  33  12.439  11.993  13.622
  241    HA3  GLY  33           1HA      GLY  33  10.818  11.473  14.046
  242    H    LYS  34           H        LYS  34  11.363  14.449  12.333
  243    HA   LYS  34           HA       LYS  34  10.821  15.188  10.256
  244    HB2  LYS  34           2HB      LYS  34  11.277  12.302   9.496
  245    HB3  LYS  34           1HB      LYS  34  11.081  13.622   8.352
  246    HG2  LYS  34           2HG      LYS  34  13.120  14.637   9.061
  247    HG3  LYS  34           1HG      LYS  34  13.274  13.513  10.415
  248    HD2  LYS  34           2HD      LYS  34  13.511  11.656   8.836
  249    HD3  LYS  34           1HD      LYS  34  13.360  12.781   7.486
  250    HE2  LYS  34           2HE      LYS  34  15.401  13.881   8.095
  251    HE3  LYS  34           1HE      LYS  34  15.506  12.955   9.592
  252    HZ1  LYS  34           3HZ      LYS  34  15.652  11.784   6.862
  253    HZ2  LYS  34           1HZ      LYS  34  15.837  10.948   8.326
  254    HZ3  LYS  34           2HZ      LYS  34  16.990  12.101   7.857
  255    H    GLY  35           H        GLY  35   8.844  13.580  12.095
  256    HA2  GLY  35           2HA      GLY  35   6.418  14.073  11.513
  257    HA3  GLY  35           1HA      GLY  35   6.747  13.120  10.070
  258    H    ALA  36           H        ALA  36   7.646  12.689  13.475
  259    HA   ALA  36           HA       ALA  36   7.441   9.899  13.430
  260    HB1  ALA  36           1HB      ALA  36   7.261  11.727  15.816
  261    HB2  ALA  36           2HB      ALA  36   8.756  11.163  15.070
  262    HB3  ALA  36           3HB      ALA  36   7.664  10.010  15.840
  263    H    VAL  37           H        VAL  37   5.004  12.292  13.749
  264    HA   VAL  37           HA       VAL  37   3.024  11.004  15.203
  265    HB   VAL  37           HB       VAL  37   2.579  12.722  12.752
  266   HG11  VAL  37          1HG1      VAL  37   0.795  12.147  15.116
  267   HG12  VAL  37          2HG1      VAL  37   0.573  11.541  13.475
  268   HG13  VAL  37          3HG1      VAL  37   0.435  13.268  13.802
  269   HG21  VAL  37          3HG2      VAL  37   2.889  13.527  15.642
  270   HG22  VAL  37          1HG2      VAL  37   2.449  14.605  14.316
  271   HG23  VAL  37          2HG2      VAL  37   4.040  13.843  14.344
  272    H    HIS  38           H        HIS  38   4.028  10.548  11.870
  273    HA   HIS  38           HA       HIS  38   1.906   8.594  11.391
  274    HB2  HIS  38           2HB      HIS  38   4.180   9.142   9.496
  275    HB3  HIS  38           1HB      HIS  38   2.556   8.575   9.130
  276    HD1  HIS  38           1HD      HIS  38   4.563  11.392   8.665
  277    HD2  HIS  38           2HD      HIS  38   0.623  10.865   9.893
  278    HE1  HIS  38           1HE      HIS  38   3.421  13.596   8.254
  279    HE2  HIS  38           2HE      HIS  38   1.077  13.295   9.121
  280    H    ASP  39           H        ASP  39   5.383   8.825  11.771
  281    HA   ASP  39           HA       ASP  39   6.024   6.251  10.825
  282    HB2  ASP  39           2HB      ASP  39   7.534   8.293  11.004
  283    HB3  ASP  39           1HB      ASP  39   7.713   7.886  12.709
  284    H    VAL  40           H        VAL  40   5.768   7.505  14.155
  285    HA   VAL  40           HA       VAL  40   6.659   5.140  15.399
  286    HB   VAL  40           HB       VAL  40   4.895   7.319  16.531
  287   HG11  VAL  40          1HG1      VAL  40   6.467   5.169  17.949
  288   HG12  VAL  40          2HG1      VAL  40   4.710   5.301  17.868
  289   HG13  VAL  40          3HG1      VAL  40   5.648   6.519  18.733
  290   HG21  VAL  40          3HG2      VAL  40   7.884   6.908  16.664
  291   HG22  VAL  40          1HG2      VAL  40   6.982   8.164  17.516
  292   HG23  VAL  40          2HG2      VAL  40   7.039   8.160  15.754
  293    H    LYS  41           H        LYS  41   3.460   6.195  14.396
  294    HA   LYS  41           HA       LYS  41   2.006   4.198  15.780
  295    HB2  LYS  41           2HB      LYS  41   1.279   5.732  13.278
  296    HB3  LYS  41           1HB      LYS  41   0.166   4.747  14.218
  297    HG2  LYS  41           2HG      LYS  41   0.529   6.211  16.156
  298    HG3  LYS  41           1HG      LYS  41   1.599   7.218  15.177
  299    HD2  LYS  41           2HD      LYS  41  -0.301   7.590  13.608
  300    HD3  LYS  41           1HD      LYS  41  -1.345   6.724  14.736
  301    HE2  LYS  41           2HE      LYS  41  -0.894   8.368  16.459
  302    HE3  LYS  41           1HE      LYS  41   0.237   9.207  15.401
  303    HZ1  LYS  41           3HZ      LYS  41  -1.673   9.578  13.862
  304    HZ2  LYS  41           1HZ      LYS  41  -1.809  10.379  15.354
  305    HZ3  LYS  41           2HZ      LYS  41  -2.704   8.969  15.063
  306    H    ASP  42           H        ASP  42   3.847   4.175  12.859
  307    HA   ASP  42           HA       ASP  42   2.702   1.724  11.843
  308    HB2  ASP  42           2HB      ASP  42   3.732   3.477  10.376
  309    HB3  ASP  42           1HB      ASP  42   5.299   3.075  11.070
  310    H    VAL  43           H        VAL  43   5.563   2.731  13.619
  311    HA   VAL  43           HA       VAL  43   6.936   0.276  13.598
  312    HB   VAL  43           HB       VAL  43   7.093   2.457  15.687
  313   HG11  VAL  43          1HG1      VAL  43   8.115   0.347  16.397
  314   HG12  VAL  43          2HG1      VAL  43   9.334   1.593  16.119
  315   HG13  VAL  43          3HG1      VAL  43   9.084   0.322  14.922
  316   HG21  VAL  43          3HG2      VAL  43   7.473   3.351  13.456
  317   HG22  VAL  43          1HG2      VAL  43   8.662   2.089  13.137
  318   HG23  VAL  43          2HG2      VAL  43   8.981   3.308  14.370
  319    H    LEU  44           H        LEU  44   4.589   1.636  15.903
  320    HA   LEU  44           HA       LEU  44   4.864  -0.632  17.657
  321    HB2  LEU  44           2HB      LEU  44   2.975   0.404  18.911
  322    HB3  LEU  44           1HB      LEU  44   4.380   1.427  18.721
  323    HG   LEU  44           HG       LEU  44   3.081   2.474  16.735
  324   HD11  LEU  44          1HD1      LEU  44   1.304   0.814  16.610
  325   HD12  LEU  44          2HD1      LEU  44   0.653   2.414  16.971
  326   HD13  LEU  44          3HD1      LEU  44   0.805   1.212  18.255
  327   HD21  LEU  44          3HD2      LEU  44   1.981   4.039  18.260
  328   HD22  LEU  44          1HD2      LEU  44   3.608   3.635  18.808
  329   HD23  LEU  44          2HD2      LEU  44   2.207   2.903  19.589
  330    H    ASP  45           H        ASP  45   3.527  -0.412  14.733
  331    HA   ASP  45           HA       ASP  45   1.304  -2.234  15.366
  332    HB2  ASP  45           2HB      ASP  45   0.684  -0.190  14.114
  333    HB3  ASP  45           1HB      ASP  45   1.809  -0.642  12.838
  334    H    SER  46           H        SER  46   4.361  -2.577  14.927
  335    HA   SER  46           HA       SER  46   4.527  -4.291  12.628
  336    HB2  SER  46           2HB      SER  46   6.846  -4.735  13.488
  337    HB3  SER  46           1HB      SER  46   6.483  -3.027  13.236
  338    HG   SER  46           HG       SER  46   6.555  -2.673  15.335
  339    H    VAL  47           H        VAL  47   3.023  -4.757  15.435
  340    HA   VAL  47           HA       VAL  47   3.938  -7.176  16.483
  341    HB   VAL  47           HB       VAL  47   1.077  -6.199  16.386
  342   HG11  VAL  47          1HG1      VAL  47   2.447  -8.153  18.226
  343   HG12  VAL  47          2HG1      VAL  47   1.230  -8.534  17.010
  344   HG13  VAL  47          3HG1      VAL  47   0.799  -7.560  18.414
  345   HG21  VAL  47          3HG2      VAL  47   2.567  -4.508  17.329
  346   HG22  VAL  47          1HG2      VAL  47   3.223  -5.701  18.451
  347   HG23  VAL  47          2HG2      VAL  47   1.535  -5.204  18.581
  348    H    LEU  48           H        LEU  48   4.001  -9.144  15.652
  349    HA   LEU  48           HA       LEU  48   2.808  -9.681  13.091
  350    HB2  LEU  48           2HB      LEU  48   4.387 -11.498  14.917
  351    HB3  LEU  48           1HB      LEU  48   3.935 -11.864  13.265
  352    HG   LEU  48           HG       LEU  48   5.294  -9.735  12.662
  353   HD11  LEU  48          1HD1      LEU  48   5.606  -8.911  14.931
  354   HD12  LEU  48          2HD1      LEU  48   7.157  -9.276  14.176
  355   HD13  LEU  48          3HD1      LEU  48   6.470 -10.386  15.363
  356   HD21  LEU  48          3HD2      LEU  48   7.350 -11.072  12.533
  357   HD22  LEU  48          1HD2      LEU  48   5.929 -11.976  12.009
  358   HD23  LEU  48          2HD2      LEU  48   6.622 -12.271  13.604
  Start of MODEL   14
    1    H1   SER   1           1HT      SER   1  26.009  41.796  13.465
    2    H2   SER   1           2HT      SER   1  26.779  41.770  11.956
    3    H3   SER   1           3HT      SER   1  26.863  40.415  12.967
    4    HA   SER   1           HA       SER   1  24.448  41.486  11.637
    5    HB2  SER   1           2HB      SER   1  25.950  38.881  11.264
    6    HB3  SER   1           1HB      SER   1  24.494  39.369  10.397
    7    HG   SER   1           HG       SER   1  25.643  41.049   9.454
    8    H    SER   2           H        SER   2  22.870  41.416  13.101
    9    HA   SER   2           HA       SER   2  22.008  38.923  14.178
   10    HB2  SER   2           2HB      SER   2  23.792  39.445  15.802
   11    HB3  SER   2           1HB      SER   2  23.051  41.011  16.114
   12    HG   SER   2           HG       SER   2  21.433  40.067  17.187
   13    H    LEU   3           H        LEU   3  19.927  39.142  15.224
   14    HA   LEU   3           HA       LEU   3  18.710  41.792  15.124
   15    HB2  LEU   3           2HB      LEU   3  16.729  41.009  13.952
   16    HB3  LEU   3           1HB      LEU   3  18.159  40.812  12.960
   17    HG   LEU   3           HG       LEU   3  17.151  38.486  14.552
   18   HD11  LEU   3          1HD1      LEU   3  15.727  37.844  12.674
   19   HD12  LEU   3          2HD1      LEU   3  16.077  39.380  11.881
   20   HD13  LEU   3          3HD1      LEU   3  15.187  39.356  13.403
   21   HD21  LEU   3          3HD2      LEU   3  18.527  38.742  11.877
   22   HD22  LEU   3          1HD2      LEU   3  18.103  37.232  12.684
   23   HD23  LEU   3          2HD2      LEU   3  19.299  38.309  13.402
   24    H    LEU   4           H        LEU   4  18.592  38.454  16.191
   25    HA   LEU   4           HA       LEU   4  17.011  39.273  18.513
   26    HB2  LEU   4           2HB      LEU   4  16.366  36.931  16.713
   27    HB3  LEU   4           1HB      LEU   4  15.658  37.176  18.298
   28    HG   LEU   4           HG       LEU   4  15.341  39.072  15.967
   29   HD11  LEU   4          1HD1      LEU   4  13.040  38.221  15.873
   30   HD12  LEU   4          2HD1      LEU   4  13.449  37.012  17.090
   31   HD13  LEU   4          3HD1      LEU   4  14.229  36.970  15.508
   32   HD21  LEU   4          3HD2      LEU   4  13.587  40.074  17.353
   33   HD22  LEU   4          1HD2      LEU   4  15.166  40.176  18.130
   34   HD23  LEU   4          2HD2      LEU   4  13.996  38.969  18.665
   35    H    GLU   5           H        GLU   5  16.899  37.277  20.076
   36    HA   GLU   5           HA       GLU   5  19.550  36.527  20.740
   37    HB2  GLU   5           2HB      GLU   5  16.944  35.299  21.672
   38    HB3  GLU   5           1HB      GLU   5  18.510  35.082  22.438
   39    HG2  GLU   5           2HG      GLU   5  16.995  37.669  22.198
   40    HG3  GLU   5           1HG      GLU   5  17.149  36.682  23.649
   41    H    LYS   6           H        LYS   6  16.898  34.854  19.138
   42    HA   LYS   6           HA       LYS   6  18.559  32.521  18.618
   43    HB2  LYS   6           2HB      LYS   6  15.700  33.183  17.903
   44    HB3  LYS   6           1HB      LYS   6  16.504  31.701  17.407
   45    HG2  LYS   6           2HG      LYS   6  16.082  32.565  20.261
   46    HG3  LYS   6           1HG      LYS   6  15.076  31.407  19.388
   47    HD2  LYS   6           2HD      LYS   6  17.049  29.967  19.070
   48    HD3  LYS   6           1HD      LYS   6  18.019  31.115  19.997
   49    HE2  LYS   6           2HE      LYS   6  15.598  29.638  21.032
   50    HE3  LYS   6           1HE      LYS   6  17.273  29.191  21.348
   51    HZ1  LYS   6           3HZ      LYS   6  16.048  31.787  22.120
   52    HZ2  LYS   6           1HZ      LYS   6  17.611  31.251  22.504
   53    HZ3  LYS   6           2HZ      LYS   6  16.259  30.472  23.167
   54    H    GLY   7           H        GLY   7  18.606  35.447  17.422
   55    HA2  GLY   7           2HA      GLY   7  18.992  34.554  14.632
   56    HA3  GLY   7           1HA      GLY   7  18.328  36.131  15.038
   57    H    LEU   8           H        LEU   8  20.834  34.748  16.952
   58    HA   LEU   8           HA       LEU   8  22.663  36.864  16.150
   59    HB2  LEU   8           2HB      LEU   8  22.091  35.981  18.577
   60    HB3  LEU   8           1HB      LEU   8  23.300  34.775  18.201
   61    HG   LEU   8           HG       LEU   8  23.863  37.732  18.052
   62   HD11  LEU   8          1HD1      LEU   8  24.893  37.506  20.254
   63   HD12  LEU   8          2HD1      LEU   8  24.317  35.842  20.354
   64   HD13  LEU   8          3HD1      LEU   8  23.162  37.175  20.317
   65   HD21  LEU   8          3HD2      LEU   8  25.671  35.330  18.286
   66   HD22  LEU   8          1HD2      LEU   8  26.186  37.018  18.236
   67   HD23  LEU   8          2HD2      LEU   8  25.411  36.290  16.828
   68    H    ASP   9           H        ASP   9  23.696  36.408  14.322
   69    HA   ASP   9           HA       ASP   9  23.890  33.958  13.081
   70    HB2  ASP   9           2HB      ASP   9  24.170  36.064  11.898
   71    HB3  ASP   9           1HB      ASP   9  25.678  36.371  12.752
   72    H    GLY  10           H        GLY  10  26.383  35.570  15.036
   73    HA2  GLY  10           2HA      GLY  10  28.378  33.598  14.680
   74    HA3  GLY  10           1HA      GLY  10  28.313  34.764  15.993
   75    H    ALA  11           H        ALA  11  25.796  33.916  17.057
   76    HA   ALA  11           HA       ALA  11  26.776  31.834  18.753
   77    HB1  ALA  11           1HB      ALA  11  25.363  33.640  19.611
   78    HB2  ALA  11           2HB      ALA  11  24.657  32.055  19.930
   79    HB3  ALA  11           3HB      ALA  11  24.022  33.057  18.625
   80    H    LYS  12           H        LYS  12  24.588  32.012  16.033
   81    HA   LYS  12           HA       LYS  12  23.409  29.452  16.347
   82    HB2  LYS  12           2HB      LYS  12  23.765  31.161  13.877
   83    HB3  LYS  12           1HB      LYS  12  22.791  29.699  13.938
   84    HG2  LYS  12           2HG      LYS  12  22.316  32.201  15.550
   85    HG3  LYS  12           1HG      LYS  12  21.412  31.697  14.121
   86    HD2  LYS  12           2HD      LYS  12  21.587  30.156  16.708
   87    HD3  LYS  12           1HD      LYS  12  20.231  31.170  16.215
   88    HE2  LYS  12           2HE      LYS  12  21.228  28.779  14.668
   89    HE3  LYS  12           1HE      LYS  12  19.884  28.738  15.807
   90    HZ1  LYS  12           3HZ      LYS  12  19.873  30.636  13.542
   91    HZ2  LYS  12           1HZ      LYS  12  18.562  30.024  14.426
   92    HZ3  LYS  12           2HZ      LYS  12  19.387  29.028  13.322
   93    H    LYS  13           H        LYS  13  26.519  30.414  15.366
   94    HA   LYS  13           HA       LYS  13  27.020  27.712  14.311
   95    HB2  LYS  13           2HB      LYS  13  28.883  28.668  13.006
   96    HB3  LYS  13           1HB      LYS  13  27.326  29.338  12.544
   97    HG2  LYS  13           2HG      LYS  13  27.793  31.368  13.761
   98    HG3  LYS  13           1HG      LYS  13  29.302  30.690  14.373
   99    HD2  LYS  13           2HD      LYS  13  29.713  32.205  12.508
  100    HD3  LYS  13           1HD      LYS  13  30.168  30.552  12.090
  101    HE2  LYS  13           2HE      LYS  13  28.996  31.605  10.245
  102    HE3  LYS  13           1HE      LYS  13  28.039  30.278  10.904
  103    HZ1  LYS  13           3HZ      LYS  13  26.836  32.032  12.227
  104    HZ2  LYS  13           1HZ      LYS  13  26.567  32.066  10.556
  105    HZ3  LYS  13           2HZ      LYS  13  27.612  33.192  11.271
  106    H    ALA  14           H        ALA  14  27.147  28.917  17.084
  107    HA   ALA  14           HA       ALA  14  29.918  28.885  17.807
  108    HB1  ALA  14           1HB      ALA  14  28.262  30.122  19.125
  109    HB2  ALA  14           2HB      ALA  14  29.119  28.937  20.110
  110    HB3  ALA  14           3HB      ALA  14  27.476  28.604  19.560
  111    H    VAL  15           H        VAL  15  27.230  26.645  18.507
  112    HA   VAL  15           HA       VAL  15  29.087  24.544  19.247
  113    HB   VAL  15           HB       VAL  15  26.074  24.446  18.979
  114   HG11  VAL  15          1HG1      VAL  15  27.098  22.235  18.843
  115   HG12  VAL  15          2HG1      VAL  15  26.225  22.427  20.363
  116   HG13  VAL  15          3HG1      VAL  15  27.985  22.542  20.335
  117   HG21  VAL  15          3HG2      VAL  15  27.799  24.861  21.420
  118   HG22  VAL  15          1HG2      VAL  15  26.049  24.652  21.425
  119   HG23  VAL  15          2HG2      VAL  15  26.764  26.069  20.658
  120    H    GLY  16           H        GLY  16  26.992  25.390  16.568
  121    HA2  GLY  16           2HA      GLY  16  27.546  22.934  15.138
  122    HA3  GLY  16           1HA      GLY  16  26.627  24.308  14.537
  123    H    GLY  17           H        GLY  17  27.681  25.970  13.472
  124    HA2  GLY  17           2HA      GLY  17  29.393  27.115  12.438
  125    HA3  GLY  17           1HA      GLY  17  30.533  26.184  13.395
  126    H    LEU  18           H        LEU  18  30.983  23.983  12.677
  127    HA   LEU  18           HA       LEU  18  31.511  23.912   9.868
  128    HB2  LEU  18           2HB      LEU  18  31.849  21.803  12.008
  129    HB3  LEU  18           1HB      LEU  18  32.404  21.628  10.357
  130    HG   LEU  18           HG       LEU  18  33.869  23.663  10.757
  131   HD11  LEU  18          1HD1      LEU  18  32.744  24.548  12.726
  132   HD12  LEU  18          2HD1      LEU  18  34.432  24.179  13.076
  133   HD13  LEU  18          3HD1      LEU  18  33.159  23.092  13.630
  134   HD21  LEU  18          3HD2      LEU  18  34.367  21.198  12.413
  135   HD22  LEU  18          1HD2      LEU  18  35.584  22.370  11.905
  136   HD23  LEU  18          2HD2      LEU  18  34.743  21.394  10.701
  137    H    GLY  19           H        GLY  19  29.108  22.626  11.999
  138    HA2  GLY  19           2HA      GLY  19  26.920  22.193  10.967
  139    HA3  GLY  19           1HA      GLY  19  27.786  21.361   9.682
  140    H    LYS  20           H        LYS  20  26.403  21.111  12.809
  141    HA   LYS  20           HA       LYS  20  27.644  18.567  13.391
  142    HB2  LYS  20           2HB      LYS  20  26.559  18.640  15.491
  143    HB3  LYS  20           1HB      LYS  20  27.038  20.289  15.154
  144    HG2  LYS  20           2HG      LYS  20  24.252  19.179  14.856
  145    HG3  LYS  20           1HG      LYS  20  24.841  20.141  16.207
  146    HD2  LYS  20           2HD      LYS  20  25.240  22.020  14.670
  147    HD3  LYS  20           1HD      LYS  20  24.598  21.049  13.339
  148    HE2  LYS  20           2HE      LYS  20  22.474  20.819  14.634
  149    HE3  LYS  20           1HE      LYS  20  23.129  21.947  15.818
  150    HZ1  LYS  20           3HZ      LYS  20  22.555  22.507  12.955
  151    HZ2  LYS  20           1HZ      LYS  20  23.308  23.602  14.017
  152    HZ3  LYS  20           2HZ      LYS  20  21.712  23.104  14.299
  153    H    LEU  21           H        LEU  21  26.669  18.183  11.066
  154    HA   LEU  21           HA       LEU  21  23.970  17.892  10.587
  155    HB2  LEU  21           2HB      LEU  21  24.675  16.409   8.690
  156    HB3  LEU  21           1HB      LEU  21  25.406  17.997   8.748
  157    HG   LEU  21           HG       LEU  21  27.388  16.769   9.920
  158   HD11  LEU  21          1HD1      LEU  21  26.071  14.479   8.472
  159   HD12  LEU  21          2HD1      LEU  21  26.281  14.622  10.217
  160   HD13  LEU  21          3HD1      LEU  21  27.689  14.465   9.167
  161   HD21  LEU  21          3HD2      LEU  21  26.806  16.426   6.984
  162   HD22  LEU  21          1HD2      LEU  21  28.395  16.323   7.741
  163   HD23  LEU  21          2HD2      LEU  21  27.514  17.850   7.747
  164    H    GLY  22           H        GLY  22  26.058  15.660  12.252
  165    HA2  GLY  22           2HA      GLY  22  24.572  13.295  11.965
  166    HA3  GLY  22           1HA      GLY  22  25.581  13.694  13.348
  167    H    LYS  23           H        LYS  23  24.172  16.011  14.164
  168    HA   LYS  23           HA       LYS  23  21.723  14.784  15.243
  169    HB2  LYS  23           2HB      LYS  23  23.367  17.132  16.227
  170    HB3  LYS  23           1HB      LYS  23  21.842  16.640  16.939
  171    HG2  LYS  23           2HG      LYS  23  23.595  15.797  18.308
  172    HG3  LYS  23           1HG      LYS  23  22.878  14.428  17.461
  173    HD2  LYS  23           2HD      LYS  23  24.704  14.340  15.917
  174    HD3  LYS  23           1HD      LYS  23  25.371  15.850  16.540
  175    HE2  LYS  23           2HE      LYS  23  25.026  13.392  18.237
  176    HE3  LYS  23           1HE      LYS  23  26.488  13.707  17.303
  177    HZ1  LYS  23           3HZ      LYS  23  25.373  15.469  19.424
  178    HZ2  LYS  23           1HZ      LYS  23  26.778  15.775  18.520
  179    HZ3  LYS  23           2HZ      LYS  23  26.723  14.452  19.579
  180    H    ASP  24           H        ASP  24  22.983  17.317  13.314
  181    HA   ASP  24           HA       ASP  24  20.917  19.210  13.393
  182    HB2  ASP  24           2HB      ASP  24  23.200  19.579  12.451
  183    HB3  ASP  24           1HB      ASP  24  22.761  18.571  11.079
  184    H    ALA  25           H        ALA  25  21.438  16.434  11.249
  185    HA   ALA  25           HA       ALA  25  19.226  16.919   9.560
  186    HB1  ALA  25           1HB      ALA  25  21.097  15.476   8.929
  187    HB2  ALA  25           2HB      ALA  25  19.553  14.635   8.787
  188    HB3  ALA  25           3HB      ALA  25  20.612  14.311  10.159
  189    H    VAL  26           H        VAL  26  19.517  15.470  12.691
  190    HA   VAL  26           HA       VAL  26  17.110  13.958  12.648
  191    HB   VAL  26           HB       VAL  26  18.530  15.081  15.070
  192   HG11  VAL  26          1HG1      VAL  26  17.499  13.198  16.252
  193   HG12  VAL  26          2HG1      VAL  26  16.669  12.726  14.769
  194   HG13  VAL  26          3HG1      VAL  26  16.285  14.263  15.543
  195   HG21  VAL  26          3HG2      VAL  26  20.090  13.812  13.693
  196   HG22  VAL  26          1HG2      VAL  26  18.965  12.455  13.647
  197   HG23  VAL  26          2HG2      VAL  26  19.709  12.931  15.172
  198    H    GLU  27           H        GLU  27  17.907  17.284  13.345
  199    HA   GLU  27           HA       GLU  27  15.518  17.980  14.696
  200    HB2  GLU  27           2HB      GLU  27  17.401  19.736  13.109
  201    HB3  GLU  27           1HB      GLU  27  16.174  20.305  14.233
  202    HG2  GLU  27           2HG      GLU  27  18.536  18.585  14.954
  203    HG3  GLU  27           1HG      GLU  27  18.414  20.324  15.217
  204    H    ASP  28           H        ASP  28  16.270  17.475  11.372
  205    HA   ASP  28           HA       ASP  28  14.152  18.910  10.176
  206    HB2  ASP  28           2HB      ASP  28  15.931  18.036   8.792
  207    HB3  ASP  28           1HB      ASP  28  15.586  16.390   9.308
  208    H    LEU  29           H        LEU  29  14.351  15.769  11.706
  209    HA   LEU  29           HA       LEU  29  11.609  15.096  11.056
  210    HB2  LEU  29           2HB      LEU  29  13.428  13.389  11.233
