*HEADER    SIGNALING PROTEIN/PEPTIDE BINDING PROTEI04-NOV-09   2KQF              
*TITLE     SOLUTION STRUCTURE OF MAST205-PDZ COMPLEXED WITH THE C-TERMINUS OF A  
*TITLE    2 RABIES VIRUS G PROTEIN                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MICROTUBULE-ASSOCIATED SERINE/THREONINE-PROTEIN KINASE 2;  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: PDZ DOMAIN;                                                
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MOL_ID: 2;                                                           
*COMPND   7 MOLECULE: C-TERMINAL MOTIF FROM GLYCOPROTEIN;                        
*COMPND   8 CHAIN: B;                                                            
*COMPND   9 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: MAST205;                                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) STAR;                            
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PDEST15;                                  
*SOURCE  11 MOL_ID: 2;                                                           
*SOURCE  12 SYNTHETIC: YES;                                                      
*SOURCE  13 OTHER_DETAILS: SYNTHETIC PEPTIDE                                     
*KEYWDS    PDZ DOMAIN, MAST205, KINASE, PDZ COMPLEX AND VIRAL PEPTIDE, SIGNALING 
*KEYWDS   2 PROTEIN-PEPTIDE BINDING PROTEIN COMPLEX                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    E.TERRIEN, N.WOLFF, F.CORDIER, C.SIMENEL, A.BERNARD, M.LAFON,         
*AUTHOR   2 M.DELEPIERRE                                                         
*REVDAT   1   10-NOV-10 2KQF    0                                                


! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! angle_phi_psi_good.tab
!
! settings: min phiError=None, min psiError=None, errorFactor=2.0
!

! Talos derived phi restraint:
assign (resid   4 and name C)
       (resid   5 and name N