  211    HB3  LEU  29           1HB      LEU  29  13.538  13.742  12.946
  212    HG   LEU  29           HG       LEU  29  11.162  13.011  13.190
  213   HD11  LEU  29          1HD1      LEU  29  10.189  11.670  11.385
  214   HD12  LEU  29          2HD1      LEU  29  11.532  12.125  10.336
  215   HD13  LEU  29          3HD1      LEU  29  10.411  13.355  10.922
  216   HD21  LEU  29          3HD2      LEU  29  11.656  10.619  13.029
  217   HD22  LEU  29          1HD2      LEU  29  12.992  11.520  13.746
  218   HD23  LEU  29          2HD2      LEU  29  13.090  10.983  12.068
  219    H    GLU  30           H        GLU  30  13.519  15.998  13.888
  220    HA   GLU  30           HA       GLU  30  11.391  15.794  15.754
  221    HB2  GLU  30           2HB      GLU  30  14.068  17.177  15.902
  222    HB3  GLU  30           1HB      GLU  30  12.968  17.020  17.268
  223    HG2  GLU  30           2HG      GLU  30  14.108  14.697  15.731
  224    HG3  GLU  30           1HG      GLU  30  14.792  15.341  17.225
  225    H    SER  31           H        SER  31  13.179  18.745  14.847
  226    HA   SER  31           HA       SER  31  11.382  20.454  16.140
  227    HB2  SER  31           2HB      SER  31  13.344  21.101  13.928
  228    HB3  SER  31           1HB      SER  31  12.607  22.268  15.029
  229    HG   SER  31           HG       SER  31  14.712  21.619  15.716
  230    H    VAL  32           H        VAL  32  11.574  19.476  12.741
  231    HA   VAL  32           HA       VAL  32   9.523  21.297  11.914
  232    HB   VAL  32           HB       VAL  32  10.522  18.846  10.446
  233   HG11  VAL  32          1HG1      VAL  32   8.418  19.699   9.574
  234   HG12  VAL  32          2HG1      VAL  32   9.734  20.036   8.447
  235   HG13  VAL  32          3HG1      VAL  32   9.100  21.322   9.475
  236   HG21  VAL  32          3HG2      VAL  32  11.499  21.698  10.341
  237   HG22  VAL  32          1HG2      VAL  32  12.001  20.404   9.255
  238   HG23  VAL  32          2HG2      VAL  32  12.384  20.308  10.974
  239    H    GLY  33           H        GLY  33   9.645  17.881  12.803
  240    HA2  GLY  33           2HA      GLY  33   7.958  16.562  13.661
  241    HA3  GLY  33           1HA      GLY  33   6.867  17.930  13.524
  242    H    LYS  34           H        LYS  34   8.475  15.409  11.616
  243    HA   LYS  34           HA       LYS  34   6.169  15.460   9.783
  244    HB2  LYS  34           2HB      LYS  34   9.089  15.249   9.044
  245    HB3  LYS  34           1HB      LYS  34   7.773  14.913   7.928
  246    HG2  LYS  34           2HG      LYS  34   6.994  17.215   8.144
  247    HG3  LYS  34           1HG      LYS  34   8.297  17.553   9.283
  248    HD2  LYS  34           2HD      LYS  34   8.720  16.625   6.443
  249    HD3  LYS  34           1HD      LYS  34   8.772  18.312   6.961
  250    HE2  LYS  34           2HE      LYS  34  10.621  17.809   8.461
  251    HE3  LYS  34           1HE      LYS  34  10.551  16.109   8.003
  252    HZ1  LYS  34           3HZ      LYS  34  11.217  16.644   5.800
  253    HZ2  LYS  34           1HZ      LYS  34  12.306  17.412   6.855
  254    HZ3  LYS  34           2HZ      LYS  34  11.090  18.314   6.089
  255    H    GLY  35           H        GLY  35   7.593  13.616  12.036
  256    HA2  GLY  35           2HA      GLY  35   7.075  11.145  10.513
  257    HA3  GLY  35           1HA      GLY  35   8.593  11.329  11.368
  258    H    ALA  36           H        ALA  36   7.111  12.762  13.591
  259    HA   ALA  36           HA       ALA  36   7.024  10.697  15.396
  260    HB1  ALA  36           1HB      ALA  36   5.385  13.225  15.532
  261    HB2  ALA  36           2HB      ALA  36   7.073  13.069  16.015
  262    HB3  ALA  36           3HB      ALA  36   5.821  12.188  16.890
  263    H    VAL  37           H        VAL  37   4.105  12.233  14.004
  264    HA   VAL  37           HA       VAL  37   2.579   9.881  14.844
  265    HB   VAL  37           HB       VAL  37   1.470  12.405  13.604
  266   HG11  VAL  37          1HG1      VAL  37  -0.612  11.702  14.672
  267   HG12  VAL  37          2HG1      VAL  37   0.190  10.267  15.310
  268   HG13  VAL  37          3HG1      VAL  37  -0.017  10.460  13.569
  269   HG21  VAL  37          3HG2      VAL  37   1.843  11.768  16.529
  270   HG22  VAL  37          1HG2      VAL  37   0.982  13.161  15.878
  271   HG23  VAL  37          2HG2      VAL  37   2.719  12.998  15.615
  272    H    HIS  38           H        HIS  38   4.121   8.972  13.013
  273    HA   HIS  38           HA       HIS  38   2.298   8.099  11.015
  274    HB2  HIS  38           2HB      HIS  38   3.158  10.340  10.084
  275    HB3  HIS  38           1HB      HIS  38   4.701   9.519   9.874
  276    HD1  HIS  38           1HD      HIS  38   4.876   7.778   7.964
  277    HD2  HIS  38           2HD      HIS  38   1.108   9.506   8.347
  278    HE1  HIS  38           1HE      HIS  38   3.608   7.115   5.898
  279    HE2  HIS  38           2HE      HIS  38   1.271   7.992   6.254
  280    H    ASP  39           H        ASP  39   5.798   8.455  11.638
  281    HA   ASP  39           HA       ASP  39   6.381   5.857  10.575
  282    HB2  ASP  39           2HB      ASP  39   8.074   7.621  10.506
  283    HB3  ASP  39           1HB      ASP  39   8.088   7.699  12.267
  284    H    VAL  40           H        VAL  40   6.545   7.217  13.861
  285    HA   VAL  40           HA       VAL  40   6.962   4.844  15.257
  286    HB   VAL  40           HB       VAL  40   5.328   7.194  16.239
  287   HG11  VAL  40          1HG1      VAL  40   6.151   6.526  18.454
  288   HG12  VAL  40          2HG1      VAL  40   6.950   5.133  17.724
  289   HG13  VAL  40          3HG1      VAL  40   5.191   5.256  17.693
  290   HG21  VAL  40          3HG2      VAL  40   8.317   6.795  16.306
  291   HG22  VAL  40          1HG2      VAL  40   7.438   8.107  17.091
  292   HG23  VAL  40          2HG2      VAL  40   7.446   7.978  15.333
  293    H    LYS  41           H        LYS  41   4.068   6.214  13.905
  294    HA   LYS  41           HA       LYS  41   2.072   4.753  15.144
  295    HB2  LYS  41           2HB      LYS  41   1.596   6.575  13.623
  296    HB3  LYS  41           1HB      LYS  41   2.303   5.695  12.281
  297    HG2  LYS  41           2HG      LYS  41   0.006   4.459  13.698
  298    HG3  LYS  41           1HG      LYS  41  -0.306   5.844  12.649
  299    HD2  LYS  41           2HD      LYS  41   0.773   4.672  10.788
  300    HD3  LYS  41           1HD      LYS  41   1.100   3.294  11.841
  301    HE2  LYS  41           2HE      LYS  41  -1.628   4.357  11.118
  302    HE3  LYS  41           1HE      LYS  41  -0.871   2.918  10.439
  303    HZ1  LYS  41           3HZ      LYS  41  -0.846   1.927  12.645
  304    HZ2  LYS  41           1HZ      LYS  41  -2.428   2.343  12.191
  305    HZ3  LYS  41           2HZ      LYS  41  -1.585   3.311  13.300
  306    H    ASP  42           H        ASP  42   4.027   3.872  12.306
  307    HA   ASP  42           HA       ASP  42   2.742   1.309  12.043
  308    HB2  ASP  42           2HB      ASP  42   3.644   2.559  10.091
  309    HB3  ASP  42           1HB      ASP  42   5.270   2.304  10.717
  310    H    VAL  43           H        VAL  43   5.666   2.564  13.495
  311    HA   VAL  43           HA       VAL  43   6.984   0.123  13.987
  312    HB   VAL  43           HB       VAL  43   7.066   2.645  15.660
  313   HG11  VAL  43          1HG1      VAL  43   9.024   0.360  15.471
  314   HG12  VAL  43          2HG1      VAL  43   7.971   0.717  16.840
  315   HG13  VAL  43          3HG1      VAL  43   9.254   1.843  16.399
  316   HG21  VAL  43          3HG2      VAL  43   8.809   1.784  13.355
  317   HG22  VAL  43          1HG2      VAL  43   9.065   3.211  14.359
  318   HG23  VAL  43          2HG2      VAL  43   7.631   3.097  13.337
  319    H    LEU  44           H        LEU  44   4.554   1.925  15.802
  320    HA   LEU  44           HA       LEU  44   4.490   0.208  18.052
  321    HB2  LEU  44           2HB      LEU  44   3.604   2.500  18.067
  322    HB3  LEU  44           1HB      LEU  44   2.344   2.020  16.949
  323    HG   LEU  44           HG       LEU  44   1.445   0.476  18.665
  324   HD11  LEU  44          1HD1      LEU  44   2.228   0.656  20.963
  325   HD12  LEU  44          2HD1      LEU  44   3.507   1.758  20.447
  326   HD13  LEU  44          3HD1      LEU  44   3.510   0.081  19.898
  327   HD21  LEU  44          3HD2      LEU  44   0.498   2.700  18.428
  328   HD22  LEU  44          1HD2      LEU  44   1.725   3.361  19.508
  329   HD23  LEU  44          2HD2      LEU  44   0.525   2.228  20.128
  330    H    ASP  45           H        ASP  45   2.740   0.250  14.985
  331    HA   ASP  45           HA       ASP  45   0.933  -1.844  15.588
  332    HB2  ASP  45           2HB      ASP  45   2.053  -0.885  12.945
  333    HB3  ASP  45           1HB      ASP  45   0.817  -2.130  13.073
  334    H    SER  46           H        SER  46   3.935  -1.841  13.719
  335    HA   SER  46           HA       SER  46   5.476  -3.404  13.242
  336    HB2  SER  46           2HB      SER  46   5.685  -3.431  15.741
  337    HB3  SER  46           1HB      SER  46   4.577  -4.803  15.770
  338    HG   SER  46           HG       SER  46   7.102  -4.688  14.470
  339    H    VAL  47           H        VAL  47   4.212  -3.978  11.401
  340    HA   VAL  47           HA       VAL  47   2.727  -6.469  11.542
  341    HB   VAL  47           HB       VAL  47   3.564  -4.872   9.109
  342   HG11  VAL  47          1HG1      VAL  47   1.782  -6.094   7.963
  343   HG12  VAL  47          2HG1      VAL  47   1.473  -7.021   9.432
  344   HG13  VAL  47          3HG1      VAL  47   3.014  -7.189   8.591
  345   HG21  VAL  47          3HG2      VAL  47   0.953  -4.826  10.620
  346   HG22  VAL  47          1HG2      VAL  47   1.303  -3.957   9.125
  347   HG23  VAL  47          2HG2      VAL  47   2.162  -3.543  10.608
  348    H    LEU  48           H        LEU  48   5.854  -5.254  10.644
  349    HA   LEU  48           HA       LEU  48   6.844  -8.006  10.543
  350    HB2  LEU  48           2HB      LEU  48   6.760  -7.157   8.235
  351    HB3  LEU  48           1HB      LEU  48   7.709  -5.760   8.711
  352    HG   LEU  48           HG       LEU  48   9.598  -7.257   9.258
  353   HD11  LEU  48          1HD1      LEU  48   8.349  -9.276   9.788
  354   HD12  LEU  48          2HD1      LEU  48   9.534  -9.589   8.521
  355   HD13  LEU  48          3HD1      LEU  48   7.829  -9.413   8.106
  356   HD21  LEU  48          3HD2      LEU  48   9.468  -6.208   7.071
  357   HD22  LEU  48          1HD2      LEU  48   8.505  -7.555   6.465
  358   HD23  LEU  48          2HD2      LEU  48  10.182  -7.817   6.948
  Start of MODEL   15
    1    H1   SER   1           1HT      SER   1  -8.706  44.414  15.970
    2    H2   SER   1           2HT      SER   1  -7.968  45.842  16.507
    3    H3   SER   1           3HT      SER   1  -9.175  45.109  17.443
    4    HA   SER   1           HA       SER   1  -6.511  43.988  16.835
    5    HB2  SER   1           2HB      SER   1  -7.673  44.987  19.450
    6    HB3  SER   1           1HB      SER   1  -6.048  44.341  19.209
    7    HG   SER   1           HG       SER   1  -6.508  46.779  19.155
    8    H    SER   2           H        SER   2  -6.925  41.927  16.369
    9    HA   SER   2           HA       SER   2  -9.065  40.502  17.729
   10    HB2  SER   2           2HB      SER   2  -7.166  39.402  15.653
   11    HB3  SER   2           1HB      SER   2  -8.792  38.842  16.050
   12    HG   SER   2           HG       SER   2  -9.623  40.336  14.804
   13    H    LEU   3           H        LEU   3  -8.564  38.227  18.470
   14    HA   LEU   3           HA       LEU   3  -6.315  38.260  20.271
   15    HB2  LEU   3           2HB      LEU   3  -7.170  36.194  21.146
   16    HB3  LEU   3           1HB      LEU   3  -8.514  37.291  20.913
   17    HG   LEU   3           HG       LEU   3  -7.828  35.109  18.943
   18   HD11  LEU   3          1HD1      LEU   3  -8.280  34.108  21.118
   19   HD12  LEU   3          2HD1      LEU   3  -9.601  33.797  19.991
   20   HD13  LEU   3          3HD1      LEU   3  -9.777  35.029  21.242
   21   HD21  LEU   3          3HD2      LEU   3 -10.153  35.406  18.242
   22   HD22  LEU   3          1HD2      LEU   3  -9.235  36.900  18.067
   23   HD23  LEU   3          2HD2      LEU   3 -10.346  36.701  19.423
   24    H    LEU   4           H        LEU   4  -5.456  38.421  17.645
   25    HA   LEU   4           HA       LEU   4  -4.849  35.873  16.518
   26    HB2  LEU   4           2HB      LEU   4  -5.028  38.299  15.470
   27    HB3  LEU   4           1HB      LEU   4  -3.312  38.331  15.816
   28    HG   LEU   4           HG       LEU   4  -4.663  36.253  14.086
   29   HD11  LEU   4          1HD1      LEU   4  -3.619  37.433  12.212
   30   HD12  LEU   4          2HD1      LEU   4  -3.059  38.687  13.319
   31   HD13  LEU   4          3HD1      LEU   4  -4.787  38.449  13.058
   32   HD21  LEU   4          3HD2      LEU   4  -2.382  35.697  13.402
   33   HD22  LEU   4          1HD2      LEU   4  -2.612  35.448  15.132
   34   HD23  LEU   4          2HD2      LEU   4  -1.750  36.875  14.554
   35    H    GLU   5           H        GLU   5  -2.492  38.380  17.477
   36    HA   GLU   5           HA       GLU   5  -0.460  36.405  17.840
   37    HB2  GLU   5           2HB      GLU   5  -0.291  38.953  17.163
   38    HB3  GLU   5           1HB      GLU   5  -0.171  39.188  18.898
   39    HG2  GLU   5           2HG      GLU   5   1.662  37.537  17.177
   40    HG3  GLU   5           1HG      GLU   5   2.027  39.097  17.908
   41    H    LYS   6           H        LYS   6  -1.552  38.873  20.170
   42    HA   LYS   6           HA       LYS   6  -0.572  37.282  22.350
   43    HB2  LYS   6           2HB      LYS   6  -1.389  39.172  23.755
   44    HB3  LYS   6           1HB      LYS   6  -0.276  39.655  22.487
   45    HG2  LYS   6           2HG      LYS   6  -2.136  40.450  21.135
   46    HG3  LYS   6           1HG      LYS   6  -3.273  39.929  22.378
   47    HD2  LYS   6           2HD      LYS   6  -1.096  41.981  22.780
   48    HD3  LYS   6           1HD      LYS   6  -2.793  42.357  22.466
   49    HE2  LYS   6           2HE      LYS   6  -1.811  40.723  24.802
   50    HE3  LYS   6           1HE      LYS   6  -2.153  42.451  24.877
   51    HZ1  LYS   6           3HZ      LYS   6  -4.425  42.078  24.523
   52    HZ2  LYS   6           1HZ      LYS   6  -3.968  40.893  25.640
   53    HZ3  LYS   6           2HZ      LYS   6  -4.190  40.478  24.012
   54    H    GLY   7           H        GLY   7  -2.834  36.173  20.824
   55    HA2  GLY   7           2HA      GLY   7  -4.622  35.753  23.131
   56    HA3  GLY   7           1HA      GLY   7  -5.283  35.999  21.524
   57    H    LEU   8           H        LEU   8  -4.875  34.425  19.904
   58    HA   LEU   8           HA       LEU   8  -5.232  31.787  20.828
   59    HB2  LEU   8           2HB      LEU   8  -5.988  32.918  18.630
   60    HB3  LEU   8           1HB      LEU   8  -4.393  32.524  18.033
   61    HG   LEU   8           HG       LEU   8  -6.190  30.926  17.354
   62   HD11  LEU   8          1HD1      LEU   8  -4.902  28.900  17.773
   63   HD12  LEU   8          2HD1      LEU   8  -3.971  29.744  19.010
   64   HD13  LEU   8          3HD1      LEU   8  -3.849  30.242  17.323
   65   HD21  LEU   8          3HD2      LEU   8  -7.494  30.953  19.401
   66   HD22  LEU   8          1HD2      LEU   8  -6.157  30.212  20.281
   67   HD23  LEU   8          2HD2      LEU   8  -6.986  29.309  19.013
   68    H    ASP   9           H        ASP   9  -2.495  33.266  19.061
   69    HA   ASP   9           HA       ASP   9  -0.870  30.931  19.563
   70    HB2  ASP   9           2HB      ASP   9  -0.709  32.289  17.456
   71    HB3  ASP   9           1HB      ASP   9   0.019  33.577  18.411
   72    H    GLY  10           H        GLY  10  -1.550  33.892  21.094
   73    HA2  GLY  10           2HA      GLY  10   0.791  34.180  22.656
   74    HA3  GLY  10           1HA      GLY  10  -0.797  34.825  23.052
   75    H    ALA  11           H        ALA  11  -1.928  32.062  22.830
   76    HA   ALA  11           HA       ALA  11  -1.782  31.263  25.507
   77    HB1  ALA  11           1HB      ALA  11  -2.536  29.599  23.107
   78    HB2  ALA  11           2HB      ALA  11  -3.625  30.651  24.013
   79    HB3  ALA  11           3HB      ALA  11  -2.919  29.232  24.788
   80    H    LYS  12           H        LYS  12   0.126  30.370  22.699
   81    HA   LYS  12           HA       LYS  12   1.439  28.138  23.824
   82    HB2  LYS  12           2HB      LYS  12   2.300  30.047  21.648
   83    HB3  LYS  12           1HB      LYS  12   3.233  28.636  22.109
   84    HG2  LYS  12           2HG      LYS  12   2.047  27.964  20.228
   85    HG3  LYS  12           1HG      LYS  12   1.140  27.282  21.577
   86    HD2  LYS  12           2HD      LYS  12  -0.561  28.896  21.383
   87    HD3  LYS  12           1HD      LYS  12   0.425  29.929  20.346
   88    HE2  LYS  12           2HE      LYS  12  -0.702  27.224  19.629
   89    HE3  LYS  12           1HE      LYS  12  -1.291  28.784  19.055
   90    HZ1  LYS  12           3HZ      LYS  12   1.333  27.521  18.463
   91    HZ2  LYS  12           1HZ      LYS  12   0.953  29.135  18.068
   92    HZ3  LYS  12           2HZ      LYS  12   0.078  27.862  17.370
   93    H    LYS  13           H        LYS  13   2.103  31.592  23.893
   94    HA   LYS  13           HA       LYS  13   4.658  31.326  25.144
   95    HB2  LYS  13           2HB      LYS  13   2.808  33.664  24.720
   96    HB3  LYS  13           1HB      LYS  13   4.288  33.820  25.652
   97    HG2  LYS  13           2HG      LYS  13   5.102  34.453  23.649
   98    HG3  LYS  13           1HG      LYS  13   5.312  32.717  23.458
   99    HD2  LYS  13           2HD      LYS  13   3.251  32.566  22.195
  100    HD3  LYS  13           1HD      LYS  13   2.926  34.281  22.473
  101    HE2  LYS  13           2HE      LYS  13   5.091  34.781  21.312
  102    HE3  LYS  13           1HE      LYS  13   5.191  33.076  20.885
  103    HZ1  LYS  13           3HZ      LYS  13   3.076  33.315  19.688
  104    HZ2  LYS  13           1HZ      LYS  13   4.271  34.348  19.076
  105    HZ3  LYS  13           2HZ      LYS  13   3.046  34.973  20.064
  106    H    ALA  14           H        ALA  14   1.430  31.214  26.237
  107    HA   ALA  14           HA       ALA  14   2.088  31.933  28.976
  108    HB1  ALA  14           1HB      ALA  14  -0.524  30.986  27.801
  109    HB2  ALA  14           2HB      ALA  14  -0.047  32.669  28.022
  110    HB3  ALA  14           3HB      ALA  14  -0.286  31.627  29.426
  111    H    VAL  15           H        VAL  15   0.914  29.074  27.204
  112    HA   VAL  15           HA       VAL  15   1.077  27.381  29.519
  113    HB   VAL  15           HB       VAL  15  -0.542  26.986  27.660
  114   HG11  VAL  15          1HG1      VAL  15   0.234  25.845  25.622
  115   HG12  VAL  15          2HG1      VAL  15   1.903  26.110  26.128
  116   HG13  VAL  15          3HG1      VAL  15   0.865  27.485  25.755
  117   HG21  VAL  15          3HG2      VAL  15  -0.286  24.540  27.615
  118   HG22  VAL  15          1HG2      VAL  15  -0.056  25.216  29.227
  119   HG23  VAL  15          2HG2      VAL  15   1.340  24.715  28.274
  120    H    GLY  16           H        GLY  16   3.228  28.374  27.020
  121    HA2  GLY  16           2HA      GLY  16   5.064  26.170  27.320
  122    HA3  GLY  16           1HA      GLY  16   5.313  27.621  26.361
  123    H    GLY  17           H        GLY  17   4.855  26.859  29.818
  124    HA2  GLY  17           2HA      GLY  17   6.901  28.814  30.513
  125    HA3  GLY  17           1HA      GLY  17   5.941  27.860  31.639
  126    H    LEU  18           H        LEU  18   6.428  25.341  30.537
  127    HA   LEU  18           HA       LEU  18   9.148  24.885  31.452
  128    HB2  LEU  18           2HB      LEU  18   8.454  22.446  31.163
  129    HB3  LEU  18           1HB      LEU  18   7.659  23.370  32.417
  130    HG   LEU  18           HG       LEU  18   5.738  23.700  30.769
  131   HD11  LEU  18          1HD1      LEU  18   7.174  21.472  29.331
  132   HD12  LEU  18          2HD1      LEU  18   6.874  23.097  28.713
  133   HD13  LEU  18          3HD1      LEU  18   5.524  22.003  29.010
  134   HD21  LEU  18          3HD2      LEU  18   4.779  21.512  31.275
  135   HD22  LEU  18          1HD2      LEU  18   5.619  22.185  32.672
  136   HD23  LEU  18          2HD2      LEU  18   6.377  20.911  31.718
  137    H    GLY  19           H        GLY  19   8.057  25.902  28.672
  138    HA2  GLY  19           2HA      GLY  19  10.241  24.884  27.157
  139    HA3  GLY  19           1HA      GLY  19   8.724  24.152  26.651
  140    H    LYS  20           H        LYS  20   9.860  27.406  27.553
  141    HA   LYS  20           HA       LYS  20   8.062  28.698  25.752
  142    HB2  LYS  20           2HB      LYS  20   8.952  29.717  27.844
  143    HB3  LYS  20           1HB      LYS  20  10.538  29.798  27.094
  144    HG2  LYS  20           2HG      LYS  20   9.878  31.461  25.603
  145    HG3  LYS  20           1HG      LYS  20   8.160  31.134  25.852
  146    HD2  LYS  20           2HD      LYS  20  10.031  32.237  27.948
  147    HD3  LYS  20           1HD      LYS  20   8.924  33.208  26.972
  148    HE2  LYS  20           2HE      LYS  20   7.019  32.095  27.914
  149    HE3  LYS  20           1HE      LYS  20   8.050  30.929  28.742
  150    HZ1  LYS  20           3HZ      LYS  20   7.168  32.697  30.192
  151    HZ2  LYS  20           1HZ      LYS  20   8.044  33.847  29.308
  152    HZ3  LYS  20           2HZ      LYS  20   8.863  32.639  30.174
  153    H    LEU  21           H        LEU  21  11.253  27.428  25.530
  154    HA   LEU  21           HA       LEU  21  11.290  28.180  22.692
  155    HB2  LEU  21           2HB      LEU  21  13.689  28.361  22.714
  156    HB3  LEU  21           1HB      LEU  21  13.029  29.432  23.930
  157    HG   LEU  21           HG       LEU  21  14.135  26.713  24.605
  158   HD11  LEU  21          1HD1      LEU  21  16.200  27.839  25.246
  159   HD12  LEU  21          2HD1      LEU  21  15.571  29.363  24.618
  160   HD13  LEU  21          3HD1      LEU  21  15.883  28.019  23.520
  161   HD21  LEU  21          3HD2      LEU  21  12.672  27.719  26.283
  162   HD22  LEU  21          1HD2      LEU  21  13.662  29.180  26.278
  163   HD23  LEU  21          2HD2      LEU  21  14.343  27.655  26.847
  164    H    GLY  22           H        GLY  22  12.030  26.579  21.263
  165    HA2  GLY  22           2HA      GLY  22  12.889  24.431  20.736
  166    HA3  GLY  22           1HA      GLY  22  12.673  23.961  22.414
  167    H    LYS  23           H        LYS  23  10.046  24.664  22.841
  168    HA   LYS  23           HA       LYS  23   8.700  22.460  21.617
  169    HB2  LYS  23           2HB      LYS  23   7.717  24.667  23.436
  170    HB3  LYS  23           1HB      LYS  23   6.717  23.322  22.902
  171    HG2  LYS  23           2HG      LYS  23   9.292  22.984  24.423
  172    HG3  LYS  23           1HG      LYS  23   7.702  23.069  25.184
  173    HD2  LYS  23           2HD      LYS  23   6.982  21.109  23.932
  174    HD3  LYS  23           1HD      LYS  23   8.544  21.042  23.115
  175    HE2  LYS  23           2HE      LYS  23   8.169  20.791  26.097
  176    HE3  LYS  23           1HE      LYS  23   8.321  19.425  24.992
  177    HZ1  LYS  23           3HZ      LYS  23  10.506  20.366  24.315
  178    HZ2  LYS  23           1HZ      LYS  23  10.449  19.853  25.931
  179    HZ3  LYS  23           2HZ      LYS  23  10.364  21.505  25.567
  180    H    ASP  24           H        ASP  24   9.068  25.777  20.875
  181    HA   ASP  24           HA       ASP  24   6.680  26.210  19.403
  182    HB2  ASP  24           2HB      ASP  24   7.809  28.199  18.531
  183    HB3  ASP  24           1HB      ASP  24   8.077  28.059  20.265
  184    H    ALA  25           H        ALA  25   9.799  24.827  18.651
  185    HA   ALA  25           HA       ALA  25   9.314  24.695  15.814
  186    HB1  ALA  25           1HB      ALA  25  11.355  23.357  15.738
  187    HB2  ALA  25           2HB      ALA  25  11.371  23.270  17.500
  188    HB3  ALA  25           3HB      ALA  25  11.595  24.823  16.695
  189    H    VAL  26           H        VAL  26   8.579  22.808  18.591
  190    HA   VAL  26           HA       VAL  26   8.219  20.299  17.279
  191    HB   VAL  26           HB       VAL  26   7.052  21.253  19.901
  192   HG11  VAL  26          1HG1      VAL  26   6.842  18.871  20.439
  193   HG12  VAL  26          2HG1      VAL  26   7.394  18.462  18.814
  194   HG13  VAL  26          3HG1      VAL  26   5.869  19.318  19.038
  195   HG21  VAL  26          3HG2      VAL  26   9.476  21.386  19.916
  196   HG22  VAL  26          1HG2      VAL  26   9.587  19.720  19.347
  197   HG23  VAL  26          2HG2      VAL  26   8.924  20.063  20.945
  198    H    GLU  27           H        GLU  27   6.188  23.071  17.966
  199    HA   GLU  27           HA       GLU  27   3.654  22.074  17.530
  200    HB2  GLU  27           2HB      GLU  27   4.768  24.733  16.626
  201    HB3  GLU  27           1HB      GLU  27   3.059  24.333  16.681
  202    HG2  GLU  27           2HG      GLU  27   3.312  23.954  19.133
  203    HG3  GLU  27           1HG      GLU  27   4.954  24.590  18.999
  204    H    ASP  28           H        ASP  28   5.842  23.434  15.089
  205    HA   ASP  28           HA       ASP  28   4.253  23.188  12.857
  206    HB2  ASP  28           2HB      ASP  28   6.492  24.308  12.988
  207    HB3  ASP  28           1HB      ASP  28   7.238  22.716  12.907
  208    H    LEU  29           H        LEU  29   6.518  20.792  14.149
  209    HA   LEU  29           HA       LEU  29   6.332  18.917  12.111
  210    HB2  LEU  29           2HB      LEU  29   6.812  18.425  15.050
  211    HB3  LEU  29           1HB      LEU  29   7.173  17.299  13.755
  212    HG   LEU  29           HG       LEU  29   8.471  20.001  14.124
  213   HD11  LEU  29          1HD1      LEU  29   9.529  17.222  14.618
  214   HD12  LEU  29          2HD1      LEU  29   9.137  18.420  15.852
  215   HD13  LEU  29          3HD1      LEU  29  10.463  18.713  14.726
  216   HD21  LEU  29          3HD2      LEU  29   8.334  19.337  11.779
  217   HD22  LEU  29          1HD2      LEU  29   9.057  17.777  12.172
  218   HD23  LEU  29          2HD2      LEU  29   9.996  19.257  12.364
  219    H    GLU  30           H        GLU  30   4.377  19.160  15.085
  220    HA   GLU  30           HA       GLU  30   2.890  16.800  14.280
  221    HB2  GLU  30           2HB      GLU  30   1.729  17.091  16.482
  222    HB3  GLU  30           1HB      GLU  30   3.462  16.829  16.579
  223    HG2  GLU  30           2HG      GLU  30   3.337  18.516  18.050
  224    HG3  GLU  30           1HG      GLU  30   3.427  19.502  16.594
  225    H    SER  31           H        SER  31   2.552  20.214  14.070
  226    HA   SER  31           HA       SER  31  -0.312  20.119  13.735
  227    HB2  SER  31           2HB      SER  31   1.684  22.334  13.227
  228    HB3  SER  31           1HB      SER  31  -0.062  22.511  13.065
  229    HG   SER  31           HG       SER  31   0.953  21.482  15.476
  230    H    VAL  32           H        VAL  32   2.533  20.256  11.610
  231    HA   VAL  32           HA       VAL  32   0.814  20.330   9.260
  232    HB   VAL  32           HB       VAL  32   3.058  21.535   9.400
  233   HG11  VAL  32          1HG1      VAL  32   4.388  19.725  10.344
  234   HG12  VAL  32          2HG1      VAL  32   5.051  20.251   8.797
  235   HG13  VAL  32          3HG1      VAL  32   4.117  18.759   8.895
  236   HG21  VAL  32          3HG2      VAL  32   2.525  19.694   7.077
  237   HG22  VAL  32          1HG2      VAL  32   3.585  21.102   7.035
  238   HG23  VAL  32          2HG2      VAL  32   1.858  21.308   7.316
  239    H    GLY  33           H        GLY  33   2.519  18.022  11.189
  240    HA2  GLY  33           2HA      GLY  33   2.387  15.730  11.209
  241    HA3  GLY  33           1HA      GLY  33   1.147  15.848   9.970
  242    H    LYS  34           H        LYS  34   4.665  16.033  10.441
  243    HA   LYS  34           HA       LYS  34   5.132  15.519   7.641
  244    HB2  LYS  34           2HB      LYS  34   7.046  15.694   9.970
  245    HB3  LYS  34           1HB      LYS  34   7.538  15.456   8.299
  246    HG2  LYS  34           2HG      LYS  34   6.497  17.601   7.703
  247    HG3  LYS  34           1HG      LYS  34   6.070  17.844   9.397
  248    HD2  LYS  34           2HD      LYS  34   8.075  19.082   8.917
  249    HD3  LYS  34           1HD      LYS  34   8.484  17.728   9.969
  250    HE2  LYS  34           2HE      LYS  34  10.140  17.991   8.199
  251    HE3  LYS  34           1HE      LYS  34   9.280  16.461   8.036
  252    HZ1  LYS  34           3HZ      LYS  34   8.578  18.915   6.519
  253    HZ2  LYS  34           1HZ      LYS  34   7.988  17.343   6.268
  254    HZ3  LYS  34           2HZ      LYS  34   9.607  17.709   5.923
  255    H    GLY  35           H        GLY  35   6.698  13.786  10.340
  256    HA2  GLY  35           2HA      GLY  35   5.790  11.267   9.105
  257    HA3  GLY  35           1HA      GLY  35   7.505  11.542   9.344
  258    H    ALA  36           H        ALA  36   6.963  12.944  11.920
  259    HA   ALA  36           HA       ALA  36   7.636  10.994  13.680
  260    HB1  ALA  36           1HB      ALA  36   5.931  13.383  14.360
  261    HB2  ALA  36           2HB      ALA  36   7.685  13.402  14.164
  262    HB3  ALA  36           3HB      ALA  36   6.952  12.470  15.470
  263    H    VAL  37           H        VAL  37   4.299  12.120  13.157
  264    HA   VAL  37           HA       VAL  37   3.086  10.436  15.041
  265    HB   VAL  37           HB       VAL  37   1.835  11.529  12.516
  266   HG11  VAL  37          1HG1      VAL  37   0.601  10.699  15.141
  267   HG12  VAL  37          2HG1      VAL  37   0.488   9.815  13.619
  268   HG13  VAL  37          3HG1      VAL  37  -0.261  11.404  13.773
  269   HG21  VAL  37          3HG2      VAL  37   1.150  13.442  13.899
  270   HG22  VAL  37          1HG2      VAL  37   2.904  13.313  13.780
  271   HG23  VAL  37          2HG2      VAL  37   2.080  12.790  15.248
  272    H    HIS  38           H        HIS  38   3.535  10.040  11.540
  273    HA   HIS  38           HA       HIS  38   2.159   7.590  11.317
  274    HB2  HIS  38           2HB      HIS  38   4.407   8.611   9.564
  275    HB3  HIS  38           1HB      HIS  38   3.270   7.335   9.151
  276    HD1  HIS  38           1HD      HIS  38   0.613   8.700   9.910
  277    HD2  HIS  38           2HD      HIS  38   3.701  10.571   7.834
  278    HE1  HIS  38           1HE      HIS  38  -0.462  10.592   8.648
  279    HE2  HIS  38           2HE      HIS  38   1.445  11.802   7.521
  280    H    ASP  39           H        ASP  39   5.486   8.421  12.004
  281    HA   ASP  39           HA       ASP  39   6.612   5.855  11.742
  282    HB2  ASP  39           2HB      ASP  39   8.009   7.829  11.752
  283    HB3  ASP  39           1HB      ASP  39   7.500   8.231  13.390
  284    H    VAL  40           H        VAL  40   5.284   7.546  14.568
  285    HA   VAL  40           HA       VAL  40   5.949   5.636  16.506
  286    HB   VAL  40           HB       VAL  40   3.518   7.440  16.435
  287   HG11  VAL  40          1HG1      VAL  40   4.791   6.009  18.768
  288   HG12  VAL  40          2HG1      VAL  40   3.240   5.608  18.031
  289   HG13  VAL  40          3HG1      VAL  40   3.450   7.150  18.860
  290   HG21  VAL  40          3HG2      VAL  40   6.236   7.825  17.683
  291   HG22  VAL  40          1HG2      VAL  40   4.859   8.910  17.876
  292   HG23  VAL  40          2HG2      VAL  40   5.592   8.690  16.288
  293    H    LYS  41           H        LYS  41   3.115   5.912  14.418
  294    HA   LYS  41           HA       LYS  41   1.780   3.609  15.428
  295    HB2  LYS  41           2HB      LYS  41   0.977   5.657  13.890
  296    HB3  LYS  41           1HB      LYS  41   1.339   4.506  12.615
  297    HG2  LYS  41           2HG      LYS  41  -0.571   4.031  14.898
  298    HG3  LYS  41           1HG      LYS  41  -1.027   4.499  13.263
  299    HD2  LYS  41           2HD      LYS  41   0.419   1.960  14.014
  300    HD3  LYS  41           1HD      LYS  41  -1.304   2.091  13.665
  301    HE2  LYS  41           2HE      LYS  41  -0.845   2.758  11.399
  302    HE3  LYS  41           1HE      LYS  41   0.889   2.800  11.724
  303    HZ1  LYS  41           3HZ      LYS  41   0.269   0.770  10.583
  304    HZ2  LYS  41           1HZ      LYS  41  -0.844   0.382  11.806
  305    HZ3  LYS  41           2HZ      LYS  41   0.814   0.412  12.147
  306    H    ASP  42           H        ASP  42   4.005   4.233  12.782
  307    HA   ASP  42           HA       ASP  42   3.778   1.780  11.437
  308    HB2  ASP  42           2HB      ASP  42   4.743   3.701  10.357
  309    HB3  ASP  42           1HB      ASP  42   6.020   3.794  11.560
  310    H    VAL  43           H        VAL  43   6.057   2.833  13.954
  311    HA   VAL  43           HA       VAL  43   7.555   0.398  13.881
  312    HB   VAL  43           HB       VAL  43   7.492   2.564  15.991
  313   HG11  VAL  43          1HG1      VAL  43   9.460   0.315  15.563
  314   HG12  VAL  43          2HG1      VAL  43   8.354   0.494  16.925
  315   HG13  VAL  43          3HG1      VAL  43   9.668   1.647  16.701
  316   HG21  VAL  43          3HG2      VAL  43   9.390   2.073  13.700
  317   HG22  VAL  43          1HG2      VAL  43   9.575   3.317  14.936
  318   HG23  VAL  43          2HG2      VAL  43   8.213   3.382  13.816
  319    H    LEU  44           H        LEU  44   5.081   1.696  16.083
  320    HA   LEU  44           HA       LEU  44   5.179  -0.535  17.854
  321    HB2  LEU  44           2HB      LEU  44   4.370   1.663  18.567
  322    HB3  LEU  44           1HB      LEU  44   3.021   1.539  17.452
  323    HG   LEU  44           HG       LEU  44   2.169  -0.402  18.732
  324   HD11  LEU  44          1HD1      LEU  44   3.098  -0.869  20.946
  325   HD12  LEU  44          2HD1      LEU  44   4.422   0.250  20.624
  326   HD13  LEU  44          3HD1      LEU  44   4.255  -1.219  19.660
  327   HD21  LEU  44          3HD2      LEU  44   1.319   1.815  19.207
  328   HD22  LEU  44          1HD2      LEU  44   2.642   2.102  20.339
  329   HD23  LEU  44          2HD2      LEU  44   1.429   0.868  20.690
  330    H    ASP  45           H        ASP  45   2.589   0.508  15.653
  331    HA   ASP  45           HA       ASP  45   1.414  -2.133  15.753
  332    HB2  ASP  45           2HB      ASP  45  -0.058  -0.175  15.806
  333    HB3  ASP  45           1HB      ASP  45   0.558   0.343  14.242
  334    H    SER  46           H        SER  46   3.119  -3.247  14.840
  335    HA   SER  46           HA       SER  46   3.107  -3.261  11.917
  336    HB2  SER  46           2HB      SER  46   5.121  -2.013  12.556
  337    HB3  SER  46           1HB      SER  46   5.596  -3.308  13.652
  338    HG   SER  46           HG       SER  46   5.581  -3.272  10.832
  339    H    VAL  47           H        VAL  47   3.869  -4.854  14.962
  340    HA   VAL  47           HA       VAL  47   4.117  -7.472  13.856
  341    HB   VAL  47           HB       VAL  47   3.471  -6.709  16.710
  342   HG11  VAL  47          1HG1      VAL  47   4.673  -9.217  15.538
  343   HG12  VAL  47          2HG1      VAL  47   3.046  -9.055  16.201
  344   HG13  VAL  47          3HG1      VAL  47   4.450  -8.890  17.257
  345   HG21  VAL  47          3HG2      VAL  47   6.159  -7.132  15.402
  346   HG22  VAL  47          1HG2      VAL  47   5.884  -6.893  17.127
  347   HG23  VAL  47          2HG2      VAL  47   5.517  -5.597  15.990
  348    H    LEU  48           H        LEU  48   2.366  -8.061  12.682
  349    HA   LEU  48           HA       LEU  48  -0.234  -8.042  14.052
  350    HB2  LEU  48           2HB      LEU  48   0.347  -7.737  11.103
  351    HB3  LEU  48           1HB      LEU  48  -1.258  -7.915  11.785
  352    HG   LEU  48           HG       LEU  48   0.620  -5.610  12.339
  353   HD11  LEU  48          1HD1      LEU  48  -0.211  -5.582  10.053
  354   HD12  LEU  48          2HD1      LEU  48  -0.968  -4.305  11.007
  355   HD13  LEU  48          3HD1      LEU  48  -1.862  -5.780  10.637
  356   HD21  LEU  48          3HD2      LEU  48  -0.849  -6.077  14.227
  357   HD22  LEU  48          1HD2      LEU  48  -2.249  -6.082  13.152
  358   HD23  LEU  48          2HD2      LEU  48  -1.341  -4.594  13.410
  Start of MODEL   16
    1    H1   SER   1           1HT      SER   1  19.423  10.243  21.620
    2    H2   SER   1           2HT      SER   1  18.056  10.023  22.602
    3    H3   SER   1           3HT      SER   1  17.989  11.071  21.268
    4    HA   SER   1           HA       SER   1  18.421   8.153  21.135
    5    HB2  SER   1           2HB      SER   1  15.959   9.796  20.482
    6    HB3  SER   1           1HB      SER   1  16.135   8.060  20.219
    7    HG   SER   1           HG       SER   1  15.589   7.778  22.214
    8    H    SER   2           H        SER   2  19.717   7.786  19.497
    9    HA   SER   2           HA       SER   2  20.135   9.612  17.354
   10    HB2  SER   2           2HB      SER   2  20.909   6.692  17.386
   11    HB3  SER   2           1HB      SER   2  21.721   8.024  16.562
   12    HG   SER   2           HG       SER   2  21.600   7.498  19.349
   13    H    LEU   3           H        LEU   3  18.881   9.884  15.618
   14    HA   LEU   3           HA       LEU   3  16.962   7.775  14.935
   15    HB2  LEU   3           2HB      LEU   3  17.107  10.660  14.060
   16    HB3  LEU   3           1HB      LEU   3  15.863   9.525  13.570
   17    HG   LEU   3           HG       LEU   3  16.365  10.503  16.383
   18   HD11  LEU   3          1HD1      LEU   3  14.108  11.046  14.462
   19   HD12  LEU   3          2HD1      LEU   3  15.357  12.191  14.956
   20   HD13  LEU   3          3HD1      LEU   3  14.192  11.590  16.137
   21   HD21  LEU   3          3HD2      LEU   3  14.234   8.641  15.331
   22   HD22  LEU   3          1HD2      LEU   3  14.336   9.276  16.974
   23   HD23  LEU   3          2HD2      LEU   3  15.585   8.186  16.370
   24    H    LEU   4           H        LEU   4  19.768   9.403  13.744
   25    HA   LEU   4           HA       LEU   4  20.072   7.573  11.561
   26    HB2  LEU   4           2HB      LEU   4  18.451   9.511  10.838
   27    HB3  LEU   4           1HB      LEU   4  19.918  10.464  10.760
   28    HG   LEU   4           HG       LEU   4  20.845   8.897   9.099
   29   HD11  LEU   4          1HD1      LEU   4  19.369   7.225   8.073
   30   HD12  LEU   4          2HD1      LEU   4  18.140   7.578   9.287
   31   HD13  LEU   4          3HD1      LEU   4  19.682   6.875   9.773
   32   HD21  LEU   4          3HD2      LEU   4  18.117   9.980   8.403
   33   HD22  LEU   4          1HD2      LEU   4  19.379   9.535   7.252
   34   HD23  LEU   4          2HD2      LEU   4  19.633  10.881   8.363
   35    H    GLU   5           H        GLU   5  22.121   8.666  10.164
   36    HA   GLU   5           HA       GLU   5  24.155   8.810  12.168
   37    HB2  GLU   5           2HB      GLU   5  25.764   8.816  10.399
   38    HB3  GLU   5           1HB      GLU   5  24.499   7.679   9.971
   39    HG2  GLU   5           2HG      GLU   5  24.784  10.469   8.885
   40    HG3  GLU   5           1HG      GLU   5  25.272   8.991   8.063
   41    H    LYS   6           H        LYS   6  22.607  11.186  10.045
   42    HA   LYS   6           HA       LYS   6  24.012  13.291  11.536
   43    HB2  LYS   6           2HB      LYS   6  22.130  13.446   9.178
   44    HB3  LYS   6           1HB      LYS   6  22.675  14.863  10.059
   45    HG2  LYS   6           2HG      LYS   6  24.190  14.877   8.379
   46    HG3  LYS   6           1HG      LYS   6  25.052  13.831   9.509
   47    HD2  LYS   6           2HD      LYS   6  25.096  12.893   7.267
   48    HD3  LYS   6           1HD      LYS   6  24.157  11.862   8.351
   49    HE2  LYS   6           2HE      LYS   6  22.091  12.966   7.506
   50    HE3  LYS   6           1HE      LYS   6  23.086  13.838   6.339
   51    HZ1  LYS   6           3HZ      LYS   6  22.877  10.886   6.525
   52    HZ2  LYS   6           1HZ      LYS   6  23.749  11.757   5.359
   53    HZ3  LYS   6           2HZ      LYS   6  22.054  11.845   5.400
   54    H    GLY   7           H        GLY   7  21.435  11.348  11.942
   55    HA2  GLY   7           2HA      GLY   7  19.461  13.254  12.832
   56    HA3  GLY   7           1HA      GLY   7  19.352  11.502  12.943
   57    H    LEU   8           H        LEU   8  21.620  13.889  14.208
   58    HA   LEU   8           HA       LEU   8  20.720  13.655  16.906
   59    HB2  LEU   8           2HB      LEU   8  22.159  11.547  16.433
   60    HB3  LEU   8           1HB      LEU   8  23.519  12.648  16.392
   61    HG   LEU   8           HG       LEU   8  21.696  12.331  18.783
   62   HD11  LEU   8          1HD1      LEU   8  23.483  10.994  19.766
   63   HD12  LEU   8          2HD1      LEU   8  24.390  11.086  18.257
   64   HD13  LEU   8          3HD1      LEU   8  22.845  10.235  18.305
   65   HD21  LEU   8          3HD2      LEU   8  23.501  13.439  19.998
   66   HD22  LEU   8          1HD2      LEU   8  22.897  14.466  18.700
   67   HD23  LEU   8          2HD2      LEU   8  24.421  13.602  18.502
   68    H    ASP   9           H        ASP   9  23.894  14.168  15.398
   69    HA   ASP   9           HA       ASP   9  24.327  16.642  16.722
   70    HB2  ASP   9           2HB      ASP   9  26.217  15.281  16.092
   71    HB3  ASP   9           1HB      ASP   9  25.754  15.345  14.395
   72    H    GLY  10           H        GLY  10  23.391  15.780  13.416
   73    HA2  GLY  10           2HA      GLY  10  23.463  18.446  12.431
   74    HA3  GLY  10           1HA      GLY  10  22.714  17.068  11.641
   75    H    ALA  11           H        ALA  11  21.195  16.774  14.331
   76    HA   ALA  11           HA       ALA  11  18.956  18.430  13.456
   77    HB1  ALA  11           1HB      ALA  11  18.572  16.022  13.748
   78    HB2  ALA  11           2HB      ALA  11  17.573  16.982  14.837
   79    HB3  ALA  11           3HB      ALA  11  19.009  16.165  15.449
   80    H    LYS  12           H        LYS  12  21.412  18.459  15.754
   81    HA   LYS  12           HA       LYS  12  19.996  20.500  17.325
   82    HB2  LYS  12           2HB      LYS  12  21.676  18.243  18.449
   83    HB3  LYS  12           1HB      LYS  12  21.131  19.628  19.382
   84    HG2  LYS  12           2HG      LYS  12  19.329  17.623  18.040
   85    HG3  LYS  12           1HG      LYS  12  19.754  17.627  19.752
   86    HD2  LYS  12           2HD      LYS  12  18.336  19.866  18.304
   87    HD3  LYS  12           1HD      LYS  12  17.546  18.654  19.312
   88    HE2  LYS  12           2HE      LYS  12  18.772  19.432  21.257
   89    HE3  LYS  12           1HE      LYS  12  19.661  20.585  20.262
   90    HZ1  LYS  12           3HZ      LYS  12  17.584  21.721  19.778
   91    HZ2  LYS  12           1HZ      LYS  12  17.855  21.659  21.452
   92    HZ3  LYS  12           2HZ      LYS  12  16.725  20.615  20.736
   93    H    LYS  13           H        LYS  13  21.786  20.782  15.157
   94    HA   LYS  13           HA       LYS  13  24.494  20.964  15.892
   95    HB2  LYS  13           2HB      LYS  13  23.817  20.701  13.587
   96    HB3  LYS  13           1HB      LYS  13  22.969  22.238  13.624
   97    HG2  LYS  13           2HG      LYS  13  25.117  22.337  12.431
   98    HG3  LYS  13           1HG      LYS  13  25.042  23.442  13.803
   99    HD2  LYS  13           2HD      LYS  13  26.381  21.961  15.138
  100    HD3  LYS  13           1HD      LYS  13  26.322  20.713  13.890
  101    HE2  LYS  13           2HE      LYS  13  27.520  23.442  13.451
  102    HE3  LYS  13           1HE      LYS  13  28.456  22.048  13.991
  103    HZ1  LYS  13           3HZ      LYS  13  28.471  22.478  11.531
  104    HZ2  LYS  13           1HZ      LYS  13  26.836  22.030  11.506
  105    HZ3  LYS  13           2HZ      LYS  13  28.008  20.909  11.990
  106    H    ALA  14           H        ALA  14  24.723  22.125  17.753
  107    HA   ALA  14           HA       ALA  14  25.128  23.916  19.077
  108    HB1  ALA  14           1HB      ALA  14  26.159  25.833  18.007
  109    HB2  ALA  14           2HB      ALA  14  25.537  25.315  16.439
  110    HB3  ALA  14           3HB      ALA  14  26.737  24.333  17.279
  111    H    VAL  15           H        VAL  15  22.312  23.545  18.070
  112    HA   VAL  15           HA       VAL  15  20.305  24.593  17.889
  113    HB   VAL  15           HB       VAL  15  21.601  26.764  19.561
  114   HG11  VAL  15          1HG1      VAL  15  19.314  27.337  20.208
  115   HG12  VAL  15          2HG1      VAL  15  18.689  26.096  19.123
  116   HG13  VAL  15          3HG1      VAL  15  19.539  27.494  18.465
  117   HG21  VAL  15          3HG2      VAL  15  19.993  24.365  20.434
  118   HG22  VAL  15          1HG2      VAL  15  20.618  25.637  21.483
  119   HG23  VAL  15          2HG2      VAL  15  21.733  24.566  20.635
  120    H    GLY  16           H        GLY  16  20.088  25.048  15.785
  121    HA2  GLY  16           2HA      GLY  16  21.906  26.829  14.455
  122    HA3  GLY  16           1HA      GLY  16  20.603  25.922  13.712
  123    H    GLY  17           H        GLY  17  20.549  28.384  16.268
  124    HA2  GLY  17           2HA      GLY  17  18.549  29.859  14.720
  125    HA3  GLY  17           1HA      GLY  17  18.958  30.126  16.411
  126    H    LEU  18           H        LEU  18  21.887  29.905  15.297
  127    HA   LEU  18           HA       LEU  18  22.169  32.763  15.044
  128    HB2  LEU  18           2HB      LEU  18  24.551  32.417  15.168
  129    HB3  LEU  18           1HB      LEU  18  23.755  31.508  16.431
  130    HG   LEU  18           HG       LEU  18  24.674  30.223  13.860
  131   HD11  LEU  18          1HD1      LEU  18  26.598  31.270  14.935
  132   HD12  LEU  18          2HD1      LEU  18  26.674  29.514  15.075
  133   HD13  LEU  18          3HD1      LEU  18  26.181  30.487  16.459
  134   HD21  LEU  18          3HD2      LEU  18  24.065  29.104  16.597
  135   HD22  LEU  18          1HD2      LEU  18  24.623  28.178  15.202
  136   HD23  LEU  18          2HD2      LEU  18  23.041  28.958  15.169
  137    H    GLY  19           H        GLY  19  21.249  33.272  13.103
  138    HA2  GLY  19           2HA      GLY  19  21.575  33.996  10.928
  139    HA3  GLY  19           1HA      GLY  19  23.056  33.060  10.870
  140    H    LYS  20           H        LYS  20  21.933  30.527  11.502
  141    HA   LYS  20           HA       LYS  20  21.246  29.738   8.870
  142    HB2  LYS  20           2HB      LYS  20  20.943  28.083  11.380
  143    HB3  LYS  20           1HB      LYS  20  21.133  27.495   9.734
  144    HG2  LYS  20           2HG      LYS  20  23.201  28.907  11.406
  145    HG3  LYS  20           1HG      LYS  20  23.202  27.216  10.906
  146    HD2  LYS  20           2HD      LYS  20  23.332  29.566   9.016
  147    HD3  LYS  20           1HD      LYS  20  24.733  28.651   9.575
  148    HE2  LYS  20           2HE      LYS  20  22.401  27.484   8.059
  149    HE3  LYS  20           1HE      LYS  20  23.933  27.965   7.335
  150    HZ1  LYS  20           3HZ      LYS  20  25.055  26.331   8.730
  151    HZ2  LYS  20           1HZ      LYS  20  23.874  25.595   7.762
  152    HZ3  LYS  20           2HZ      LYS  20  23.574  25.865   9.405
  153    H    LEU  21           H        LEU  21  19.356  29.248  11.852
  154    HA   LEU  21           HA       LEU  21  17.179  29.620  12.362
  155    HB2  LEU  21           2HB      LEU  21  16.987  30.825   9.608
  156    HB3  LEU  21           1HB      LEU  21  15.707  30.857  10.805
  157    HG   LEU  21           HG       LEU  21  18.415  32.164  11.112
  158   HD11  LEU  21          1HD1      LEU  21  17.186  34.262  10.891
  159   HD12  LEU  21          2HD1      LEU  21  15.701  33.363  10.575
  160   HD13  LEU  21          3HD1      LEU  21  17.045  33.276   9.435
  161   HD21  LEU  21          3HD2      LEU  21  17.438  33.198  13.101
  162   HD22  LEU  21          1HD2      LEU  21  17.477  31.441  13.243
  163   HD23  LEU  21          2HD2      LEU  21  15.962  32.261  12.865
  164    H    GLY  22           H        GLY  22  17.592  28.426   9.049
  165    HA2  GLY  22           2HA      GLY  22  15.179  27.288   8.545
  166    HA3  GLY  22           1HA      GLY  22  16.690  26.613   7.968
  167    H    LYS  23           H        LYS  23  17.818  25.609  10.270
  168    HA   LYS  23           HA       LYS  23  16.418  23.172  10.528
  169    HB2  LYS  23           2HB      LYS  23  18.710  24.309  12.134
  170    HB3  LYS  23           1HB      LYS  23  18.104  22.669  12.322
  171    HG2  LYS  23           2HG      LYS  23  19.267  23.826   9.792
  172    HG3  LYS  23           1HG      LYS  23  20.102  22.751  10.916
  173    HD2  LYS  23           2HD      LYS  23  18.453  21.003  10.482
  174    HD3  LYS  23           1HD      LYS  23  17.593  22.079   9.379
  175    HE2  LYS  23           2HE      LYS  23  19.611  22.190   7.964
  176    HE3  LYS  23           1HE      LYS  23  20.406  21.046   9.044
  177    HZ1  LYS  23           3HZ      LYS  23  17.899  20.487   7.555
  178    HZ2  LYS  23           1HZ      LYS  23  18.789  19.385   8.487
  179    HZ3  LYS  23           2HZ      LYS  23  19.443  20.000   7.047
  180    H    ASP  24           H        ASP  24  16.949  25.794  12.869
  181    HA   ASP  24           HA       ASP  24  15.508  24.618  14.980
  182    HB2  ASP  24           2HB      ASP  24  17.151  26.440  15.274
  183    HB3  ASP  24           1HB      ASP  24  16.054  27.552  14.464
  184    H    ALA  25           H        ALA  25  14.510  26.485  12.229
  185    HA   ALA  25           HA       ALA  25  11.940  27.171  13.323
  186    HB1  ALA  25           1HB      ALA  25  13.094  28.656  11.762
  187    HB2  ALA  25           2HB      ALA  25  11.502  28.184  11.161
  188    HB3  ALA  25           3HB      ALA  25  12.956  27.431  10.501
  189    H    VAL  26           H        VAL  26  13.184  24.350  11.926
  190    HA   VAL  26           HA       VAL  26  10.465  23.558  11.110
  191    HB   VAL  26           HB       VAL  26  12.068  23.619   9.229
  192   HG11  VAL  26          1HG1      VAL  26  13.455  21.373  10.683
  193   HG12  VAL  26          2HG1      VAL  26  14.113  22.981  10.367
  194   HG13  VAL  26          3HG1      VAL  26  13.780  21.884   9.026
  195   HG21  VAL  26          3HG2      VAL  26  10.124  22.179   9.117
  196   HG22  VAL  26          1HG2      VAL  26  11.009  20.888   9.930
  197   HG23  VAL  26          2HG2      VAL  26  11.499  21.414   8.321
  198    H    GLU  27           H        GLU  27  13.317  22.629  12.931
  199    HA   GLU  27           HA       GLU  27  12.744  19.952  13.397
  200    HB2  GLU  27           2HB      GLU  27  14.127  20.196  15.460
  201    HB3  GLU  27           1HB      GLU  27  14.885  20.829  14.007
  202    HG2  GLU  27           2HG      GLU  27  14.319  23.090  14.663
  203    HG3  GLU  27           1HG      GLU  27  13.478  22.486  16.088
  204    H    ASP  28           H        ASP  28  11.777  22.761  15.352
  205    HA   ASP  28           HA       ASP  28  10.330  21.254  17.268
  206    HB2  ASP  28           2HB      ASP  28  11.149  23.512  17.753
  207    HB3  ASP  28           1HB      ASP  28  10.096  24.179  16.510
  208    H    LEU  29           H        LEU  29   9.530  22.659  14.192
  209    HA   LEU  29           HA       LEU  29   6.726  22.733  14.433
  210    HB2  LEU  29           2HB      LEU  29   7.904  24.007  12.746
  211    HB3  LEU  29           1HB      LEU  29   8.501  22.538  12.001
  212    HG   LEU  29           HG       LEU  29   6.152  21.931  11.425
  213   HD11  LEU  29          1HD1      LEU  29   5.558  24.720  12.397
  214   HD12  LEU  29          2HD1      LEU  29   5.010  23.220  13.146
  215   HD13  LEU  29          3HD1      LEU  29   4.438  23.664  11.537
  216   HD21  LEU  29          3HD2      LEU  29   5.952  23.546   9.601
  217   HD22  LEU  29          1HD2      LEU  29   7.615  22.994   9.800
  218   HD23  LEU  29          2HD2      LEU  29   7.137  24.586  10.394
  219    H    GLU  30           H        GLU  30   8.930  20.229  13.231
  220    HA   GLU  30           HA       GLU  30   6.681  18.548  12.476
  221    HB2  GLU  30           2HB      GLU  30   8.430  17.000  11.640
  222    HB3  GLU  30           1HB      GLU  30   8.534  18.610  10.944
  223    HG2  GLU  30           2HG      GLU  30  10.352  19.154  12.500
  224    HG3  GLU  30           1HG      GLU  30  10.260  17.521  13.158
  225    H    SER  31           H        SER  31   9.019  18.803  15.040
  226    HA   SER  31           HA       SER  31   8.793  16.097  15.935
  227    HB2  SER  31           2HB      SER  31  10.802  17.571  16.289
  228    HB3  SER  31           1HB      SER  31   9.859  18.478  17.470
  229    HG   SER  31           HG       SER  31  10.472  15.697  17.596
  230    H    VAL  32           H        VAL  32   6.912  18.934  16.417
  231    HA   VAL  32           HA       VAL  32   5.935  18.196  19.029
  232    HB   VAL  32           HB       VAL  32   6.211  20.558  18.279
  233   HG11  VAL  32          1HG1      VAL  32   4.458  21.584  16.905
  234   HG12  VAL  32          2HG1      VAL  32   3.790  19.983  16.588
  235   HG13  VAL  32          3HG1      VAL  32   5.407  20.394  16.016
  236   HG21  VAL  32          3HG2      VAL  32   3.440  19.796  19.188
  237   HG22  VAL  32          1HG2      VAL  32   4.157  21.403  19.321
  238   HG23  VAL  32          2HG2      VAL  32   4.849  20.051  20.218
  239    H    GLY  33           H        GLY  33   5.529  16.183  17.038
  240    HA2  GLY  33           2HA      GLY  33   3.840  14.555  17.048
  241    HA3  GLY  33           1HA      GLY  33   2.690  15.781  17.551
  242    H    LYS  34           H        LYS  34   4.813  16.229  14.794
  243    HA   LYS  34           HA       LYS  34   2.439  16.164  13.081
  244    HB2  LYS  34           2HB      LYS  34   5.043  17.598  12.933
  245    HB3  LYS  34           1HB      LYS  34   4.270  17.160  11.416
  246    HG2  LYS  34           2HG      LYS  34   3.683  19.422  12.073
  247    HG3  LYS  34           1HG      LYS  34   2.263  18.380  12.070
  248    HD2  LYS  34           2HD      LYS  34   2.456  18.147  14.512
  249    HD3  LYS  34           1HD      LYS  34   3.846  19.234  14.492
  250    HE2  LYS  34           2HE      LYS  34   1.072  19.951  13.544
  251    HE3  LYS  34           1HE      LYS  34   1.738  20.371  15.121
  252    HZ1  LYS  34           3HZ      LYS  34   2.970  21.206  12.557
  253    HZ2  LYS  34           1HZ      LYS  34   3.359  21.756  14.111
  254    HZ3  LYS  34           2HZ      LYS  34   1.868  22.163  13.416
  255    H    GLY  35           H        GLY  35   5.868  15.437  12.436
  256    HA2  GLY  35           2HA      GLY  35   5.053  13.420  10.539
  257    HA3  GLY  35           1HA      GLY  35   6.698  13.926  10.887
  258    H    ALA  36           H        ALA  36   6.543  13.497  13.718
  259    HA   ALA  36           HA       ALA  36   7.652  10.991  13.875
  260    HB1  ALA  36           1HB      ALA  36   7.907  12.748  15.573
  261    HB2  ALA  36           2HB      ALA  36   7.484  11.190  16.281
  262    HB3  ALA  36           3HB      ALA  36   6.257  12.445  16.117
  263    H    VAL  37           H        VAL  37   4.274  11.866  14.525
  264    HA   VAL  37           HA       VAL  37   3.486   9.389  15.588
  265    HB   VAL  37           HB       VAL  37   2.173  11.449  15.868
  266   HG11  VAL  37          1HG1      VAL  37   1.448  11.081  12.967
  267   HG12  VAL  37          2HG1      VAL  37   2.397  12.401  13.652
  268   HG13  VAL  37          3HG1      VAL  37   0.692  12.228  14.074
  269   HG21  VAL  37          3HG2      VAL  37   1.095   9.315  16.270
  270   HG22  VAL  37          1HG2      VAL  37   0.648   9.195  14.567
  271   HG23  VAL  37          2HG2      VAL  37  -0.054  10.460  15.577
  272    H    HIS  38           H        HIS  38   4.016  10.389  12.312
  273    HA   HIS  38           HA       HIS  38   2.332   8.425  11.083
  274    HB2  HIS  38           2HB      HIS  38   4.680   9.935   9.917
  275    HB3  HIS  38           1HB      HIS  38   3.522   8.983   8.997
  276    HD1  HIS  38           1HD      HIS  38   4.178  12.187   8.929
  277    HD2  HIS  38           2HD      HIS  38   0.789  10.275  10.407
  278    HE1  HIS  38           1HE      HIS  38   2.341  13.909   8.869
  279    HE2  HIS  38           2HE      HIS  38   0.349  12.785   9.925
  280    H    ASP  39           H        ASP  39   5.761   8.619  11.912
  281    HA   ASP  39           HA       ASP  39   6.371   6.032  10.822
  282    HB2  ASP  39           2HB      ASP  39   7.934   7.839  12.677
  283    HB3  ASP  39           1HB      ASP  39   8.550   6.324  12.023
  284    H    VAL  40           H        VAL  40   5.783   7.370  14.038
  285    HA   VAL  40           HA       VAL  40   6.295   5.068  15.539
  286    HB   VAL  40           HB       VAL  40   4.344   7.312  16.102
  287   HG11  VAL  40          1HG1      VAL  40   3.712   5.350  17.398
  288   HG12  VAL  40          2HG1      VAL  40   4.422   6.578  18.446
  289   HG13  VAL  40          3HG1      VAL  40   5.371   5.171  17.968
  290   HG21  VAL  40          3HG2      VAL  40   7.143   6.798  17.108
  291   HG22  VAL  40          1HG2      VAL  40   6.099   8.140  17.581
  292   HG23  VAL  40          2HG2      VAL  40   6.674   8.016  15.919
  293    H    LYS  41           H        LYS  41   3.343   6.140  13.915
  294    HA   LYS  41           HA       LYS  41   1.522   4.287  14.853
  295    HB2  LYS  41           2HB      LYS  41   1.107   6.219  13.265
  296    HB3  LYS  41           1HB      LYS  41   1.702   5.189  11.975
  297    HG2  LYS  41           2HG      LYS  41  -0.601   4.987  11.812
  298    HG3  LYS  41           1HG      LYS  41  -0.130   3.544  12.711
  299    HD2  LYS  41           2HD      LYS  41  -0.937   6.049  14.145
  300    HD3  LYS  41           1HD      LYS  41  -2.156   4.939  13.523
  301    HE2  LYS  41           2HE      LYS  41   0.083   4.032  15.310
  302    HE3  LYS  41           1HE      LYS  41  -1.439   4.648  15.949
  303    HZ1  LYS  41           3HZ      LYS  41  -1.081   2.264  14.200
  304    HZ2  LYS  41           1HZ      LYS  41  -2.585   2.908  14.655
  305    HZ3  LYS  41           2HZ      LYS  41  -1.548   2.276  15.830
  306    H    ASP  42           H        ASP  42   3.698   3.969  12.060
  307    HA   ASP  42           HA       ASP  42   2.867   1.366  11.344
  308    HB2  ASP  42           2HB      ASP  42   3.916   2.673   9.669
  309    HB3  ASP  42           1HB      ASP  42   5.317   2.991  10.686
  310    H    VAL  43           H        VAL  43   5.714   2.509  13.145
  311    HA   VAL  43           HA       VAL  43   6.868  -0.048  13.476
  312    HB   VAL  43           HB       VAL  43   7.260   2.419  15.185
  313   HG11  VAL  43          1HG1      VAL  43   8.986  -0.037  14.874
  314   HG12  VAL  43          2HG1      VAL  43   8.035   0.387  16.298
  315   HG13  VAL  43          3HG1      VAL  43   9.395   1.400  15.809
  316   HG21  VAL  43          3HG2      VAL  43   7.752   2.856  12.845
  317   HG22  VAL  43          1HG2      VAL  43   8.783   1.425  12.774
  318   HG23  VAL  43          2HG2      VAL  43   9.245   2.798  13.781
  319    H    LEU  44           H        LEU  44   4.786   1.897  15.602
  320    HA   LEU  44           HA       LEU  44   4.928   0.168  17.831
  321    HB2  LEU  44           2HB      LEU  44   4.214   2.528  17.942
  322    HB3  LEU  44           1HB      LEU  44   2.749   2.118  17.074
  323    HG   LEU  44           HG       LEU  44   2.094   0.643  18.966
  324   HD11  LEU  44          1HD1      LEU  44   4.473   1.892  20.337
  325   HD12  LEU  44          2HD1      LEU  44   4.336   0.204  19.841
  326   HD13  LEU  44          3HD1      LEU  44   3.265   0.844  21.088
  327   HD21  LEU  44          3HD2      LEU  44   2.636   3.526  19.667
  328   HD22  LEU  44          1HD2      LEU  44   1.470   2.471  20.469
  329   HD23  LEU  44          2HD2      LEU  44   1.240   2.918  18.779
  330    H    ASP  45           H        ASP  45   2.841   0.240  15.007
  331    HA   ASP  45           HA       ASP  45   1.047  -1.767  16.020
  332    HB2  ASP  45           2HB      ASP  45   1.453  -0.580  13.277
  333    HB3  ASP  45           1HB      ASP  45   0.299  -1.872  13.584
  334    H    SER  46           H        SER  46   4.048  -1.727  14.300
  335    HA   SER  46           HA       SER  46   3.779  -4.396  13.267
  336    HB2  SER  46           2HB      SER  46   5.157  -2.550  12.194
  337    HB3  SER  46           1HB      SER  46   6.326  -2.777  13.497
  338    HG   SER  46           HG       SER  46   5.831  -4.316  11.269
  339    H    VAL  47           H        VAL  47   5.829  -2.873  15.779
  340    HA   VAL  47           HA       VAL  47   6.021  -5.498  17.080
  341    HB   VAL  47           HB       VAL  47   8.050  -5.238  15.745
  342   HG11  VAL  47          1HG1      VAL  47   8.493  -2.701  17.313
  343   HG12  VAL  47          2HG1      VAL  47   8.148  -2.822  15.587
  344   HG13  VAL  47          3HG1      VAL  47   9.666  -3.451  16.232
  345   HG21  VAL  47          3HG2      VAL  47   8.558  -4.901  18.699
  346   HG22  VAL  47          1HG2      VAL  47   9.716  -5.526  17.526
  347   HG23  VAL  47          2HG2      VAL  47   8.232  -6.417  17.861
  348    H    LEU  48           H        LEU  48   6.091  -5.462  19.284
  349    HA   LEU  48           HA       LEU  48   6.704  -3.134  20.809
  350    HB2  LEU  48           2HB      LEU  48   4.427  -2.531  20.070
  351    HB3  LEU  48           1HB      LEU  48   3.817  -4.032  20.739
  352    HG   LEU  48           HG       LEU  48   4.539  -3.261  22.996
  353   HD11  LEU  48          1HD1      LEU  48   5.061  -0.664  21.557
  354   HD12  LEU  48          2HD1      LEU  48   6.272  -1.692  22.322
  355   HD13  LEU  48          3HD1      LEU  48   5.050  -0.891  23.307
  356   HD21  LEU  48          3HD2      LEU  48   2.624  -1.459  21.526
  357   HD22  LEU  48          1HD2      LEU  48   2.706  -1.671  23.275
  358   HD23  LEU  48          2HD2      LEU  48   2.235  -3.022  22.244
  Start of MODEL   17
    1    H1   SER   1           1HT      SER   1   9.055  61.099   7.157
    2    H2   SER   1           2HT      SER   1   8.544  60.811   8.751
    3    H3   SER   1           3HT      SER   1   7.953  59.853   7.484
    4    HA   SER   1           HA       SER   1  10.747  59.963   8.438
    5    HB2  SER   1           2HB      SER   1   8.700  57.728   8.554
    6    HB3  SER   1           1HB      SER   1  10.342  57.680   9.199
    7    HG   SER   1           HG       SER   1   9.649  58.635  10.926
    8    H    SER   2           H        SER   2  12.233  58.747   7.252
    9    HA   SER   2           HA       SER   2  11.847  58.592   4.479
   10    HB2  SER   2           2HB      SER   2  13.887  57.107   6.160
   11    HB3  SER   2           1HB      SER   2  13.990  57.412   4.427
   12    HG   SER   2           HG       SER   2  14.125  59.275   6.559
   13    H    LEU   3           H        LEU   3  10.637  57.244   3.363
   14    HA   LEU   3           HA       LEU   3   9.597  54.847   4.580
   15    HB2  LEU   3           2HB      LEU   3   8.421  54.639   2.321
   16    HB3  LEU   3           1HB      LEU   3   7.991  55.981   3.361
   17    HG   LEU   3           HG       LEU   3   9.607  57.385   1.963
   18   HD11  LEU   3          1HD1      LEU   3  10.026  56.609  -0.311
   19   HD12  LEU   3          2HD1      LEU   3   9.309  55.047   0.081
   20   HD13  LEU   3          3HD1      LEU   3  10.800  55.554   0.873
   21   HD21  LEU   3          3HD2      LEU   3   7.125  56.247   0.687
   22   HD22  LEU   3          1HD2      LEU   3   7.919  57.754   0.232
   23   HD23  LEU   3          2HD2      LEU   3   7.193  57.589   1.830
   24    H    LEU   4           H        LEU   4  12.484  55.150   3.705
   25    HA   LEU   4           HA       LEU   4  12.898  53.049   1.802
   26    HB2  LEU   4           2HB      LEU   4  14.745  54.439   3.743
   27    HB3  LEU   4           1HB      LEU   4  15.280  53.149   2.686
   28    HG   LEU   4           HG       LEU   4  15.928  55.181   1.659
   29   HD11  LEU   4          1HD1      LEU   4  13.422  54.189   0.318
   30   HD12  LEU   4          2HD1      LEU   4  15.054  53.552   0.107
   31   HD13  LEU   4          3HD1      LEU   4  14.666  55.184  -0.438
   32   HD21  LEU   4          3HD2      LEU   4  13.091  56.144   2.012
   33   HD22  LEU   4          1HD2      LEU   4  14.365  57.000   1.142
   34   HD23  LEU   4          2HD2      LEU   4  14.511  56.730   2.879
   35    H    GLU   5           H        GLU   5  14.836  51.442   3.044
   36    HA   GLU   5           HA       GLU   5  13.111  49.512   4.167
   37    HB2  GLU   5           2HB      GLU   5  16.131  49.581   4.201
   38    HB3  GLU   5           1HB      GLU   5  15.131  48.169   4.509
   39    HG2  GLU   5           2HG      GLU   5  15.378  49.675   1.915
   40    HG3  GLU   5           1HG      GLU   5  15.994  48.063   2.277
   41    H    LYS   6           H        LYS   6  14.379  52.196   5.661
   42    HA   LYS   6           HA       LYS   6  14.728  50.976   8.280
   43    HB2  LYS   6           2HB      LYS   6  15.055  53.784   7.246
   44    HB3  LYS   6           1HB      LYS   6  15.011  53.454   8.971
   45    HG2  LYS   6           2HG      LYS   6  17.286  53.583   8.316
   46    HG3  LYS   6           1HG      LYS   6  16.928  51.891   8.651
   47    HD2  LYS   6           2HD      LYS   6  18.269  52.051   6.659
   48    HD3  LYS   6           1HD      LYS   6  16.646  51.512   6.230
   49    HE2  LYS   6           2HE      LYS   6  17.415  53.155   4.640
   50    HE3  LYS   6           1HE      LYS   6  16.080  53.819   5.581
   51    HZ1  LYS   6           3HZ      LYS   6  18.973  54.400   5.927
   52    HZ2  LYS   6           1HZ      LYS   6  17.763  54.940   6.987
   53    HZ3  LYS   6           2HZ      LYS   6  17.770  55.464   5.380
   54    H    GLY   7           H        GLY   7  12.225  52.305   6.415
   55    HA2  GLY   7           2HA      GLY   7  10.551  52.592   8.840
   56    HA3  GLY   7           1HA      GLY   7  10.406  53.684   7.470
   57    H    LEU   8           H        LEU   8  10.560  51.943   5.367
   58    HA   LEU   8           HA       LEU   8   8.247  50.166   5.766
   59    HB2  LEU   8           2HB      LEU   8   7.760  52.031   4.247
   60    HB3  LEU   8           1HB      LEU   8   9.148  51.606   3.264
   61    HG   LEU   8           HG       LEU   8   8.040  49.415   2.770
   62   HD11  LEU   8          1HD1      LEU   8   5.661  50.716   4.088
   63   HD12  LEU   8          2HD1      LEU   8   6.554  49.326   4.702
   64   HD13  LEU   8          3HD1      LEU   8   5.651  49.195   3.195
   65   HD21  LEU   8          3HD2      LEU   8   6.449  50.352   1.160
   66   HD22  LEU   8          1HD2      LEU   8   7.966  51.252   1.184
   67   HD23  LEU   8          2HD2      LEU   8   6.539  51.908   1.986
   68    H    ASP   9           H        ASP   9   9.091  48.183   6.046
   69    HA   ASP   9           HA       ASP   9  11.608  47.491   4.807
   70    HB2  ASP   9           2HB      ASP   9  11.236  46.761   7.092
   71    HB3  ASP   9           1HB      ASP   9   9.781  45.892   6.608
   72    H    GLY  10           H        GLY  10  11.726  46.771   2.833
   73    HA2  GLY  10           2HA      GLY  10   9.652  44.870   1.919
   74    HA3  GLY  10           1HA      GLY  10  10.639  45.860   0.842
   75    H    ALA  11           H        ALA  11  12.778  45.253   3.029
   76    HA   ALA  11           HA       ALA  11  14.301  43.468   1.554
   77    HB1  ALA  11           1HB      ALA  11  15.213  45.027   3.207
   78    HB2  ALA  11           2HB      ALA  11  15.786  43.382   3.473
   79    HB3  ALA  11           3HB      ALA  11  14.524  44.053   4.504
   80    H    LYS  12           H        LYS  12  12.202  42.803   4.365
   81    HA   LYS  12           HA       LYS  12  13.003  40.035   4.446
   82    HB2  LYS  12           2HB      LYS  12  10.519  41.189   5.713
   83    HB3  LYS  12           1HB      LYS  12  11.399  39.749   6.189
   84    HG2  LYS  12           2HG      LYS  12  12.190  42.617   6.574
   85    HG3  LYS  12           1HG      LYS  12  11.846  41.403   7.803
   86    HD2  LYS  12           2HD      LYS  12  13.832  40.139   7.041
   87    HD3  LYS  12           1HD      LYS  12  14.198  41.451   5.919
   88    HE2  LYS  12           2HE      LYS  12  14.179  41.531   8.929
   89    HE3  LYS  12           1HE      LYS  12  15.541  41.797   7.847
   90    HZ1  LYS  12           3HZ      LYS  12  14.133  43.771   7.002
   91    HZ2  LYS  12           1HZ      LYS  12  14.937  43.922   8.491
   92    HZ3  LYS  12           2HZ      LYS  12  13.275  43.590   8.447
   93    H    LYS  13           H        LYS  13  10.452  41.903   2.997
   94    HA   LYS  13           HA       LYS  13   8.743  39.679   2.418
   95    HB2  LYS  13           2HB      LYS  13   8.743  42.507   1.352
   96    HB3  LYS  13           1HB      LYS  13   7.469  41.327   1.077
   97    HG2  LYS  13           2HG      LYS  13   7.002  41.242   3.452
   98    HG3  LYS  13           1HG      LYS  13   8.322  42.369   3.767
   99    HD2  LYS  13           2HD      LYS  13   6.329  43.642   3.819
  100    HD3  LYS  13           1HD      LYS  13   7.116  44.016   2.288
  101    HE2  LYS  13           2HE      LYS  13   4.935  41.956   2.557
  102    HE3  LYS  13           1HE      LYS  13   4.612  43.653   2.210
  103    HZ1  LYS  13           3HZ      LYS  13   6.031  41.678   0.515
  104    HZ2  LYS  13           1HZ      LYS  13   6.158  43.350   0.247
  105    HZ3  LYS  13           2HZ      LYS  13   4.650  42.589   0.150
  106    H    ALA  14           H        ALA  14  11.173  41.506   0.639
  107    HA   ALA  14           HA       ALA  14  10.561  40.394  -1.915
  108    HB1  ALA  14           1HB      ALA  14  11.710  42.542  -1.653
  109    HB2  ALA  14           2HB      ALA  14  12.637  41.424  -2.652
  110    HB3  ALA  14           3HB      ALA  14  13.109  41.708  -0.978
  111    H    VAL  15           H        VAL  15  13.113  39.704   0.476
  112    HA   VAL  15           HA       VAL  15  14.369  37.709  -1.096
  113    HB   VAL  15           HB       VAL  15  15.454  38.963   0.784
  114   HG11  VAL  15          1HG1      VAL  15  13.912  37.037   2.514
  115   HG12  VAL  15          2HG1      VAL  15  13.696  38.787   2.443
  116   HG13  VAL  15          3HG1      VAL  15  15.203  38.108   3.062
  117   HG21  VAL  15          3HG2      VAL  15  16.507  36.999  -0.206
  118   HG22  VAL  15          1HG2      VAL  15  15.636  35.955   0.917
  119   HG23  VAL  15          2HG2      VAL  15  16.842  37.090   1.523
  120    H    GLY  16           H        GLY  16  11.589  37.673   0.920
  121    HA2  GLY  16           2HA      GLY  16  11.590  34.808   1.301
  122    HA3  GLY  16           1HA      GLY  16  10.306  35.922   1.744
  123    H    GLY  17           H        GLY  17  10.932  36.792  -1.288
  124    HA2  GLY  17           2HA      GLY  17  10.030  36.340  -3.348
  125    HA3  GLY  17           1HA      GLY  17   9.791  34.682  -2.811
  126    H    LEU  18           H        LEU  18   7.898  34.125  -1.747
  127    HA   LEU  18           HA       LEU  18   5.639  35.854  -2.426
  128    HB2  LEU  18           2HB      LEU  18   4.270  33.851  -2.186
  129    HB3  LEU  18           1HB      LEU  18   5.585  33.590  -3.313
  130    HG   LEU  18           HG       LEU  18   5.874  32.707  -0.460
  131   HD11  LEU  18          1HD1      LEU  18   3.749  31.783  -1.198
  132   HD12  LEU  18          2HD1      LEU  18   4.973  30.519  -1.099
  133   HD13  LEU  18          3HD1      LEU  18   4.504  31.177  -2.667
  134   HD21  LEU  18          3HD2      LEU  18   7.332  31.029  -1.478
  135   HD22  LEU  18          1HD2      LEU  18   7.839  32.661  -1.920
  136   HD23  LEU  18          2HD2      LEU  18   6.956  31.667  -3.080
  137    H    GLY  19           H        GLY  19   7.441  36.151  -0.058
  138    HA2  GLY  19           2HA      GLY  19   6.715  37.230   1.956
  139    HA3  GLY  19           1HA      GLY  19   5.302  36.184   1.962
  140    H    LYS  20           H        LYS  20   7.918  34.373   1.126
  141    HA   LYS  20           HA       LYS  20   9.409  33.005   2.136
  142    HB2  LYS  20           2HB      LYS  20   9.983  34.964   3.584
  143    HB3  LYS  20           1HB      LYS  20   8.791  34.400   4.745
  144    HG2  LYS  20           2HG      LYS  20  10.044  32.348   5.074
  145    HG3  LYS  20           1HG      LYS  20  11.220  32.853   3.859
  146    HD2  LYS  20           2HD      LYS  20  12.134  33.310   6.025
  147    HD3  LYS  20           1HD      LYS  20  11.720  34.848   5.267
  148    HE2  LYS  20           2HE      LYS  20  11.049  34.870   7.586
  149    HE3  LYS  20           1HE      LYS  20   9.620  34.886   6.556
  150    HZ1  LYS  20           3HZ      LYS  20  10.723  32.406   7.755
  151    HZ2  LYS  20           1HZ      LYS  20   9.207  32.616   7.016
  152    HZ3  LYS  20           2HZ      LYS  20   9.536  33.346   8.512
  153    H    LEU  21           H        LEU  21   6.162  33.228   2.992
  154    HA   LEU  21           HA       LEU  21   5.853  31.196   4.882
  155    HB2  LEU  21           2HB      LEU  21   4.083  32.481   2.875
  156    HB3  LEU  21           1HB      LEU  21   3.538  30.971   3.579
  157    HG   LEU  21           HG       LEU  21   3.680  31.953   5.825
  158   HD11  LEU  21          1HD1      LEU  21   4.062  34.350   6.105
  159   HD12  LEU  21          2HD1      LEU  21   4.447  34.487   4.389
  160   HD13  LEU  21          3HD1      LEU  21   5.485  33.538   5.451
  161   HD21  LEU  21          3HD2      LEU  21   1.804  33.481   5.631
  162   HD22  LEU  21          1HD2      LEU  21   1.588  32.096   4.560
  163   HD23  LEU  21          2HD2      LEU  21   2.098  33.650   3.900
  164    H    GLY  22           H        GLY  22   6.539  30.982   1.496
  165    HA2  GLY  22           2HA      GLY  22   5.732  28.318   1.029
  166    HA3  GLY  22           1HA      GLY  22   6.998  29.170   0.154
  167    H    LYS  23           H        LYS  23   8.605  29.704   2.484
  168    HA   LYS  23           HA       LYS  23   9.832  27.081   2.775
  169    HB2  LYS  23           2HB      LYS  23  10.768  29.857   3.508
  170    HB3  LYS  23           1HB      LYS  23  11.683  28.397   3.867
  171    HG2  LYS  23           2HG      LYS  23  10.884  29.338   1.118
  172    HG3  LYS  23           1HG      LYS  23  12.487  29.494   1.843
  173    HD2  LYS  23           2HD      LYS  23  12.638  27.049   2.004
  174    HD3  LYS  23           1HD      LYS  23  11.046  26.905   1.259
  175    HE2  LYS  23           2HE      LYS  23  13.444  28.193  -0.031
  176    HE3  LYS  23           1HE      LYS  23  12.915  26.539  -0.328
  177    HZ1  LYS  23           3HZ      LYS  23  11.432  29.033  -0.971
  178    HZ2  LYS  23           1HZ      LYS  23  10.769  27.477  -1.105
  179    HZ3  LYS  23           2HZ      LYS  23  12.091  27.921  -2.060
  180    H    ASP  24           H        ASP  24   8.129  29.487   4.637
  181    HA   ASP  24           HA       ASP  24   8.593  28.587   7.232
  182    HB2  ASP  24           2HB      ASP  24   6.301  29.976   5.910
  183    HB3  ASP  24           1HB      ASP  24   6.079  29.339   7.534
  184    H    ALA  25           H        ALA  25   6.391  27.394   4.772
  185    HA   ALA  25           HA       ALA  25   4.831  25.665   6.258
  186    HB1  ALA  25           1HB      ALA  25   5.844  25.215   3.454
  187    HB2  ALA  25           2HB      ALA  25   4.439  26.185   3.894
  188    HB3  ALA  25           3HB      ALA  25   4.439  24.446   4.192
  189    H    VAL  26           H        VAL  26   8.001  25.025   4.795
  190    HA   VAL  26           HA       VAL  26   8.155  22.299   5.463
  191    HB   VAL  26           HB       VAL  26  10.433  24.269   5.150
  192   HG11  VAL  26          1HG1      VAL  26  11.776  22.306   4.573
  193   HG12  VAL  26          2HG1      VAL  26  10.398  21.263   4.924
  194   HG13  VAL  26          3HG1      VAL  26  11.143  22.205   6.215
  195   HG21  VAL  26          3HG2      VAL  26  10.536  23.501   2.830
  196   HG22  VAL  26          1HG2      VAL  26   8.991  24.269   3.191
  197   HG23  VAL  26          2HG2      VAL  26   9.101  22.511   3.092
  198    H    GLU  27           H        GLU  27   9.417  25.175   7.114
  199    HA   GLU  27           HA       GLU  27  10.619  23.795   9.259
  200    HB2  GLU  27           2HB      GLU  27   9.648  26.651   9.065
  201    HB3  GLU  27           1HB      GLU  27  10.662  26.027  10.357
  202    HG2  GLU  27           2HG      GLU  27  12.418  25.524   8.738
  203    HG3  GLU  27           1HG      GLU  27  11.400  26.144   7.440
  204    H    ASP  28           H        ASP  28   7.521  25.535   9.036
  205    HA   ASP  28           HA       ASP  28   6.851  25.222  11.757
  206    HB2  ASP  28           2HB      ASP  28   5.912  26.988  10.338
  207    HB3  ASP  28           1HB      ASP  28   5.048  25.780   9.393
  208    H    LEU  29           H        LEU  29   6.188  23.234   8.936
  209    HA   LEU  29           HA       LEU  29   4.089  21.717  10.064
  210    HB2  LEU  29           2HB      LEU  29   4.547  21.829   7.645
  211    HB3  LEU  29           1HB      LEU  29   6.024  20.920   7.890
  212    HG   LEU  29           HG       LEU  29   4.691  18.987   8.668
  213   HD11  LEU  29          1HD1      LEU  29   2.764  20.216   9.529
  214   HD12  LEU  29          2HD1      LEU  29   2.271  18.994   8.357
  215   HD13  LEU  29          3HD1      LEU  29   2.329  20.693   7.887
  216   HD21  LEU  29          3HD2      LEU  29   3.900  20.081   5.972
  217   HD22  LEU  29          1HD2      LEU  29   3.760  18.398   6.477
  218   HD23  LEU  29          2HD2      LEU  29   5.350  19.146   6.331
  219    H    GLU  30           H        GLU  30   7.601  21.139   9.927
  220    HA   GLU  30           HA       GLU  30   7.226  18.657  11.406
  221    HB2  GLU  30           2HB      GLU  30   9.688  19.939  10.233
  222    HB3  GLU  30           1HB      GLU  30   9.704  18.426  11.130
  223    HG2  GLU  30           2HG      GLU  30   8.045  17.549   9.456
  224    HG3  GLU  30           1HG      GLU  30   8.354  19.005   8.511
  225    H    SER  31           H        SER  31   8.018  21.930  12.051
  226    HA   SER  31           HA       SER  31   9.499  21.516  14.437
  227    HB2  SER  31           2HB      SER  31   9.455  23.656  13.113
  228    HB3  SER  31           1HB      SER  31   7.830  23.940  13.733
  229    HG   SER  31           HG       SER  31   9.876  23.377  15.568
  230    H    VAL  32           H        VAL  32   6.117  21.441  13.679
  231    HA   VAL  32           HA       VAL  32   5.383  21.542  16.501
  232    HB   VAL  32           HB       VAL  32   3.054  21.437  15.743
  233   HG11  VAL  32          1HG1      VAL  32   4.704  23.482  14.262
  234   HG12  VAL  32          2HG1      VAL  32   4.154  23.604  15.934
  235   HG13  VAL  32          3HG1      VAL  32   2.982  23.608  14.616
  236   HG21  VAL  32          3HG2      VAL  32   4.220  21.328  12.962
  237   HG22  VAL  32          1HG2      VAL  32   2.516  21.538  13.352
  238   HG23  VAL  32          2HG2      VAL  32   3.336  20.034  13.770
  239    H    GLY  33           H        GLY  33   6.697  19.284  14.677
  240    HA2  GLY  33           2HA      GLY  33   6.920  17.017  14.943
  241    HA3  GLY  33           1HA      GLY  33   5.931  17.165  16.387
  242    H    LYS  34           H        LYS  34   5.236  17.701  12.925
  243    HA   LYS  34           HA       LYS  34   2.985  15.831  13.246
  244    HB2  LYS  34           2HB      LYS  34   2.442  18.260  12.797
  245    HB3  LYS  34           1HB      LYS  34   3.189  18.062  11.218
  246    HG2  LYS  34           2HG      LYS  34   1.549  16.462  10.563
  247    HG3  LYS  34           1HG      LYS  34   0.875  16.406  12.191
  248    HD2  LYS  34           2HD      LYS  34   0.174  18.736  11.990
  249    HD3  LYS  34           1HD      LYS  34   0.878  18.817  10.373
  250    HE2  LYS  34           2HE      LYS  34  -1.576  18.475  10.361
  251    HE3  LYS  34           1HE      LYS  34  -0.680  17.190   9.552
  252    HZ1  LYS  34           3HZ      LYS  34  -0.922  15.814  11.526
  253    HZ2  LYS  34           1HZ      LYS  34  -2.441  16.308  10.962
  254    HZ3  LYS  34           2HZ      LYS  34  -1.759  17.054  12.322
  255    H    GLY  35           H        GLY  35   5.871  15.408  12.431
  256    HA2  GLY  35           2HA      GLY  35   5.361  14.253   9.760
  257    HA3  GLY  35           1HA      GLY  35   6.949  14.702  10.366
  258    H    ALA  36           H        ALA  36   7.207  13.560  12.733
  259    HA   ALA  36           HA       ALA  36   7.513  10.792  12.015
  260    HB1  ALA  36           1HB      ALA  36   9.237  12.014  13.263
  261    HB2  ALA  36           2HB      ALA  36   8.687  10.582  14.134
  262    HB3  ALA  36           3HB      ALA  36   8.123  12.182  14.619
  263    H    VAL  37           H        VAL  37   4.911  12.422  13.127
  264    HA   VAL  37           HA       VAL  37   3.950  10.784  15.220
  265    HB   VAL  37           HB       VAL  37   3.087  13.046  14.787
  266   HG11  VAL  37          1HG1      VAL  37   1.481  13.442  12.978
  267   HG12  VAL  37          2HG1      VAL  37   1.807  11.828  12.343
  268   HG13  VAL  37          3HG1      VAL  37   3.088  13.042  12.365
  269   HG21  VAL  37          3HG2      VAL  37   1.725  11.524  16.101
  270   HG22  VAL  37          1HG2      VAL  37   0.971  10.898  14.634
  271   HG23  VAL  37          2HG2      VAL  37   0.699  12.571  15.122
  272    H    HIS  38           H        HIS  38   4.047  10.390  11.791
  273    HA   HIS  38           HA       HIS  38   1.980   8.406  11.653
  274    HB2  HIS  38           2HB      HIS  38   2.395   9.623   9.644
  275    HB3  HIS  38           1HB      HIS  38   4.120   9.290   9.716
  276    HD1  HIS  38           1HD      HIS  38   0.868   7.350   9.236
  277    HD2  HIS  38           2HD      HIS  38   4.892   7.195   8.200
  278    HE1  HIS  38           1HE      HIS  38   1.088   5.410   7.655
  279    HE2  HIS  38           2HE      HIS  38   3.552   5.248   7.150
  280    H    ASP  39           H        ASP  39   5.490   8.379  11.957
  281    HA   ASP  39           HA       ASP  39   5.739   5.603  11.381
  282    HB2  ASP  39           2HB      ASP  39   7.626   7.700  12.374
  283    HB3  ASP  39           1HB      ASP  39   8.093   6.000  12.429
  284    H    VAL  40           H        VAL  40   5.310   7.402  14.361
  285    HA   VAL  40           HA       VAL  40   6.185   5.413  16.134
  286    HB   VAL  40           HB       VAL  40   5.760   7.674  16.929
  287   HG11  VAL  40          1HG1      VAL  40   2.841   7.086  16.453
  288   HG12  VAL  40          2HG1      VAL  40   3.831   8.256  15.579
  289   HG13  VAL  40          3HG1      VAL  40   3.477   8.502  17.290
  290   HG21  VAL  40          3HG2      VAL  40   4.006   5.619  18.264
  291   HG22  VAL  40          1HG2      VAL  40   4.536   7.133  19.000
  292   HG23  VAL  40          2HG2      VAL  40   5.719   5.898  18.567
  293    H    LYS  41           H        LYS  41   2.991   5.972  14.696
  294    HA   LYS  41           HA       LYS  41   1.730   3.774  15.983
  295    HB2  LYS  41           2HB      LYS  41   0.428   5.634  15.092
  296    HB3  LYS  41           1HB      LYS  41   1.008   5.291  13.470
  297    HG2  LYS  41           2HG      LYS  41  -1.271   4.517  13.771
  298    HG3  LYS  41           1HG      LYS  41  -0.180   3.163  13.476
  299    HD2  LYS  41           2HD      LYS  41  -0.204   2.546  15.777
  300    HD3  LYS  41           1HD      LYS  41  -1.040   4.034  16.229
  301    HE2  LYS  41           2HE      LYS  41  -2.583   2.154  16.219
  302    HE3  LYS  41           1HE      LYS  41  -3.005   3.308  14.959
  303    HZ1  LYS  41           3HZ      LYS  41  -1.786   1.840  13.378
  304    HZ2  LYS  41           1HZ      LYS  41  -3.174   1.138  14.052
  305    HZ3  LYS  41           2HZ      LYS  41  -1.637   0.693  14.620
  306    H    ASP  42           H        ASP  42   3.276   4.244  12.857
  307    HA   ASP  42           HA       ASP  42   2.628   1.780  11.692
  308    HB2  ASP  42           2HB      ASP  42   3.449   3.546  10.314
  309    HB3  ASP  42           1HB      ASP  42   4.929   3.681  11.252
  310    H    VAL  43           H        VAL  43   5.485   2.743  13.580
  311    HA   VAL  43           HA       VAL  43   6.819   0.266  13.326
  312    HB   VAL  43           HB       VAL  43   7.149   2.441  15.392
  313   HG11  VAL  43          1HG1      VAL  43   9.284   1.380  15.957
  314   HG12  VAL  43          2HG1      VAL  43   8.907   0.044  14.869
  315   HG13  VAL  43          3HG1      VAL  43   7.922   0.314  16.307
  316   HG21  VAL  43          3HG2      VAL  43   8.754   1.709  12.943
  317   HG22  VAL  43          1HG2      VAL  43   9.153   2.988  14.091
  318   HG23  VAL  43          2HG2      VAL  43   7.690   3.107  13.112
  319    H    LEU  44           H        LEU  44   4.802   1.571  15.997
  320    HA   LEU  44           HA       LEU  44   5.229  -0.660  17.676
  321    HB2  LEU  44           2HB      LEU  44   3.429   0.190  19.061
  322    HB3  LEU  44           1HB      LEU  44   4.503   1.479  18.573
  323    HG   LEU  44           HG       LEU  44   2.717   1.960  16.742
  324   HD11  LEU  44          1HD1      LEU  44   1.056   0.437  18.748
  325   HD12  LEU  44          2HD1      LEU  44   1.381  -0.054  17.085
  326   HD13  LEU  44          3HD1      LEU  44   0.436   1.401  17.406
  327   HD21  LEU  44          3HD2      LEU  44   3.259   3.453  18.584
  328   HD22  LEU  44          1HD2      LEU  44   2.204   2.533  19.658
  329   HD23  LEU  44          2HD2      LEU  44   1.518   3.422  18.298
  330    H    ASP  45           H        ASP  45   3.068  -0.149  15.038
  331    HA   ASP  45           HA       ASP  45   1.307  -2.315  15.796
  332    HB2  ASP  45           2HB      ASP  45   1.038  -0.090  14.154
  333    HB3  ASP  45           1HB      ASP  45   1.109  -1.438  13.024
  334    H    SER  46           H        SER  46   4.228  -1.925  14.062
  335    HA   SER  46           HA       SER  46   3.848  -4.318  12.459
  336    HB2  SER  46           2HB      SER  46   6.228  -2.465  12.710
  337    HB3  SER  46           1HB      SER  46   6.080  -3.783  11.550
  338    HG   SER  46           HG       SER  46   4.423  -1.471  11.728
  339    H    VAL  47           H        VAL  47   4.889  -3.601  15.568
  340    HA   VAL  47           HA       VAL  47   6.518  -6.047  15.650
  341    HB   VAL  47           HB       VAL  47   7.881  -4.125  16.207
  342   HG11  VAL  47          1HG1      VAL  47   7.429  -2.730  18.170
  343   HG12  VAL  47          2HG1      VAL  47   5.887  -3.557  18.394
  344   HG13  VAL  47          3HG1      VAL  47   6.164  -2.584  16.950
  345   HG21  VAL  47          3HG2      VAL  47   8.710  -4.830  18.394
  346   HG22  VAL  47          1HG2      VAL  47   8.336  -6.214  17.366
  347   HG23  VAL  47          2HG2      VAL  47   7.230  -5.751  18.658
  348    H    LEU  48           H        LEU  48   5.739  -7.684  16.744
  349    HA   LEU  48           HA       LEU  48   3.313  -7.381  18.263
  350    HB2  LEU  48           2HB      LEU  48   3.325  -9.832  18.430
  351    HB3  LEU  48           1HB      LEU  48   3.448  -9.273  16.777
  352    HG   LEU  48           HG       LEU  48   5.849 -10.188  18.357
  353   HD11  LEU  48          1HD1      LEU  48   4.247 -12.018  18.261
  354   HD12  LEU  48          2HD1      LEU  48   5.622 -12.332  17.202
  355   HD13  LEU  48          3HD1      LEU  48   4.085 -11.799  16.519
  356   HD21  LEU  48          3HD2      LEU  48   5.350  -9.925  15.395
  357   HD22  LEU  48          1HD2      LEU  48   6.837 -10.501  16.147
  358   HD23  LEU  48          2HD2      LEU  48   6.321  -8.831  16.377
  Start of MODEL   18
    1    H1   SER   1           1HT      SER   1  -2.864   4.856  28.056
    2    H2   SER   1           2HT      SER   1  -2.925   6.222  29.069
    3    H3   SER   1           3HT      SER   1  -3.249   4.681  29.697
    4    HA   SER   1           HA       SER   1  -1.036   5.501  30.282
    5    HB2  SER   1           2HB      SER   1  -1.141   3.080  28.470
    6    HB3  SER   1           1HB      SER   1   0.137   3.424  29.637
    7    HG   SER   1           HG       SER   1  -1.075   2.638  31.145
    8    H    SER   2           H        SER   2   1.109   5.916  29.594
    9    HA   SER   2           HA       SER   2   2.770   6.709  28.277
   10    HB2  SER   2           2HB      SER   2   1.169   5.610  25.959
   11    HB3  SER   2           1HB      SER   2   2.871   6.071  25.927
   12    HG   SER   2           HG       SER   2   2.755   4.424  27.898
   13    H    LEU   3           H        LEU   3  -0.037   8.129  28.576
   14    HA   LEU   3           HA       LEU   3  -0.006   9.984  26.371
   15    HB2  LEU   3           2HB      LEU   3  -2.029   9.264  27.811
   16    HB3  LEU   3           1HB      LEU   3  -1.421  10.395  29.001
   17    HG   LEU   3           HG       LEU   3  -3.264  11.280  27.564
   18   HD11  LEU   3          1HD1      LEU   3  -0.635  12.737  27.371
   19   HD12  LEU   3          2HD1      LEU   3  -1.776  12.812  28.714
   20   HD13  LEU   3          3HD1      LEU   3  -2.231  13.452  27.136
   21   HD21  LEU   3          3HD2      LEU   3  -2.651  10.209  25.473
   22   HD22  LEU   3          1HD2      LEU   3  -1.166  11.156  25.406
   23   HD23  LEU   3          2HD2      LEU   3  -2.730  11.958  25.276
   24    H    LEU   4           H        LEU   4   0.408  10.433  29.883
   25    HA   LEU   4           HA       LEU   4   2.078  12.763  29.392
   26    HB2  LEU   4           2HB      LEU   4   1.221  11.448  31.975
   27    HB3  LEU   4           1HB      LEU   4   2.123  12.948  31.861
   28    HG   LEU   4           HG       LEU   4  -0.685  12.516  30.835
   29   HD11  LEU   4          1HD1      LEU   4  -0.570  12.527  33.268
   30   HD12  LEU   4          2HD1      LEU   4  -1.333  13.998  32.663
   31   HD13  LEU   4          3HD1      LEU   4   0.338  14.040  33.225
   32   HD21  LEU   4          3HD2      LEU   4   0.571  14.149  29.510
   33   HD22  LEU   4          1HD2      LEU   4   0.989  15.022  30.985
   34   HD23  LEU   4          2HD2      LEU   4  -0.694  14.926  30.463
   35    H    GLU   5           H        GLU   5   2.346   9.434  30.034
   36    HA   GLU   5           HA       GLU   5   4.926   9.419  31.238
   37    HB2  GLU   5           2HB      GLU   5   3.450   7.200  29.819
   38    HB3  GLU   5           1HB      GLU   5   4.814   7.004  30.913
   39    HG2  GLU   5           2HG      GLU   5   3.543   7.689  32.777
   40    HG3  GLU   5           1HG      GLU   5   2.229   8.274  31.756
   41    H    LYS   6           H        LYS   6   3.860   9.817  28.035
   42    HA   LYS   6           HA       LYS   6   6.603   9.396  27.074
   43    HB2  LYS   6           2HB      LYS   6   5.013   7.505  26.425
   44    HB3  LYS   6           1HB      LYS   6   4.180   8.683  25.421
   45    HG2  LYS   6           2HG      LYS   6   5.649   7.510  24.001
   46    HG3  LYS   6           1HG      LYS   6   6.380   9.095  24.271
   47    HD2  LYS   6           2HD      LYS   6   7.796   8.093  26.034
   48    HD3  LYS   6           1HD      LYS   6   7.116   6.512  25.644
   49    HE2  LYS   6           2HE      LYS   6   7.948   6.812  23.313
   50    HE3  LYS   6           1HE      LYS   6   8.754   8.290  23.845
   51    HZ1  LYS   6           3HZ      LYS   6   9.300   5.508  24.712
   52    HZ2  LYS   6           1HZ      LYS   6   9.900   6.862  25.545
   53    HZ3  LYS   6           2HZ      LYS   6  10.355   6.584  23.937
   54    H    GLY   7           H        GLY   7   3.415  10.742  26.219
   55    HA2  GLY   7           2HA      GLY   7   4.456  12.511  24.249
   56    HA3  GLY   7           1HA      GLY   7   2.831  12.536  24.914
   57    H    LEU   8           H        LEU   8   4.461  12.738  27.631
   58    HA   LEU   8           HA       LEU   8   4.628  15.662  27.509
   59    HB2  LEU   8           2HB      LEU   8   3.111  14.733  29.189
   60    HB3  LEU   8           1HB      LEU   8   4.434  13.832  29.900
   61    HG   LEU   8           HG       LEU   8   5.544  15.985  30.468
   62   HD11  LEU   8          1HD1      LEU   8   2.943  17.194  29.538
   63   HD12  LEU   8          2HD1      LEU   8   4.509  17.379  28.751
   64   HD13  LEU   8          3HD1      LEU   8   4.249  18.049  30.361
   65   HD21  LEU   8          3HD2      LEU   8   2.749  15.644  31.543
   66   HD22  LEU   8          1HD2      LEU   8   4.054  16.540  32.318
   67   HD23  LEU   8          2HD2      LEU   8   4.189  14.793  32.108
   68    H    ASP   9           H        ASP   9   6.309  13.004  29.195
   69    HA   ASP   9           HA       ASP   9   8.600  14.453  29.853
   70    HB2  ASP   9           2HB      ASP   9   8.322  11.481  29.357
   71    HB3  ASP   9           1HB      ASP   9   9.703  12.246  30.134
   72    H    GLY  10           H        GLY  10   7.964  12.403  27.023
   73    HA2  GLY  10           2HA      GLY  10  10.618  12.627  25.992
   74    HA3  GLY  10           1HA      GLY  10   9.223  11.982  25.144
   75    H    ALA  11           H        ALA  11   7.766  14.568  25.692
   76    HA   ALA  11           HA       ALA  11   8.312  15.731  23.176
   77    HB1  ALA  11           1HB      ALA  11   6.714  16.878  25.456
   78    HB2  ALA  11           2HB      ALA  11   6.096  15.780  24.221
   79    HB3  ALA  11           3HB      ALA  11   6.650  17.392  23.768
   80    H    LYS  12           H        LYS  12   9.139  16.685  26.480
   81    HA   LYS  12           HA       LYS  12  10.317  19.169  25.625
   82    HB2  LYS  12           2HB      LYS  12  10.193  17.751  28.279
   83    HB3  LYS  12           1HB      LYS  12  11.152  19.207  28.055
   84    HG2  LYS  12           2HG      LYS  12   9.061  19.853  28.984
   85    HG3  LYS  12           1HG      LYS  12   9.073  20.371  27.298
   86    HD2  LYS  12           2HD      LYS  12   7.799  18.312  26.724
   87    HD3  LYS  12           1HD      LYS  12   7.687  17.951  28.446
   88    HE2  LYS  12           2HE      LYS  12   5.655  19.013  27.698
   89    HE3  LYS  12           1HE      LYS  12   6.522  20.088  28.793
   90    HZ1  LYS  12           3HZ      LYS  12   6.840  20.307  25.858
   91    HZ2  LYS  12           1HZ      LYS  12   7.162  21.471  27.050
   92    HZ3  LYS  12           2HZ      LYS  12   5.560  21.069  26.664
   93    H    LYS  13           H        LYS  13  11.310  16.032  25.441
   94    HA   LYS  13           HA       LYS  13  14.153  16.705  25.622
   95    HB2  LYS  13           2HB      LYS  13  13.228  14.553  26.605
   96    HB3  LYS  13           1HB      LYS  13  12.915  14.023  24.961
   97    HG2  LYS  13           2HG      LYS  13  15.666  14.842  25.825
   98    HG3  LYS  13           1HG      LYS  13  15.054  13.218  26.133
   99    HD2  LYS  13           2HD      LYS  13  14.704  12.875  23.753
  100    HD3  LYS  13           1HD      LYS  13  15.221  14.528  23.418
  101    HE2  LYS  13           2HE      LYS  13  17.022  12.985  22.951
  102    HE3  LYS  13           1HE      LYS  13  17.438  14.003  24.328
  103    HZ1  LYS  13           3HZ      LYS  13  17.997  11.620  24.612
  104    HZ2  LYS  13           1HZ      LYS  13  16.342  11.253  24.569
  105    HZ3  LYS  13           2HZ      LYS  13  16.968  12.218  25.820
  106    H    ALA  14           H        ALA  14  11.617  15.813  23.368
  107    HA   ALA  14           HA       ALA  14  13.215  15.464  21.068
  108    HB1  ALA  14           1HB      ALA  14  11.135  15.684  19.822
  109    HB2  ALA  14           2HB      ALA  14  10.335  16.326  21.254
  110    HB3  ALA  14           3HB      ALA  14  10.912  14.661  21.240
  111    H    VAL  15           H        VAL  15  11.910  18.307  22.620
  112    HA   VAL  15           HA       VAL  15  12.373  20.094  20.437
  113    HB   VAL  15           HB       VAL  15  10.766  20.506  22.320
  114   HG11  VAL  15          1HG1      VAL  15  11.616  21.498  24.389
  115   HG12  VAL  15          2HG1      VAL  15  13.268  21.162  23.866
  116   HG13  VAL  15          3HG1      VAL  15  12.154  19.830  24.183
  117   HG21  VAL  15          3HG2      VAL  15  12.799  22.663  21.765
  118   HG22  VAL  15          1HG2      VAL  15  11.194  22.924  22.451
  119   HG23  VAL  15          2HG2      VAL  15  11.360  22.296  20.811
  120    H    GLY  16           H        GLY  16  14.467  18.427  22.371
  121    HA2  GLY  16           2HA      GLY  16  16.799  18.493  22.138
  122    HA3  GLY  16           1HA      GLY  16  16.677  20.150  21.566
  123    H    GLY  17           H        GLY  17  15.428  21.485  23.476
  124    HA2  GLY  17           2HA      GLY  17  15.615  22.423  25.562
  125    HA3  GLY  17           1HA      GLY  17  16.259  20.887  26.126
  126    H    LEU  18           H        LEU  18  18.387  20.652  26.409
  127    HA   LEU  18           HA       LEU  18  20.043  23.024  25.979
  128    HB2  LEU  18           2HB      LEU  18  20.283  20.642  27.790
  129    HB3  LEU  18           1HB      LEU  18  21.644  21.703  27.497
  130    HG   LEU  18           HG       LEU  18  20.193  23.605  28.346
  131   HD11  LEU  18          1HD1      LEU  18  18.023  22.515  28.105
  132   HD12  LEU  18          2HD1      LEU  18  18.307  23.021  29.771
  133   HD13  LEU  18          3HD1      LEU  18  18.481  21.325  29.321
  134   HD21  LEU  18          3HD2      LEU  18  21.969  22.630  29.676
  135   HD22  LEU  18          1HD2      LEU  18  20.881  21.356  30.229
  136   HD23  LEU  18          2HD2      LEU  18  20.586  23.032  30.695
  137    H    GLY  19           H        GLY  19  19.399  20.028  24.622
  138    HA2  GLY  19           2HA      GLY  19  22.102  19.851  23.446
  139    HA3  GLY  19           1HA      GLY  19  20.979  18.504  23.580
  140    H    LYS  20           H        LYS  20  19.603  21.493  22.704
  141    HA   LYS  20           HA       LYS  20  18.873  20.418  20.137
  142    HB2  LYS  20           2HB      LYS  20  17.451  22.360  19.922
  143    HB3  LYS  20           1HB      LYS  20  17.252  21.657  21.518
  144    HG2  LYS  20           2HG      LYS  20  18.780  23.400  22.408
  145    HG3  LYS  20           1HG      LYS  20  18.791  24.137  20.805
  146    HD2  LYS  20           2HD      LYS  20  16.292  23.652  22.427
  147    HD3  LYS  20           1HD      LYS  20  17.182  25.172  22.422
  148    HE2  LYS  20           2HE      LYS  20  15.385  25.440  20.903
  149    HE3  LYS  20           1HE      LYS  20  16.836  25.240  19.925
  150    HZ1  LYS  20           3HZ      LYS  20  16.218  23.069  19.333
  151    HZ2  LYS  20           1HZ      LYS  20  14.787  23.969  19.208
  152    HZ3  LYS  20           2HZ      LYS  20  15.041  22.964  20.551
  153    H    LEU  21           H        LEU  21  19.168  21.538  18.139
  154    HA   LEU  21           HA       LEU  21  20.404  22.532  16.520
  155    HB2  LEU  21           2HB      LEU  21  21.734  24.059  18.762
  156    HB3  LEU  21           1HB      LEU  21  21.948  24.382  17.053
  157    HG   LEU  21           HG       LEU  21  19.354  24.650  18.573
  158   HD11  LEU  21          1HD1      LEU  21  20.969  26.361  19.191
  159   HD12  LEU  21          2HD1      LEU  21  19.669  27.051  18.222
  160   HD13  LEU  21          3HD1      LEU  21  21.241  26.737  17.491
  161   HD21  LEU  21          3HD2      LEU  21  18.514  25.689  16.523
  162   HD22  LEU  21          1HD2      LEU  21  18.996  24.016  16.245
  163   HD23  LEU  21          2HD2      LEU  21  20.041  25.333  15.714
  164    H    GLY  22           H        GLY  22  21.683  20.700  19.007
  165    HA2  GLY  22           2HA      GLY  22  24.360  20.484  17.920
  166    HA3  GLY  22           1HA      GLY  22  23.708  19.585  19.284
  167    H    LYS  23           H        LYS  23  21.685  18.184  18.432
  168    HA   LYS  23           HA       LYS  23  22.866  16.437  16.435
  169    HB2  LYS  23           2HB      LYS  23  20.641  16.103  18.412
  170    HB3  LYS  23           1HB      LYS  23  20.804  14.989  17.059
  171    HG2  LYS  23           2HG      LYS  23  23.146  14.560  17.777
  172    HG3  LYS  23           1HG      LYS  23  22.833  15.540  19.212
  173    HD2  LYS  23           2HD      LYS  23  21.278  13.997  20.056
  174    HD3  LYS  23           1HD      LYS  23  21.104  13.189  18.496
  175    HE2  LYS  23           2HE      LYS  23  23.605  13.194  20.186
  176    HE3  LYS  23           1HE      LYS  23  22.440  11.872  20.103
  177    HZ1  LYS  23           3HZ      LYS  23  24.348  11.492  18.651
  178    HZ2  LYS  23           1HZ      LYS  23  24.019  12.925  17.812
  179    HZ3  LYS  23           2HZ      LYS  23  22.923  11.634  17.749
  180    H    ASP  24           H        ASP  24  20.195  18.636  16.769
  181    HA   ASP  24           HA       ASP  24  19.132  19.818  15.149
  182    HB2  ASP  24           2HB      ASP  24  21.228  19.706  13.882
  183    HB3  ASP  24           1HB      ASP  24  20.744  18.156  13.205
  184    H    ALA  25           H        ALA  25  19.411  16.465  13.952
  185    HA   ALA  25           HA       ALA  25  17.096  16.508  12.406
  186    HB1  ALA  25           1HB      ALA  25  18.348  14.094  13.702
  187    HB2  ALA  25           2HB      ALA  25  18.891  14.846  12.201
  188    HB3  ALA  25           3HB      ALA  25  17.292  14.108  12.288
  189    H    VAL  26           H        VAL  26  17.451  15.743  15.819
  190    HA   VAL  26           HA       VAL  26  14.962  14.490  16.207
  191    HB   VAL  26           HB       VAL  26  16.780  14.369  17.850
  192   HG11  VAL  26          1HG1      VAL  26  16.138  17.256  18.418
  193   HG12  VAL  26          2HG1      VAL  26  17.633  16.620  17.737
  194   HG13  VAL  26          3HG1      VAL  26  17.190  16.235  19.399
  195   HG21  VAL  26          3HG2      VAL  26  15.431  14.642  19.881
  196   HG22  VAL  26          1HG2      VAL  26  14.545  13.837  18.586
  197   HG23  VAL  26          2HG2      VAL  26  14.228  15.535  18.949
  198    H    GLU  27           H        GLU  27  15.825  17.810  15.849
  199    HA   GLU  27           HA       GLU  27  13.329  18.786  16.988
  200    HB2  GLU  27           2HB      GLU  27  15.613  20.278  15.689
  201    HB3  GLU  27           1HB      GLU  27  14.277  21.000  16.573
  202    HG2  GLU  27           2HG      GLU  27  15.059  20.259  18.622
  203    HG3  GLU  27           1HG      GLU  27  16.063  19.004  17.893
  204    H    ASP  28           H        ASP  28  14.276  17.535  14.087
  205    HA   ASP  28           HA       ASP  28  12.985  19.504  12.386
  206    HB2  ASP  28           2HB      ASP  28  15.105  18.340  11.726
  207    HB3  ASP  28           1HB      ASP  28  14.185  16.844  11.597
  208    H    LEU  29           H        LEU  29  12.583  16.013  13.048
  209    HA   LEU  29           HA       LEU  29  10.301  15.780  11.405
  210    HB2  LEU  29           2HB      LEU  29  10.058  13.565  12.195
  211    HB3  LEU  29           1HB      LEU  29  11.774  13.881  12.066
  212    HG   LEU  29           HG       LEU  29  10.302  14.056  14.692
  213   HD11  LEU  29          1HD1      LEU  29   9.998  11.813  13.781
  214   HD12  LEU  29          2HD1      LEU  29  11.106  11.794  15.153
  215   HD13  LEU  29          3HD1      LEU  29  11.736  11.681  13.510
  216   HD21  LEU  29          3HD2      LEU  29  13.214  13.676  14.003
  217   HD22  LEU  29          1HD2      LEU  29  12.537  13.735  15.630
  218   HD23  LEU  29          2HD2      LEU  29  12.477  15.164  14.597
  219    H    GLU  30           H        GLU  30  10.659  16.777  14.715
  220    HA   GLU  30           HA       GLU  30   7.908  16.334  15.391
  221    HB2  GLU  30           2HB      GLU  30   8.396  17.561  17.450
  222    HB3  GLU  30           1HB      GLU  30   9.601  16.324  17.140
  223    HG2  GLU  30           2HG      GLU  30  10.988  17.996  17.741
  224    HG3  GLU  30           1HG      GLU  30  10.861  18.385  16.028
  225    H    SER  31           H        SER  31   9.724  18.889  13.904
  226    HA   SER  31           HA       SER  31   7.596  20.820  14.074
  227    HB2  SER  31           2HB      SER  31  10.036  20.739  12.281
  228    HB3  SER  31           1HB      SER  31   8.971  22.129  12.498
  229    HG   SER  31           HG       SER  31   9.973  21.055  14.847
  230    H    VAL  32           H        VAL  32   8.725  18.394  11.807
  231    HA   VAL  32           HA       VAL  32   7.030  19.075   9.643
  232    HB   VAL  32           HB       VAL  32   8.224  16.386  10.358
  233   HG11  VAL  32          1HG1      VAL  32   7.094  17.366   7.738
  234   HG12  VAL  32          2HG1      VAL  32   6.363  16.159   8.796
  235   HG13  VAL  32          3HG1      VAL  32   7.900  15.818   8.002
  236   HG21  VAL  32          3HG2      VAL  32   9.221  18.553   8.513
  237   HG22  VAL  32          1HG2      VAL  32   9.959  16.967   8.731
  238   HG23  VAL  32          2HG2      VAL  32   9.916  18.112  10.074
  239    H    GLY  33           H        GLY  33   6.662  16.917  12.419
  240    HA2  GLY  33           2HA      GLY  33   4.651  16.492  13.531
  241    HA3  GLY  33           1HA      GLY  33   3.775  17.172  12.168
  242    H    LYS  34           H        LYS  34   4.203  15.779  10.067
  243    HA   LYS  34           HA       LYS  34   2.811  13.383  10.492
  244    HB2  LYS  34           2HB      LYS  34   2.802  14.673   8.370
  245    HB3  LYS  34           1HB      LYS  34   4.452  14.146   8.072
  246    HG2  LYS  34           2HG      LYS  34   3.693  11.816   8.003
  247    HG3  LYS  34           1HG      LYS  34   2.038  12.354   8.290
  248    HD2  LYS  34           2HD      LYS  34   3.738  13.119   5.917
  249    HD3  LYS  34           1HD      LYS  34   2.476  11.887   5.913
  250    HE2  LYS  34           2HE      LYS  34   2.110  14.832   6.445
  251    HE3  LYS  34           1HE      LYS  34   1.639  13.968   4.984
  252    HZ1  LYS  34           3HZ      LYS  34   0.156  12.596   6.462
  253    HZ2  LYS  34           1HZ      LYS  34  -0.297  14.222   6.279
  254    HZ3  LYS  34           2HZ      LYS  34   0.471  13.716   7.697
  255    H    GLY  35           H        GLY  35   6.234  14.052  10.356
  256    HA2  GLY  35           2HA      GLY  35   7.242  11.478   9.933
  257    HA3  GLY  35           1HA      GLY  35   8.049  12.738  10.857
  258    H    ALA  36           H        ALA  36   6.236  13.064  12.935
  259    HA   ALA  36           HA       ALA  36   6.863  10.820  14.588
  260    HB1  ALA  36           1HB      ALA  36   5.652  12.038  16.339
  261    HB2  ALA  36           2HB      ALA  36   5.087  13.200  15.137
  262    HB3  ALA  36           3HB      ALA  36   6.807  13.081  15.508
  263    H    VAL  37           H        VAL  37   3.934  12.106  13.090
  264    HA   VAL  37           HA       VAL  37   2.055  10.385  14.218
  265    HB   VAL  37           HB       VAL  37   2.034  11.549  11.429
  266   HG11  VAL  37          1HG1      VAL  37   0.418   9.737  11.680
  267   HG12  VAL  37          2HG1      VAL  37  -0.387  11.298  11.528
  268   HG13  VAL  37          3HG1      VAL  37  -0.253  10.527  13.107
  269   HG21  VAL  37          3HG2      VAL  37   0.879  12.635  13.997
  270   HG22  VAL  37          1HG2      VAL  37   0.688  13.348  12.394
  271   HG23  VAL  37          2HG2      VAL  37   2.285  13.269  13.139
  272    H    HIS  38           H        HIS  38   4.066   9.960  11.321
  273    HA   HIS  38           HA       HIS  38   2.870   7.473  10.612
  274    HB2  HIS  38           2HB      HIS  38   3.911   8.694   8.853
  275    HB3  HIS  38           1HB      HIS  38   5.433   8.797   9.735
  276    HD1  HIS  38           1HD      HIS  38   7.137   7.081   9.168
  277    HD2  HIS  38           2HD      HIS  38   3.295   5.869   8.119
  278    HE1  HIS  38           1HE      HIS  38   7.411   4.861   8.025
  279    HE2  HIS  38           2HE      HIS  38   5.061   4.026   7.687
  280    H    ASP  39           H        ASP  39   6.185   8.153  11.810
  281    HA   ASP  39           HA       ASP  39   6.827   5.414  11.776
  282    HB2  ASP  39           2HB      ASP  39   8.197   7.844  12.842
  283    HB3  ASP  39           1HB      ASP  39   8.849   6.243  13.185
  284    H    VAL  40           H        VAL  40   5.684   7.466  14.403
  285    HA   VAL  40           HA       VAL  40   6.174   5.559  16.452
  286    HB   VAL  40           HB       VAL  40   4.138   7.796  16.367
  287   HG11  VAL  40          1HG1      VAL  40   3.503   6.082  17.999
  288   HG12  VAL  40          2HG1      VAL  40   4.025   7.564  18.800
  289   HG13  VAL  40          3HG1      VAL  40   5.109   6.174  18.725
  290   HG21  VAL  40          3HG2      VAL  40   6.881   7.635  17.617
  291   HG22  VAL  40          1HG2      VAL  40   5.766   8.993  17.767
  292   HG23  VAL  40          2HG2      VAL  40   6.439   8.575  16.191
  293    H    LYS  41           H        LYS  41   3.428   6.205  14.327
  294    HA   LYS  41           HA       LYS  41   2.009   3.896  15.431
  295    HB2  LYS  41           2HB      LYS  41   0.867   6.135  14.972
  296    HB3  LYS  41           1HB      LYS  41   1.054   5.771  13.262
  297    HG2  LYS  41           2HG      LYS  41  -1.179   5.219  14.079
  298    HG3  LYS  41           1HG      LYS  41  -0.318   3.787  13.509
  299    HD2  LYS  41           2HD      LYS  41   0.271   3.244  15.836
  300    HD3  LYS  41           1HD      LYS  41  -0.650   4.645  16.384
  301    HE2  LYS  41           2HE      LYS  41  -2.686   3.700  15.494
  302    HE3  LYS  41           1HE      LYS  41  -1.795   2.345  14.805
  303    HZ1  LYS  41           3HZ      LYS  41  -2.804   1.621  16.806
  304    HZ2  LYS  41           1HZ      LYS  41  -2.209   2.947  17.682
  305    HZ3  LYS  41           2HZ      LYS  41  -1.142   1.751  17.118
  306    H    ASP  42           H        ASP  42   4.451   3.579  13.975
  307    HA   ASP  42           HA       ASP  42   3.488   1.979  11.693
  308    HB2  ASP  42           2HB      ASP  42   4.709   3.966  10.890
  309    HB3  ASP  42           1HB      ASP  42   6.090   3.529  11.888
  310    H    VAL  43           H        VAL  43   6.309   2.455  13.802
  311    HA   VAL  43           HA       VAL  43   7.350  -0.138  13.493
  312    HB   VAL  43           HB       VAL  43   7.751   1.740  15.827
  313   HG11  VAL  43          1HG1      VAL  43   9.472  -0.508  14.789
  314   HG12  VAL  43          2HG1      VAL  43   8.517  -0.535  16.271
  315   HG13  VAL  43          3HG1      VAL  43   9.878   0.577  16.118
  316   HG21  VAL  43          3HG2      VAL  43   8.244   2.857  13.724
  317   HG22  VAL  43          1HG2      VAL  43   9.282   1.518  13.238
  318   HG23  VAL  43          2HG2      VAL  43   9.730   2.527  14.613
  319    H    LEU  44           H        LEU  44   5.727   1.244  16.367
  320    HA   LEU  44           HA       LEU  44   5.316  -1.418  17.427
  321    HB2  LEU  44           2HB      LEU  44   4.216  -0.161  19.339
  322    HB3  LEU  44           1HB      LEU  44   5.930   0.098  19.094
  323    HG   LEU  44           HG       LEU  44   4.028   2.038  17.862
  324   HD11  LEU  44          1HD1      LEU  44   3.185   1.753  20.139
  325   HD12  LEU  44          2HD1      LEU  44   3.959   3.324  19.935
  326   HD13  LEU  44          3HD1      LEU  44   4.806   2.025  20.776
  327   HD21  LEU  44          3HD2      LEU  44   6.733   2.288  19.177
  328   HD22  LEU  44          1HD2      LEU  44   5.850   3.588  18.375
  329   HD23  LEU  44          2HD2      LEU  44   6.431   2.208  17.442
  330    H    ASP  45           H        ASP  45   3.870  -0.078  15.043
  331    HA   ASP  45           HA       ASP  45   1.137  -0.779  15.848
  332    HB2  ASP  45           2HB      ASP  45   1.492   1.352  14.615
  333    HB3  ASP  45           1HB      ASP  45   2.134   0.436  13.258
  334    H    SER  46           H        SER  46   3.901  -2.010  14.475
  335    HA   SER  46           HA       SER  46   4.479  -3.992  13.587
  336    HB2  SER  46           2HB      SER  46   1.655  -4.801  14.319
  337    HB3  SER  46           1HB      SER  46   2.951  -5.907  13.865
  338    HG   SER  46           HG       SER  46   2.560  -5.511  16.205
  339    H    VAL  47           H        VAL  47   3.208  -1.871  11.931
  340    HA   VAL  47           HA       VAL  47   2.031  -3.470   9.800
  341    HB   VAL  47           HB       VAL  47   0.863  -1.421  10.244
  342   HG11  VAL  47          1HG1      VAL  47   1.886   0.790   9.930
  343   HG12  VAL  47          2HG1      VAL  47   3.456   0.017   9.710
  344   HG13  VAL  47          3HG1      VAL  47   2.619  -0.109  11.256
  345   HG21  VAL  47          3HG2      VAL  47   0.906  -2.136   7.930
  346   HG22  VAL  47          1HG2      VAL  47   2.397  -1.233   7.654
  347   HG23  VAL  47          2HG2      VAL  47   0.901  -0.376   8.021
  348    H    LEU  48           H        LEU  48   3.786  -4.657   9.117
  349    HA   LEU  48           HA       LEU  48   6.083  -3.200   8.040
  350    HB2  LEU  48           2HB      LEU  48   5.607  -6.124   8.590
  351    HB3  LEU  48           1HB      LEU  48   6.971  -5.565   7.648
  352    HG   LEU  48           HG       LEU  48   7.772  -5.957   9.836
  353   HD11  LEU  48          1HD1      LEU  48   8.652  -3.944   8.833
  354   HD12  LEU  48          2HD1      LEU  48   8.503  -3.740  10.578
  355   HD13  LEU  48          3HD1      LEU  48   7.319  -3.000   9.502
  356   HD21  LEU  48          3HD2      LEU  48   5.647  -6.002  11.020
  357   HD22  LEU  48          1HD2      LEU  48   5.517  -4.249  10.873
  358   HD23  LEU  48          2HD2      LEU  48   6.810  -4.959  11.840
  Start of MODEL   19
    1    H1   SER   1           1HT      SER   1  -5.694   8.648  -2.612
    2    H2   SER   1           2HT      SER   1  -4.132   8.111  -2.256
    3    H3   SER   1           3HT      SER   1  -5.030   8.930  -1.076
    4    HA   SER   1           HA       SER   1  -6.641   7.131  -1.043
    5    HB2  SER   1           2HB      SER   1  -4.645   5.731  -2.843
    6    HB3  SER   1           1HB      SER   1  -6.154   5.055  -2.223
    7    HG   SER   1           HG       SER   1  -7.310   6.384  -3.526
    8    H    SER   2           H        SER   2  -6.443   5.844   0.729
    9    HA   SER   2           HA       SER   2  -3.759   5.737   1.913
   10    HB2  SER   2           2HB      SER   2  -6.455   5.448   3.255
   11    HB3  SER   2           1HB      SER   2  -4.890   5.578   4.060
   12    HG   SER   2           HG       SER   2  -5.532   7.594   2.257
   13    H    LEU   3           H        LEU   3  -2.855   3.875   1.250
   14    HA   LEU   3           HA       LEU   3  -4.485   1.447   1.132
   15    HB2  LEU   3           2HB      LEU   3  -1.649   1.908   0.209
   16    HB3  LEU   3           1HB      LEU   3  -2.634   0.496  -0.123
   17    HG   LEU   3           HG       LEU   3  -3.184   3.288  -1.132
   18   HD11  LEU   3          1HD1      LEU   3  -1.239   2.305  -2.199
   19   HD12  LEU   3          2HD1      LEU   3  -2.598   2.355  -3.323
   20   HD13  LEU   3          3HD1      LEU   3  -2.151   0.836  -2.546
   21   HD21  LEU   3          3HD2      LEU   3  -4.908   2.221  -2.499
   22   HD22  LEU   3          1HD2      LEU   3  -5.236   2.016  -0.777
   23   HD23  LEU   3          2HD2      LEU   3  -4.577   0.677  -1.715
   24    H    LEU   4           H        LEU   4  -1.432   2.604   2.528
   25    HA   LEU   4           HA       LEU   4  -1.764   0.897   4.813
   26    HB2  LEU   4           2HB      LEU   4   0.268  -0.378   4.580
   27    HB3  LEU   4           1HB      LEU   4  -0.749  -0.665   3.184
   28    HG   LEU   4           HG       LEU   4   1.506   1.325   3.094
   29   HD11  LEU   4          1HD1      LEU   4   2.901  -0.446   2.144
   30   HD12  LEU   4          2HD1      LEU   4   1.635  -1.625   2.490
   31   HD13  LEU   4          3HD1      LEU   4   2.452  -0.796   3.815
   32   HD21  LEU   4          3HD2      LEU   4  -0.134   1.425   1.287
   33   HD22  LEU   4          1HD2      LEU   4   0.109  -0.294   0.965
   34   HD23  LEU   4          2HD2      LEU   4   1.426   0.849   0.698
   35    H    GLU   5           H        GLU   5   0.791   0.993   5.836
   36    HA   GLU   5           HA       GLU   5   1.017   3.570   6.871
   37    HB2  GLU   5           2HB      GLU   5   2.181   1.148   7.397
   38    HB3  GLU   5           1HB      GLU   5   3.536   2.041   6.722
   39    HG2  GLU   5           2HG      GLU   5   1.881   2.775   9.123
   40    HG3  GLU   5           1HG      GLU   5   3.573   2.277   9.094
   41    H    LYS   6           H        LYS   6   3.412   2.042   4.705
   42    HA   LYS   6           HA       LYS   6   4.144   4.639   3.659
   43    HB2  LYS   6           2HB      LYS   6   5.226   1.870   3.349
   44    HB3  LYS   6           1HB      LYS   6   5.575   3.049   2.093
   45    HG2  LYS   6           2HG      LYS   6   7.374   2.983   3.711
   46    HG3  LYS   6           1HG      LYS   6   6.555   4.544   3.764
   47    HD2  LYS   6           2HD      LYS   6   5.217   3.661   5.701
   48    HD3  LYS   6           1HD      LYS   6   6.287   2.257   5.710
   49    HE2  LYS   6           2HE      LYS   6   8.212   3.733   6.062
   50    HE3  LYS   6           1HE      LYS   6   7.136   5.132   6.048
   51    HZ1  LYS   6           3HZ      LYS   6   7.601   4.551   8.301
   52    HZ2  LYS   6           1HZ      LYS   6   7.168   2.931   8.037
   53    HZ3  LYS   6           2HZ      LYS   6   5.981   4.145   7.984
   54    H    GLY   7           H        GLY   7   1.954   4.979   2.966
   55    HA2  GLY   7           2HA      GLY   7   1.515   5.083   0.302
   56    HA3  GLY   7           1HA      GLY   7   0.909   3.486   0.734
   57    H    LEU   8           H        LEU   8   0.859   6.373   2.708
   58    HA   LEU   8           HA       LEU   8  -2.033   6.093   3.031
   59    HB2  LEU   8           2HB      LEU   8  -0.529   6.215   5.018
   60    HB3  LEU   8           1HB      LEU   8  -0.052   7.826   4.521
   61    HG   LEU   8           HG       LEU   8  -2.489   8.489   4.750
   62   HD11  LEU   8          1HD1      LEU   8  -3.454   6.253   4.693
   63   HD12  LEU   8          2HD1      LEU   8  -3.876   7.087   6.189
   64   HD13  LEU   8          3HD1      LEU   8  -2.622   5.846   6.194
   65   HD21  LEU   8          3HD2      LEU   8  -2.334   8.726   7.184
   66   HD22  LEU   8          1HD2      LEU   8  -0.807   9.116   6.390
   67   HD23  LEU   8          2HD2      LEU   8  -1.006   7.566   7.207
   68    H    ASP   9           H        ASP   9   0.420   8.144   1.757
   69    HA   ASP   9           HA       ASP   9  -1.215  10.481   1.418
   70    HB2  ASP   9           2HB      ASP   9   0.767  11.304   0.128
   71    HB3  ASP   9           1HB      ASP   9   1.151  10.772   1.764
   72    H    GLY  10           H        GLY  10   0.258   8.125  -0.809
   73    HA2  GLY  10           2HA      GLY  10  -0.372   7.459  -2.921
   74    HA3  GLY  10           1HA      GLY  10  -1.931   8.227  -2.641
   75    H    ALA  11           H        ALA  11   0.973  10.042  -2.206
   76    HA   ALA  11           HA       ALA  11   0.588  11.390  -4.794
   77    HB1  ALA  11           1HB      ALA  11  -0.624  12.682  -3.104
   78    HB2  ALA  11           2HB      ALA  11   0.765  13.576  -3.721
   79    HB3  ALA  11           3HB      ALA  11   0.846  12.802  -2.137
   80    H    LYS  12           H        LYS  12   2.609  11.274  -1.862
   81    HA   LYS  12           HA       LYS  12   4.993  12.069  -3.253
   82    HB2  LYS  12           2HB      LYS  12   4.522  10.853  -0.524
   83    HB3  LYS  12           1HB      LYS  12   6.119  11.288  -1.120
   84    HG2  LYS  12           2HG      LYS  12   3.819  13.209  -0.799
   85    HG3  LYS  12           1HG      LYS  12   5.139  13.001   0.355
   86    HD2  LYS  12           2HD      LYS  12   6.746  13.649  -1.381
   87    HD3  LYS  12           1HD      LYS  12   5.417  13.877  -2.519
   88    HE2  LYS  12           2HE      LYS  12   6.158  16.008  -1.577
   89    HE3  LYS  12           1HE      LYS  12   4.498  15.644  -1.112
   90    HZ1  LYS  12           3HZ      LYS  12   6.756  14.940   0.662
   91    HZ2  LYS  12           1HZ      LYS  12   5.126  15.170   1.059
   92    HZ3  LYS  12           2HZ      LYS  12   6.103  16.507   0.670
   93    H    LYS  13           H        LYS  13   3.509   9.066  -2.222
   94    HA   LYS  13           HA       LYS  13   5.531   7.297  -3.066
   95    HB2  LYS  13           2HB      LYS  13   3.650   6.647  -1.613
   96    HB3  LYS  13           1HB      LYS  13   2.526   6.899  -2.938
   97    HG2  LYS  13           2HG      LYS  13   4.748   4.934  -3.263
   98    HG3  LYS  13           1HG      LYS  13   3.332   4.502  -2.305
   99    HD2  LYS  13           2HD      LYS  13   1.885   4.982  -4.215
  100    HD3  LYS  13           1HD      LYS  13   3.291   5.452  -5.171
  101    HE2  LYS  13           2HE      LYS  13   4.191   3.183  -4.956
  102    HE3  LYS  13           1HE      LYS  13   2.781   2.717  -4.007
  103    HZ1  LYS  13           3HZ      LYS  13   2.522   2.025  -6.284
  104    HZ2  LYS  13           1HZ      LYS  13   2.765   3.608  -6.843
  105    HZ3  LYS  13           2HZ      LYS  13   1.385   3.231  -5.930
  106    H    ALA  14           H        ALA  14   3.091   9.066  -4.781
  107    HA   ALA  14           HA       ALA  14   3.144   7.446  -7.143
  108    HB1  ALA  14           1HB      ALA  14   1.646   9.087  -8.079
  109    HB2  ALA  14           2HB      ALA  14   2.004  10.207  -6.767
  110    HB3  ALA  14           3HB      ALA  14   1.150   8.702  -6.432
  111    H    VAL  15           H        VAL  15   4.619  10.515  -6.156
  112    HA   VAL  15           HA       VAL  15   5.655  11.033  -8.778
  113    HB   VAL  15           HB       VAL  15   6.930  12.864  -7.743
  114   HG11  VAL  15          1HG1      VAL  15   4.032  12.724  -6.925
  115   HG12  VAL  15          2HG1      VAL  15   4.667  13.278  -8.475
  116   HG13  VAL  15          3HG1      VAL  15   4.999  14.198  -7.007
  117   HG21  VAL  15          3HG2      VAL  15   6.615  13.392  -5.361
  118   HG22  VAL  15          1HG2      VAL  15   7.455  11.858  -5.595
  119   HG23  VAL  15          2HG2      VAL  15   5.749  11.869  -5.150
  120    H    GLY  16           H        GLY  16   6.814   9.378  -5.944
  121    HA2  GLY  16           2HA      GLY  16   8.536   7.837  -5.822
  122    HA3  GLY  16           1HA      GLY  16   8.956   8.217  -7.484
  123    H    GLY  17           H        GLY  17   9.818  10.591  -7.679
  124    HA2  GLY  17           2HA      GLY  17  11.139  12.334  -6.752
  125    HA3  GLY  17           1HA      GLY  17  11.469  11.308  -5.363
  126    H    LEU  18           H        LEU  18  11.933   9.170  -7.646
  127    HA   LEU  18           HA       LEU  18  14.709   9.113  -7.383
  128    HB2  LEU  18           2HB      LEU  18  12.968   7.817  -9.475
  129    HB3  LEU  18           1HB      LEU  18  14.661   7.436  -9.221
  130    HG   LEU  18           HG       LEU  18  12.416   6.982  -7.251
  131   HD11  LEU  18          1HD1      LEU  18  14.120   5.043  -8.808
  132   HD12  LEU  18          2HD1      LEU  18  12.427   5.419  -9.127
  133   HD13  LEU  18          3HD1      LEU  18  12.884   4.622  -7.622
  134   HD21  LEU  18          3HD2      LEU  18  14.475   7.581  -6.095
  135   HD22  LEU  18          1HD2      LEU  18  15.360   6.365  -7.017
  136   HD23  LEU  18          2HD2      LEU  18  14.108   5.869  -5.877
  137    H    GLY  19           H        GLY  19  12.724  10.665  -9.802
  138    HA2  GLY  19           2HA      GLY  19  15.197  11.615 -11.101
  139    HA3  GLY  19           1HA      GLY  19  13.704  11.322 -11.978
  140    H    LYS  20           H        LYS  20  13.448  12.728  -8.844
  141    HA   LYS  20           HA       LYS  20  12.940  15.341 -10.109
  142    HB2  LYS  20           2HB      LYS  20  11.418  13.963  -7.894
  143    HB3  LYS  20           1HB      LYS  20  11.296  15.689  -8.179
  144    HG2  LYS  20           2HG      LYS  20   9.427  14.699  -9.223
  145    HG3  LYS  20           1HG      LYS  20  10.536  15.140 -10.520
  146    HD2  LYS  20           2HD      LYS  20  11.301  12.835 -10.672
  147    HD3  LYS  20           1HD      LYS  20  10.263  12.383  -9.320
  148    HE2  LYS  20           2HE      LYS  20   9.275  11.755 -11.468
  149    HE3  LYS  20           1HE      LYS  20   8.288  12.944 -10.623
  150    HZ1  LYS  20           3HZ      LYS  20   8.664  13.286 -13.091
  151    HZ2  LYS  20           1HZ      LYS  20  10.249  13.729 -12.699
  152    HZ3  LYS  20           2HZ      LYS  20   8.942  14.625 -12.092
  153    H    LEU  21           H        LEU  21  14.770  16.421  -9.622
  154    HA   LEU  21           HA       LEU  21  15.833  16.262  -6.896
  155    HB2  LEU  21           2HB      LEU  21  16.986  17.427  -9.427
  156    HB3  LEU  21           1HB      LEU  21  17.754  17.563  -7.860
  157    HG   LEU  21           HG       LEU  21  17.232  15.004  -9.373
  158   HD11  LEU  21          1HD1      LEU  21  19.800  16.436  -8.702
  159   HD12  LEU  21          2HD1      LEU  21  19.045  16.358 -10.294
  160   HD13  LEU  21          3HD1      LEU  21  19.661  14.890  -9.537
  161   HD21  LEU  21          3HD2      LEU  21  18.480  13.910  -7.583
  162   HD22  LEU  21          1HD2      LEU  21  17.012  14.668  -6.965
  163   HD23  LEU  21          2HD2      LEU  21  18.578  15.438  -6.709
  164    H    GLY  22           H        GLY  22  15.467  17.798  -5.485
  165    HA2  GLY  22           2HA      GLY  22  15.479  20.177  -4.935
  166    HA3  GLY  22           1HA      GLY  22  14.646  20.469  -6.462
  167    H    LYS  23           H        LYS  23  12.785  18.449  -6.401
  168    HA   LYS  23           HA       LYS  23  10.825  19.490  -4.589
  169    HB2  LYS  23           2HB      LYS  23  10.619  16.963  -6.235
  170    HB3  LYS  23           1HB      LYS  23   9.302  17.952  -5.624
  171    HG2  LYS  23           2HG      LYS  23  11.275  18.743  -7.758
  172    HG3  LYS  23           1HG      LYS  23   9.597  18.266  -8.010
  173    HD2  LYS  23           2HD      LYS  23   8.847  20.206  -6.729
  174    HD3  LYS  23           1HD      LYS  23  10.525  20.671  -6.442
  175    HE2  LYS  23           2HE      LYS  23  10.860  20.938  -8.851
  176    HE3  LYS  23           1HE      LYS  23   9.183  20.477  -9.136
  177    HZ1  LYS  23           3HZ      LYS  23   8.486  22.418  -7.851
  178    HZ2  LYS  23           1HZ      LYS  23   9.431  22.867  -9.189
  179    HZ3  LYS  23           2HZ      LYS  23  10.107  22.869  -7.633
  180    H    ASP  24           H        ASP  24  13.142  16.978  -4.587
  181    HA   ASP  24           HA       ASP  24  11.919  15.337  -2.568
  182    HB2  ASP  24           2HB      ASP  24  13.968  14.050  -2.673
  183    HB3  ASP  24           1HB      ASP  24  13.479  14.461  -4.315
  184    H    ALA  25           H        ALA  25  13.693  18.224  -2.585
  185    HA   ALA  25           HA       ALA  25  15.116  17.842  -0.127
  186    HB1  ALA  25           1HB      ALA  25  15.687  20.204  -0.317
  187    HB2  ALA  25           2HB      ALA  25  14.524  20.389  -1.630
  188    HB3  ALA  25           3HB      ALA  25  15.945  19.365  -1.848
  189    H    VAL  26           H        VAL  26  11.994  19.117  -1.036
  190    HA   VAL  26           HA       VAL  26  11.530  20.244   1.605
  191    HB   VAL  26           HB       VAL  26  10.737  21.395  -0.472
  192   HG11  VAL  26          1HG1      VAL  26  10.041  19.493  -1.774
  193   HG12  VAL  26          2HG1      VAL  26   8.675  20.583  -1.540
  194   HG13  VAL  26          3HG1      VAL  26   8.792  19.100  -0.594
  195   HG21  VAL  26          3HG2      VAL  26   8.603  20.635   1.517
  196   HG22  VAL  26          1HG2      VAL  26   8.538  22.016   0.420
  197   HG23  VAL  26          2HG2      VAL  26   9.770  21.947   1.680
  198    H    GLU  27           H        GLU  27  11.227  17.281   0.087
  199    HA   GLU  27           HA       GLU  27   8.766  16.290   0.991
  200    HB2  GLU  27           2HB      GLU  27  10.625  15.355  -0.672
  201    HB3  GLU  27           1HB      GLU  27  11.126  14.474   0.760
  202    HG2  GLU  27           2HG      GLU  27   8.452  14.344  -0.611
  203    HG3  GLU  27           1HG      GLU  27   9.688  13.089  -0.555
  204    H    ASP  28           H        ASP  28  12.004  16.115   2.410
  205    HA   ASP  28           HA       ASP  28  11.505  14.311   4.453
  206    HB2  ASP  28           2HB      ASP  28  13.755  15.057   3.765
  207    HB3  ASP  28           1HB      ASP  28  13.453  16.624   4.510
  208    H    LEU  29           H        LEU  29  11.539  17.873   4.735
  209    HA   LEU  29           HA       LEU  29  10.824  17.882   7.451
  210    HB2  LEU  29           2HB      LEU  29  10.218  20.291   7.063
  211    HB3  LEU  29           1HB      LEU  29  11.856  19.831   6.656
  212    HG   LEU  29           HG       LEU  29   9.818  19.869   4.475
  213   HD11  LEU  29          1HD1      LEU  29   9.438  21.975   5.645
  214   HD12  LEU  29          2HD1      LEU  29  10.257  22.254   4.108
  215   HD13  LEU  29          3HD1      LEU  29  11.169  22.315   5.616
  216   HD21  LEU  29          3HD2      LEU  29  12.747  20.577   4.650
  217   HD22  LEU  29          1HD2      LEU  29  11.773  20.589   3.180
  218   HD23  LEU  29          2HD2      LEU  29  12.077  19.071   4.024
  219    H    GLU  30           H        GLU  30   8.874  17.602   4.588
  220    HA   GLU  30           HA       GLU  30   6.395  18.318   5.801
  221    HB2  GLU  30           2HB      GLU  30   7.007  16.618   3.382
  222    HB3  GLU  30           1HB      GLU  30   5.378  17.020   3.899
  223    HG2  GLU  30           2HG      GLU  30   5.979  19.427   3.634
  224    HG3  GLU  30           1HG      GLU  30   7.501  18.899   2.911
  225    H    SER  31           H        SER  31   7.613  15.129   4.795
  226    HA   SER  31           HA       SER  31   5.490  13.768   6.070
  227    HB2  SER  31           2HB      SER  31   8.093  12.759   4.917
  228    HB3  SER  31           1HB      SER  31   6.763  11.720   5.443
  229    HG   SER  31           HG       SER  31   7.057  13.018   3.108
  230    H    VAL  32           H        VAL  32   8.662  14.700   7.193
  231    HA   VAL  32           HA       VAL  32   8.530  12.939   9.484
  232    HB   VAL  32           HB       VAL  32  10.419  15.224   8.883
  233   HG11  VAL  32          1HG1      VAL  32  11.803  14.329  10.705
  234   HG12  VAL  32          2HG1      VAL  32  10.546  13.151  11.079
  235   HG13  VAL  32          3HG1      VAL  32  10.232  14.873  11.294
  236   HG21  VAL  32          3HG2      VAL  32  10.762  12.234   8.683
  237   HG22  VAL  32          1HG2      VAL  32  12.042  13.424   8.444
  238   HG23  VAL  32          2HG2      VAL  32  10.666  13.374   7.342
  239    H    GLY  33           H        GLY  33   8.157  16.422   8.889
  240    HA2  GLY  33           2HA      GLY  33   7.704  17.068  11.629
  241    HA3  GLY  33           1HA      GLY  33   7.418  18.121  10.254
  242    H    LYS  34           H        LYS  34   5.530  16.642   8.856
  243    HA   LYS  34           HA       LYS  34   3.188  17.136  10.483
  244    HB2  LYS  34           2HB      LYS  34   3.261  17.829   8.119
  245    HB3  LYS  34           1HB      LYS  34   3.440  16.152   7.630
  246    HG2  LYS  34           2HG      LYS  34   1.218  15.686   8.654
  247    HG3  LYS  34           1HG      LYS  34   1.049  17.417   8.946
  248    HD2  LYS  34           2HD      LYS  34   1.222  17.859   6.565
  249    HD3  LYS  34           1HD      LYS  34   1.454  16.140   6.245
  250    HE2  LYS  34           2HE      LYS  34  -0.831  16.699   5.778
  251    HE3  LYS  34           1HE      LYS  34  -0.786  15.714   7.239
  252    HZ1  LYS  34           3HZ      LYS  34  -1.073  18.669   7.125
  253    HZ2  LYS  34           1HZ      LYS  34  -0.970  17.758   8.554
  254    HZ3  LYS  34           2HZ      LYS  34  -2.294  17.558   7.513
  255    H    GLY  35           H        GLY  35   5.152  14.471   9.642
  256    HA2  GLY  35           2HA      GLY  35   3.019  12.610  10.481
  257    HA3  GLY  35           1HA      GLY  35   4.203  12.214   9.249
  258    H    ALA  36           H        ALA  36   4.599  13.710  12.468
  259    HA   ALA  36           HA       ALA  36   6.816  12.036  13.095
  260    HB1  ALA  36           1HB      ALA  36   6.529  14.234  14.123
  261    HB2  ALA  36           2HB      ALA  36   6.636  12.973  15.352
  262    HB3  ALA  36           3HB      ALA  36   5.070  13.671  14.936
  263    H    VAL  37           H        VAL  37   3.389  12.006  13.947
  264    HA   VAL  37           HA       VAL  37   3.467   9.653  15.536
  265    HB   VAL  37           HB       VAL  37   1.128  10.775  13.970
  266   HG11  VAL  37          1HG1      VAL  37  -0.255   9.627  15.633
  267   HG12  VAL  37          2HG1      VAL  37   1.195   8.952  16.373
  268   HG13  VAL  37          3HG1      VAL  37   0.749   8.493  14.732
  269   HG21  VAL  37          3HG2      VAL  37   0.514  11.918  16.050
  270   HG22  VAL  37          1HG2      VAL  37   2.071  12.474  15.435
  271   HG23  VAL  37          2HG2      VAL  37   2.008  11.354  16.797
  272    H    HIS  38           H        HIS  38   3.337  10.284  12.139
  273    HA   HIS  38           HA       HIS  38   2.376   7.820  11.177
  274    HB2  HIS  38           2HB      HIS  38   2.579   9.877   9.808
  275    HB3  HIS  38           1HB      HIS  38   4.329   9.749   9.885
  276    HD1  HIS  38           1HD      HIS  38   1.375   8.531   8.049
  277    HD2  HIS  38           2HD      HIS  38   5.405   7.585   8.326
  278    HE1  HIS  38           1HE      HIS  38   1.883   7.171   6.005
  279    HE2  HIS  38           2HE      HIS  38   4.223   6.340   6.398
  280    H    ASP  39           H        ASP  39   5.620   8.927  12.062
  281    HA   ASP  39           HA       ASP  39   6.926   6.558  11.119
  282    HB2  ASP  39           2HB      ASP  39   8.089   8.745  11.329
  283    HB3  ASP  39           1HB      ASP  39   7.948   8.623  13.080
  284    H    VAL  40           H        VAL  40   5.861   7.734  14.278
  285    HA   VAL  40           HA       VAL  40   6.848   5.581  15.807
  286    HB   VAL  40           HB       VAL  40   4.460   7.352  16.380
  287   HG11  VAL  40          1HG1      VAL  40   4.835   6.769  18.728
  288   HG12  VAL  40          2HG1      VAL  40   6.133   5.677  18.254
  289   HG13  VAL  40          3HG1      VAL  40   4.475   5.334  17.766
  290   HG21  VAL  40          3HG2      VAL  40   7.345   7.642  17.209
  291   HG22  VAL  40          1HG2      VAL  40   6.015   8.684  17.708
  292   HG23  VAL  40          2HG2      VAL  40   6.506   8.632  16.014
  293    H    LYS  41           H        LYS  41   3.896   6.060  13.992
  294    HA   LYS  41           HA       LYS  41   2.316   3.978  14.913
  295    HB2  LYS  41           2HB      LYS  41   1.487   5.628  13.332
  296    HB3  LYS  41           1HB      LYS  41   2.592   5.043  12.096
  297    HG2  LYS  41           2HG      LYS  41   1.402   2.822  12.265
  298    HG3  LYS  41           1HG      LYS  41   0.190   3.649  13.244
  299    HD2  LYS  41           2HD      LYS  41  -0.221   5.210  11.405
  300    HD3  LYS  41           1HD      LYS  41   0.990   4.379  10.429
  301    HE2  LYS  41           2HE      LYS  41  -1.580   3.198  11.477
  302    HE3  LYS  41           1HE      LYS  41  -1.254   3.672   9.811
  303    HZ1  LYS  41           3HZ      LYS  41  -1.006   1.307  10.051
  304    HZ2  LYS  41           1HZ      LYS  41   0.100   1.500  11.317
  305    HZ3  LYS  41           2HZ      LYS  41   0.516   1.985   9.755
  306    H    ASP  42           H        ASP  42   4.932   3.926  12.548
  307    HA   ASP  42           HA       ASP  42   4.519   1.474  11.362
  308    HB2  ASP  42           2HB      ASP  42   6.200   2.969  10.520
  309    HB3  ASP  42           1HB      ASP  42   7.118   2.864  12.021
  310    H    VAL  43           H        VAL  43   6.493   2.093  14.265
  311    HA   VAL  43           HA       VAL  43   7.218  -0.629  14.627
  312    HB   VAL  43           HB       VAL  43   7.184   1.554  16.719
  313   HG11  VAL  43          1HG1      VAL  43   7.451  -0.687  17.640
  314   HG12  VAL  43          2HG1      VAL  43   8.946   0.236  17.786
  315   HG13  VAL  43          3HG1      VAL  43   8.788  -0.996  16.533
  316   HG21  VAL  43          3HG2      VAL  43   9.345   0.799  14.754
  317   HG22  VAL  43          1HG2      VAL  43   9.543   1.918  16.104
  318   HG23  VAL  43          2HG2      VAL  43   8.434   2.308  14.791
  319    H    LEU  44           H        LEU  44   4.734   1.433  16.067
  320    HA   LEU  44           HA       LEU  44   3.895  -0.462  18.016
  321    HB2  LEU  44           2HB      LEU  44   3.626   2.007  18.191
  322    HB3  LEU  44           1HB      LEU  44   2.410   1.932  16.933
  323    HG   LEU  44           HG       LEU  44   1.053   0.450  18.426
  324   HD11  LEU  44          1HD1      LEU  44   1.605   0.412  20.806
  325   HD12  LEU  44          2HD1      LEU  44   3.115   1.263  20.472
  326   HD13  LEU  44          3HD1      LEU  44   2.862  -0.366  19.845
  327   HD21  LEU  44          3HD2      LEU  44   0.575   2.825  18.212
  328   HD22  LEU  44          1HD2      LEU  44   1.756   3.192  19.468
  329   HD23  LEU  44          2HD2      LEU  44   0.298   2.284  19.868
  330    H    ASP  45           H        ASP  45   2.935   0.231  14.736
  331    HA   ASP  45           HA       ASP  45   0.410  -1.115  14.865
  332    HB2  ASP  45           2HB      ASP  45   0.860   0.717  13.278
  333    HB3  ASP  45           1HB      ASP  45   2.057  -0.282  12.467
  334    H    SER  46           H        SER  46   3.667  -2.008  13.888
  335    HA   SER  46           HA       SER  46   2.723  -4.521  12.776
  336    HB2  SER  46           2HB      SER  46   5.150  -4.822  12.156
  337    HB3  SER  46           1HB      SER  46   4.370  -3.407  11.450
  338    HG   SER  46           HG       SER  46   5.481  -2.096  12.791
  339    H    VAL  47           H        VAL  47   4.779  -3.398  15.445
  340    HA   VAL  47           HA       VAL  47   5.279  -6.144  16.263
  341    HB   VAL  47           HB       VAL  47   6.185  -3.579  17.582
  342   HG11  VAL  47          1HG1      VAL  47   6.217  -5.480  19.097
  343   HG12  VAL  47          2HG1      VAL  47   7.861  -5.006  18.670
  344   HG13  VAL  47          3HG1      VAL  47   7.131  -6.426  17.920
  345   HG21  VAL  47          3HG2      VAL  47   7.633  -5.368  15.630
  346   HG22  VAL  47          1HG2      VAL  47   8.338  -3.998  16.485
  347   HG23  VAL  47          2HG2      VAL  47   7.047  -3.733  15.314
  348    H    LEU  48           H        LEU  48   3.960  -7.188  17.565
  349    HA   LEU  48           HA       LEU  48   2.587  -5.720  19.685
  350    HB2  LEU  48           2HB      LEU  48   0.563  -7.165  19.278
  351    HB3  LEU  48           1HB      LEU  48   0.863  -5.903  18.104
  352    HG   LEU  48           HG       LEU  48   2.041  -7.851  16.774
  353   HD11  LEU  48          1HD1      LEU  48   0.868  -9.989  17.078
  354   HD12  LEU  48          2HD1      LEU  48   0.097  -9.345  18.528
  355   HD13  LEU  48          3HD1      LEU  48   1.847  -9.552  18.479
  356   HD21  LEU  48          3HD2      LEU  48  -0.950  -7.528  16.976
  357   HD22  LEU  48          1HD2      LEU  48  -0.086  -8.277  15.634
  358   HD23  LEU  48          2HD2      LEU  48   0.142  -6.565  15.983
  Start of MODEL   20
    1    H1   SER   1           1HT      SER   1   7.579   7.820  31.926
    2    H2   SER   1           2HT      SER   1   8.838   6.890  32.579
    3    H3   SER   1           3HT      SER   1   7.667   6.158  31.599
    4    HA   SER   1           HA       SER   1   9.506   8.271  30.675
    5    HB2  SER   1           2HB      SER   1  10.595   6.307  29.442
    6    HB3  SER   1           1HB      SER   1  10.909   6.434  31.173
    7    HG   SER   1           HG       SER   1  10.354   4.346  30.887
    8    H    SER   2           H        SER   2   8.869   9.159  28.848
    9    HA   SER   2           HA       SER   2   7.259   7.598  26.947
   10    HB2  SER   2           2HB      SER   2   6.691  10.480  27.689
   11    HB3  SER   2           1HB      SER   2   5.768   9.475  26.573
   12    HG   SER   2           HG       SER   2   5.282   8.109  28.373
   13    H    LEU   3           H        LEU   3   7.649   8.103  24.782
   14    HA   LEU   3           HA       LEU   3  10.217   8.976  24.135
   15    HB2  LEU   3           2HB      LEU   3   7.760   8.745  22.407
   16    HB3  LEU   3           1HB      LEU   3   9.350   9.110  21.776
   17    HG   LEU   3           HG       LEU   3   9.014   6.816  21.381
   18   HD11  LEU   3          1HD1      LEU   3  10.716   5.719  22.745
   19   HD12  LEU   3          2HD1      LEU   3  10.664   7.061  23.887
   20   HD13  LEU   3          3HD1      LEU   3  11.224   7.330  22.237
   21   HD21  LEU   3          3HD2      LEU   3   8.326   5.214  23.097
   22   HD22  LEU   3          1HD2      LEU   3   7.103   6.460  22.841
   23   HD23  LEU   3          2HD2      LEU   3   8.154   6.532  24.257
   24    H    LEU   4           H        LEU   4   7.181  10.721  24.261
   25    HA   LEU   4           HA       LEU   4   8.430  13.122  23.211
   26    HB2  LEU   4           2HB      LEU   4   5.601  12.476  24.020
   27    HB3  LEU   4           1HB      LEU   4   6.109  14.109  23.644
   28    HG   LEU   4           HG       LEU   4   6.826  13.225  21.369
   29   HD11  LEU   4          1HD1      LEU   4   6.881  10.849  21.935
   30   HD12  LEU   4          2HD1      LEU   4   5.778  11.173  20.596
   31   HD13  LEU   4          3HD1      LEU   4   5.138  10.876  22.213
   32   HD21  LEU   4          3HD2      LEU   4   3.916  13.136  22.142
   33   HD22  LEU   4          1HD2      LEU   4   4.534  13.290  20.496
   34   HD23  LEU   4          2HD2      LEU   4   4.837  14.564  21.675
   35    H    GLU   5           H        GLU   5   9.728  14.075  24.597
   36    HA   GLU   5           HA       GLU   5  10.371  15.446  26.270
   37    HB2  GLU   5           2HB      GLU   5   7.450  15.352  27.014
   38    HB3  GLU   5           1HB      GLU   5   8.632  16.363  27.831
   39    HG2  GLU   5           2HG      GLU   5   7.980  16.510  24.898
   40    HG3  GLU   5           1HG      GLU   5   7.307  17.566  26.138
   41    H    LYS   6           H        LYS   6   7.907  13.500  27.977
   42    HA   LYS   6           HA       LYS   6   9.661  13.457  30.262
   43    HB2  LYS   6           2HB      LYS   6   7.710  12.279  31.356
   44    HB3  LYS   6           1HB      LYS   6   7.406  13.904  30.764
   45    HG2  LYS   6           2HG      LYS   6   6.382  12.889  28.725
   46    HG3  LYS   6           1HG      LYS   6   6.547  11.310  29.499
   47    HD2  LYS   6           2HD      LYS   6   5.119  11.987  31.309
   48    HD3  LYS   6           1HD      LYS   6   5.067  13.643  30.710
   49    HE2  LYS   6           2HE      LYS   6   3.028  12.688  30.048
   50    HE3  LYS   6           1HE      LYS   6   4.029  12.688  28.598
   51    HZ1  LYS   6           3HZ      LYS   6   4.543  10.330  29.042
   52    HZ2  LYS   6           1HZ      LYS   6   2.886  10.602  28.802
   53    HZ3  LYS   6           2HZ      LYS   6   3.483  10.357  30.367
   54    H    GLY   7           H        GLY   7  10.924  11.981  28.337
   55    HA2  GLY   7           2HA      GLY   7  11.923   9.932  29.781
   56    HA3  GLY   7           1HA      GLY   7  10.542   9.185  28.997
   57    H    LEU   8           H        LEU   8  12.422  11.678  27.422
   58    HA   LEU   8           HA       LEU   8  13.361   9.652  25.524
   59    HB2  LEU   8           2HB      LEU   8  12.018  11.616  24.707
   60    HB3  LEU   8           1HB      LEU   8  13.351  12.651  25.188
   61    HG   LEU   8           HG       LEU   8  14.828  11.481  23.593
   62   HD11  LEU   8          1HD1      LEU   8  13.870   9.937  21.961
   63   HD12  LEU   8          2HD1      LEU   8  12.311  10.025  22.782
   64   HD13  LEU   8          3HD1      LEU   8  13.700   9.310  23.602
   65   HD21  LEU   8          3HD2      LEU   8  12.273  12.552  22.390
   66   HD22  LEU   8          1HD2      LEU   8  13.814  12.374  21.548
   67   HD23  LEU   8          2HD2      LEU   8  13.671  13.508  22.892
   68    H    ASP   9           H        ASP   9  15.298   8.895  26.066
   69    HA   ASP   9           HA       ASP   9  17.029  10.163  27.879
   70    HB2  ASP   9           2HB      ASP   9  17.513   7.878  25.967
   71    HB3  ASP   9           1HB      ASP   9  18.673   8.396  27.188
   72    H    GLY  10           H        GLY  10  17.200   9.825  24.357
   73    HA2  GLY  10           2HA      GLY  10  19.759  10.896  23.996
   74    HA3  GLY  10           1HA      GLY  10  18.493  10.877  22.781
   75    H    ALA  11           H        ALA  11  16.688  12.543  24.374
   76    HA   ALA  11           HA       ALA  11  17.935  15.095  23.671
   77    HB1  ALA  11           1HB      ALA  11  15.666  15.992  23.665
   78    HB2  ALA  11           2HB      ALA  11  15.043  14.437  24.213
   79    HB3  ALA  11           3HB      ALA  11  15.795  14.575  22.624
   80    H    LYS  12           H        LYS  12  17.839  13.325  26.353
   81    HA   LYS  12           HA       LYS  12  17.413  15.663  28.096
   82    HB2  LYS  12           2HB      LYS  12  16.515  12.866  28.362
   83    HB3  LYS  12           1HB      LYS  12  17.192  13.572  29.822
   84    HG2  LYS  12           2HG      LYS  12  14.782  13.841  29.760
   85    HG3  LYS  12           1HG      LYS  12  15.590  15.406  29.694
   86    HD2  LYS  12           2HD      LYS  12  15.291  15.399  27.233
   87    HD3  LYS  12           1HD      LYS  12  14.374  13.899  27.383
   88    HE2  LYS  12           2HE      LYS  12  12.874  15.806  27.218
   89    HE3  LYS  12           1HE      LYS  12  12.740  15.045  28.802
   90    HZ1  LYS  12           3HZ      LYS  12  14.425  17.429  28.281
   91    HZ2  LYS  12           1HZ      LYS  12  13.995  16.776  29.788
   92    HZ3  LYS  12           2HZ      LYS  12  12.818  17.523  28.817
   93    H    LYS  13           H        LYS  13  19.134  12.545  28.017
   94    HA   LYS  13           HA       LYS  13  21.161  11.885  28.773
   95    HB2  LYS  13           2HB      LYS  13  21.865  14.770  28.199
   96    HB3  LYS  13           1HB      LYS  13  23.035  13.498  28.524
   97    HG2  LYS  13           2HG      LYS  13  21.114  13.573  26.205
   98    HG3  LYS  13           1HG      LYS  13  22.838  13.939  26.139
   99    HD2  LYS  13           2HD      LYS  13  21.645  11.283  26.935
  100    HD3  LYS  13           1HD      LYS  13  22.333  11.657  25.356
  101    HE2  LYS  13           2HE      LYS  13  23.827  11.743  27.979
  102    HE3  LYS  13           1HE      LYS  13  23.900  10.428  26.807
  103    HZ1  LYS  13           3HZ      LYS  13  24.810  11.981  25.182
  104    HZ2  LYS  13           1HZ      LYS  13  25.784  11.908  26.569
  105    HZ3  LYS  13           2HZ      LYS  13  24.754  13.233  26.321
  106    H    ALA  14           H        ALA  14  19.204  12.976  30.683
  107    HA   ALA  14           HA       ALA  14  18.987  13.293  32.906
  108    HB1  ALA  14           1HB      ALA  14  21.908  12.556  33.062
  109    HB2  ALA  14           2HB      ALA  14  20.563  11.417  33.077
  110    HB3  ALA  14           3HB      ALA  14  20.756  12.569  34.397
  111    H    VAL  15           H        VAL  15  18.731  15.502  32.102
  112    HA   VAL  15           HA       VAL  15  18.786  17.708  32.385
  113    HB   VAL  15           HB       VAL  15  19.364  18.668  34.450
  114   HG11  VAL  15          1HG1      VAL  15  17.447  17.214  34.528
  115   HG12  VAL  15          2HG1      VAL  15  18.311  17.140  36.063
  116   HG13  VAL  15          3HG1      VAL  15  18.471  15.828  34.897
  117   HG21  VAL  15          3HG2      VAL  15  21.067  16.252  35.047
  118   HG22  VAL  15          1HG2      VAL  15  20.696  17.552  36.179
  119   HG23  VAL  15          2HG2      VAL  15  21.641  17.891  34.728
  120    H    GLY  16           H        GLY  16  22.005  16.309  32.488
  121    HA2  GLY  16           2HA      GLY  16  23.422  18.746  32.195
  122    HA3  GLY  16           1HA      GLY  16  24.041  17.143  31.834
  123    H    GLY  17           H        GLY  17  24.223  19.798  30.431
  124    HA2  GLY  17           2HA      GLY  17  22.780  19.348  27.950
  125    HA3  GLY  17           1HA      GLY  17  23.810  20.722  28.330
  126    H    LEU  18           H        LEU  18  24.225  17.188  28.044
  127    HA   LEU  18           HA       LEU  18  26.412  17.764  26.171
  128    HB2  LEU  18           2HB      LEU  18  27.726  15.928  27.036
  129    HB3  LEU  18           1HB      LEU  18  27.384  17.078  28.309
  130    HG   LEU  18           HG       LEU  18  25.808  14.523  27.994
  131   HD11  LEU  18          1HD1      LEU  18  28.281  14.996  29.656
  132   HD12  LEU  18          2HD1      LEU  18  28.169  13.949  28.243
  133   HD13  LEU  18          3HD1      LEU  18  27.262  13.558  29.707
  134   HD21  LEU  18          3HD2      LEU  18  24.806  16.284  29.381
  135   HD22  LEU  18          1HD2      LEU  18  26.277  16.350  30.350
  136   HD23  LEU  18          2HD2      LEU  18  25.289  14.889  30.345
  137    H    GLY  19           H        GLY  19  25.343  17.342  24.318
  138    HA2  GLY  19           2HA      GLY  19  25.209  15.688  22.621
  139    HA3  GLY  19           1HA      GLY  19  24.849  14.490  23.853
  140    H    LYS  20           H        LYS  20  22.825  16.314  25.092
  141    HA   LYS  20           HA       LYS  20  20.605  15.142  23.856
  142    HB2  LYS  20           2HB      LYS  20  19.227  16.579  25.303
  143    HB3  LYS  20           1HB      LYS  20  20.510  15.764  26.179
  144    HG2  LYS  20           2HG      LYS  20  21.792  17.794  26.299
  145    HG3  LYS  20           1HG      LYS  20  20.626  18.633  25.271
  146    HD2  LYS  20           2HD      LYS  20  18.899  18.347  26.959
  147    HD3  LYS  20           1HD      LYS  20  20.012  17.430  27.972
  148    HE2  LYS  20           2HE      LYS  20  21.428  19.395  28.219
  149    HE3  LYS  20           1HE      LYS  20  20.360  20.315  27.160
  150    HZ1  LYS  20           3HZ      LYS  20  19.953  20.747  29.532
  151    HZ2  LYS  20           1HZ      LYS  20  19.546  19.117  29.755
  152    HZ3  LYS  20           2HZ      LYS  20  18.595  20.099  28.756
  153    H    LEU  21           H        LEU  21  21.953  18.380  23.530
  154    HA   LEU  21           HA       LEU  21  20.093  18.816  21.287
  155    HB2  LEU  21           2HB      LEU  21  21.515  20.830  23.036
  156    HB3  LEU  21           1HB      LEU  21  20.582  21.242  21.608
  157    HG   LEU  21           HG       LEU  21  19.479  19.930  24.097
  158   HD11  LEU  21          1HD1      LEU  21  20.097  22.255  24.465
  159   HD12  LEU  21          2HD1      LEU  21  18.344  22.058  24.451
  160   HD13  LEU  21          3HD1      LEU  21  19.167  22.736  23.045
  161   HD21  LEU  21          3HD2      LEU  21  17.293  20.325  23.064
  162   HD22  LEU  21          1HD2      LEU  21  18.286  19.236  22.089
  163   HD23  LEU  21          2HD2      LEU  21  18.092  20.924  21.609
  164    H    GLY  22           H        GLY  22  22.736  17.419  21.538
  165    HA2  GLY  22           2HA      GLY  22  24.317  19.076  19.686
  166    HA3  GLY  22           1HA      GLY  22  24.990  17.870  20.772
  167    H    LYS  23           H        LYS  23  23.586  15.631  20.348
  168    HA   LYS  23           HA       LYS  23  24.221  15.121  17.526
  169    HB2  LYS  23           2HB      LYS  23  24.712  12.830  18.142
  170    HB3  LYS  23           1HB      LYS  23  25.630  13.932  19.153
  171    HG2  LYS  23           2HG      LYS  23  24.943  12.398  20.696
  172    HG3  LYS  23           1HG      LYS  23  23.639  13.579  20.818
  173    HD2  LYS  23           2HD      LYS  23  22.271  12.214  19.305
  174    HD3  LYS  23           1HD      LYS  23  23.579  11.036  19.186
  175    HE2  LYS  23           2HE      LYS  23  23.407  10.602  21.582
  176    HE3  LYS  23           1HE      LYS  23  22.110  11.791  21.711
  177    HZ1  LYS  23           3HZ      LYS  23  21.982   9.353  20.017
  178    HZ2  LYS  23           1HZ      LYS  23  20.714  10.440  20.326
  179    HZ3  LYS  23           2HZ      LYS  23  21.325   9.465  21.575
  180    H    ASP  24           H        ASP  24  21.691  14.859  19.901
  181    HA   ASP  24           HA       ASP  24  20.180  13.027  18.201
  182    HB2  ASP  24           2HB      ASP  24  20.491  12.955  20.845
  183    HB3  ASP  24           1HB      ASP  24  19.087  14.017  20.788
  184    H    ALA  25           H        ALA  25  20.561  16.276  18.566
  185    HA   ALA  25           HA       ALA  25  17.877  17.197  18.463
  186    HB1  ALA  25           1HB      ALA  25  18.857  19.370  17.943
  187    HB2  ALA  25           2HB      ALA  25  20.427  18.606  17.689
  188    HB3  ALA  25           3HB      ALA  25  19.688  18.591  19.289
  189    H    VAL  26           H        VAL  26  19.842  15.725  16.158
  190    HA   VAL  26           HA       VAL  26  18.959  17.051  13.811
  191    HB   VAL  26           HB       VAL  26  21.003  15.654  13.894
  192   HG11  VAL  26          1HG1      VAL  26  19.094  13.324  13.980
  193   HG12  VAL  26          2HG1      VAL  26  20.162  13.839  15.286
  194   HG13  VAL  26          3HG1      VAL  26  20.843  13.229  13.779
  195   HG21  VAL  26          3HG2      VAL  26  20.714  14.557  11.718
  196   HG22  VAL  26          1HG2      VAL  26  20.014  16.176  11.738
  197   HG23  VAL  26          2HG2      VAL  26  18.968  14.761  11.854
  198    H    GLU  27           H        GLU  27  17.549  14.677  15.880
  199    HA   GLU  27           HA       GLU  27  15.745  13.480  14.075
  200    HB2  GLU  27           2HB      GLU  27  15.597  13.882  17.063
  201    HB3  GLU  27           1HB      GLU  27  14.446  12.915  16.150
  202    HG2  GLU  27           2HG      GLU  27  17.406  12.409  16.348
  203    HG3  GLU  27           1HG      GLU  27  16.145  11.532  17.214
  204    H    ASP  28           H        ASP  28  15.637  16.443  15.929
  205    HA   ASP  28           HA       ASP  28  12.864  16.958  15.450
  206    HB2  ASP  28           2HB      ASP  28  13.947  17.913  17.399
  207    HB3  ASP  28           1HB      ASP  28  15.117  18.751  16.387
  208    H    LEU  29           H        LEU  29  15.649  17.193  13.559
  209    HA   LEU  29           HA       LEU  29  14.635  19.380  11.933
  210    HB2  LEU  29           2HB      LEU  29  17.202  17.804  11.756
  211    HB3  LEU  29           1HB      LEU  29  16.774  19.126  10.687
  212    HG   LEU  29           HG       LEU  29  17.184  19.358  13.668
  213   HD11  LEU  29          1HD1      LEU  29  19.208  20.590  13.069
  214   HD12  LEU  29          2HD1      LEU  29  18.917  20.241  11.365
  215   HD13  LEU  29          3HD1      LEU  29  19.266  18.927  12.488
  216   HD21  LEU  29          3HD2      LEU  29  15.543  20.954  12.812
  217   HD22  LEU  29          1HD2      LEU  29  16.691  21.479  11.580
  218   HD23  LEU  29          2HD2      LEU  29  17.038  21.762  13.286
  219    H    GLU  30           H        GLU  30  16.128  16.277  10.984
  220    HA   GLU  30           HA       GLU  30  14.409  16.363   8.623
  221    HB2  GLU  30           2HB      GLU  30  15.987  14.684   7.693
  222    HB3  GLU  30           1HB      GLU  30  16.740  16.214   8.118
  223    HG2  GLU  30           2HG      GLU  30  17.696  15.280  10.090
  224    HG3  GLU  30           1HG      GLU  30  16.783  13.783   9.887
  225    H    SER  31           H        SER  31  14.844  14.504  11.509
  226    HA   SER  31           HA       SER  31  13.795  12.055  10.500
  227    HB2  SER  31           2HB      SER  31  15.210  12.240  12.555
  228    HB3  SER  31           1HB      SER  31  13.850  13.004  13.374
  229    HG   SER  31           HG       SER  31  14.083  10.687  13.708
  230    H    VAL  32           H        VAL  32  12.388  14.856  12.137
  231    HA   VAL  32           HA       VAL  32   9.787  13.795  12.431
  232    HB   VAL  32           HB       VAL  32  10.592  15.801  13.642
  233   HG11  VAL  32          1HG1      VAL  32  11.804  16.890  11.834
  234   HG12  VAL  32          2HG1      VAL  32  10.609  17.981  12.535
  235   HG13  VAL  32          3HG1      VAL  32  10.289  17.199  10.987
  236   HG21  VAL  32          3HG2      VAL  32   8.113  16.256  11.986
  237   HG22  VAL  32          1HG2      VAL  32   8.516  17.092  13.485
  238   HG23  VAL  32          2HG2      VAL  32   8.204  15.356  13.502
  239    H    GLY  33           H        GLY  33  11.492  15.164   9.747
  240    HA2  GLY  33           2HA      GLY  33   9.273  15.957   8.173
  241    HA3  GLY  33           1HA      GLY  33  10.910  15.689   7.595
  242    H    LYS  34           H        LYS  34  10.636  12.871   8.825
  243    HA   LYS  34           HA       LYS  34   9.755  11.569   6.441
  244    HB2  LYS  34           2HB      LYS  34  11.507  10.642   7.954
  245    HB3  LYS  34           1HB      LYS  34  10.272  10.381   9.179
  246    HG2  LYS  34           2HG      LYS  34   9.096   8.890   7.541
  247    HG3  LYS  34           1HG      LYS  34  10.514   9.034   6.501
  248    HD2  LYS  34           2HD      LYS  34  11.914   8.112   8.292
  249    HD3  LYS  34           1HD      LYS  34  10.486   7.954   9.319
  250    HE2  LYS  34           2HE      LYS  34  10.965   6.557   6.689
  251    HE3  LYS  34           1HE      LYS  34  11.036   5.822   8.289
  252    HZ1  LYS  34           3HZ      LYS  34   8.938   5.377   7.145
  253    HZ2  LYS  34           1HZ      LYS  34   8.611   7.039   7.076
  254    HZ3  LYS  34           2HZ      LYS  34   8.692   6.252   8.581
  255    H    GLY  35           H        GLY  35   8.298  12.521   9.423
  256    HA2  GLY  35           2HA      GLY  35   5.864  12.663   9.518
  257    HA3  GLY  35           1HA      GLY  35   5.813  11.132   8.646
  258    H    ALA  36           H        ALA  36   7.542  12.326  11.512
  259    HA   ALA  36           HA       ALA  36   7.640   9.891  12.864
  260    HB1  ALA  36           1HB      ALA  36   8.222  11.180  14.838
  261    HB2  ALA  36           2HB      ALA  36   7.626  12.654  14.076
  262    HB3  ALA  36           3HB      ALA  36   9.042  11.831  13.419
  263    H    VAL  37           H        VAL  37   5.107  12.257  12.668
  264    HA   VAL  37           HA       VAL  37   3.548  11.466  14.879
  265    HB   VAL  37           HB       VAL  37   2.512  12.614  12.280
  266   HG11  VAL  37          1HG1      VAL  37   0.777  11.838  13.806
  267   HG12  VAL  37          2HG1      VAL  37   0.775  13.597  13.688
  268   HG13  VAL  37          3HG1      VAL  37   1.473  12.810  15.103
  269   HG21  VAL  37          3HG2      VAL  37   4.393  13.954  13.067
  270   HG22  VAL  37          1HG2      VAL  37   3.649  14.081  14.660
  271   HG23  VAL  37          2HG2      VAL  37   2.872  14.827  13.262
  272    H    HIS  38           H        HIS  38   4.061  10.068  11.768
  273    HA   HIS  38           HA       HIS  38   1.806   8.231  12.105
  274    HB2  HIS  38           2HB      HIS  38   2.064   9.244   9.886
  275    HB3  HIS  38           1HB      HIS  38   3.707   8.619   9.777
  276    HD1  HIS  38           1HD      HIS  38   0.177   7.698   9.222
  277    HD2  HIS  38           2HD      HIS  38   3.863   5.787   9.387
  278    HE1  HIS  38           1HE      HIS  38  -0.201   5.409   8.241
  279    HE2  HIS  38           2HE      HIS  38   2.006   4.213   8.521
  280    H    ASP  39           H        ASP  39   5.320   8.230  11.599
  281    HA   ASP  39           HA       ASP  39   5.741   5.483  11.589
  282    HB2  ASP  39           2HB      ASP  39   7.476   7.829  12.241
  283    HB3  ASP  39           1HB      ASP  39   8.085   6.204  12.535
  284    H    VAL  40           H        VAL  40   5.431   7.667  14.334
  285    HA   VAL  40           HA       VAL  40   6.448   6.032  16.339
  286    HB   VAL  40           HB       VAL  40   5.850   8.399  16.680
  287   HG11  VAL  40          1HG1      VAL  40   3.003   7.406  16.696
  288   HG12  VAL  40          2HG1      VAL  40   3.733   8.492  15.511
  289   HG13  VAL  40          3HG1      VAL  40   3.524   9.020  17.183
  290   HG21  VAL  40          3HG2      VAL  40   6.215   6.958  18.609
  291   HG22  VAL  40          1HG2      VAL  40   4.508   6.509  18.609
  292   HG23  VAL  40          2HG2      VAL  40   4.982   8.171  18.957
  293    H    LYS  41           H        LYS  41   3.321   5.933  14.748
  294    HA   LYS  41           HA       LYS  41   2.430   3.811  16.564
  295    HB2  LYS  41           2HB      LYS  41   0.933   5.425  14.498
  296    HB3  LYS  41           1HB      LYS  41   0.225   4.108  15.423
  297    HG2  LYS  41           2HG      LYS  41   0.555   5.315  17.483
  298    HG3  LYS  41           1HG      LYS  41   1.407   6.602  16.626
  299    HD2  LYS  41           2HD      LYS  41  -1.462   5.822  16.121
  300    HD3  LYS  41           1HD      LYS  41  -0.957   7.150  17.167
  301    HE2  LYS  41           2HE      LYS  41   0.171   8.207  15.259
  302    HE3  LYS  41           1HE      LYS  41  -0.376   6.893  14.218
  303    HZ1  LYS  41           3HZ      LYS  41  -1.756   8.941  14.132
  304    HZ2  LYS  41           1HZ      LYS  41  -2.210   8.658  15.741
  305    HZ3  LYS  41           2HZ      LYS  41  -2.627   7.541  14.530
  306    H    ASP  42           H        ASP  42   3.508   4.424  13.353
  307    HA   ASP  42           HA       ASP  42   2.448   2.144  12.064
  308    HB2  ASP  42           2HB      ASP  42   3.444   4.199  10.958
  309    HB3  ASP  42           1HB      ASP  42   5.029   3.542  11.348
  310    H    VAL  43           H        VAL  43   5.611   2.775  13.560
  311    HA   VAL  43           HA       VAL  43   6.706   0.223  13.087
  312    HB   VAL  43           HB       VAL  43   7.352   2.162  15.321
  313   HG11  VAL  43          1HG1      VAL  43   8.187  -0.073  15.807
  314   HG12  VAL  43          2HG1      VAL  43   9.518   1.020  15.425
  315   HG13  VAL  43          3HG1      VAL  43   8.956  -0.143  14.223
  316   HG21  VAL  43          3HG2      VAL  43   7.608   3.168  13.113
  317   HG22  VAL  43          1HG2      VAL  43   8.611   1.810  12.599
  318   HG23  VAL  43          2HG2      VAL  43   9.181   2.899  13.865
  319    H    LEU  44           H        LEU  44   4.683   1.494  15.665
  320    HA   LEU  44           HA       LEU  44   4.902  -0.717  17.411
  321    HB2  LEU  44           2HB      LEU  44   2.701   1.319  17.092
  322    HB3  LEU  44           1HB      LEU  44   2.744   0.120  18.370
  323    HG   LEU  44           HG       LEU  44   4.746   2.337  17.937
  324   HD11  LEU  44          1HD1      LEU  44   2.693   1.889  20.101
  325   HD12  LEU  44          2HD1      LEU  44   2.621   3.114  18.834
  326   HD13  LEU  44          3HD1      LEU  44   3.884   3.189  20.063
  327   HD21  LEU  44          3HD2      LEU  44   5.825   0.315  18.794
  328   HD22  LEU  44          1HD2      LEU  44   4.634   0.230  20.095
  329   HD23  LEU  44          2HD2      LEU  44   5.766   1.582  20.020
  330    H    ASP  45           H        ASP  45   2.851  -0.049  14.643
  331    HA   ASP  45           HA       ASP  45   1.066  -2.213  14.972
  332    HB2  ASP  45           2HB      ASP  45   0.453  -0.491  13.449
  333    HB3  ASP  45           1HB      ASP  45   1.954  -0.654  12.545
  334    H    SER  46           H        SER  46   4.311  -1.996  13.760
  335    HA   SER  46           HA       SER  46   4.264  -4.639  12.579
  336    HB2  SER  46           2HB      SER  46   6.588  -2.766  13.074
  337    HB3  SER  46           1HB      SER  46   6.600  -4.193  12.035
  338    HG   SER  46           HG       SER  46   4.603  -2.823  11.153
  339    H    VAL  47           H        VAL  47   4.086  -3.784  15.638
  340    HA   VAL  47           HA       VAL  47   5.469  -6.210  16.498
  341    HB   VAL  47           HB       VAL  47   6.924  -4.178  16.967
  342   HG11  VAL  47          1HG1      VAL  47   5.223  -2.584  17.587
  343   HG12  VAL  47          2HG1      VAL  47   6.351  -2.812  18.925
  344   HG13  VAL  47          3HG1      VAL  47   4.762  -3.575  18.973
  345   HG21  VAL  47          3HG2      VAL  47   7.540  -4.919  19.224
  346   HG22  VAL  47          1HG2      VAL  47   7.266  -6.276  18.131
  347   HG23  VAL  47          2HG2      VAL  47   6.040  -5.841  19.320
  348    H    LEU  48           H        LEU  48   2.697  -5.026  16.005
  349    HA   LEU  48           HA       LEU  48   1.517  -5.436  18.666
  350    HB2  LEU  48           2HB      LEU  48   1.105  -3.245  17.578
  351    HB3  LEU  48           1HB      LEU  48   0.347  -4.080  16.236
  352    HG   LEU  48           HG       LEU  48  -1.371  -4.951  17.818
  353   HD11  LEU  48          1HD1      LEU  48  -0.057  -3.044  19.744
  354   HD12  LEU  48          2HD1      LEU  48  -0.115  -4.801  19.886
  355   HD13  LEU  48          3HD1      LEU  48  -1.600  -3.858  19.997
  356   HD21  LEU  48          3HD2      LEU  48  -2.589  -2.842  17.998
  357   HD22  LEU  48          1HD2      LEU  48  -1.807  -3.004  16.426
  358   HD23  LEU  48          2HD2      LEU  48  -1.105  -1.954  17.657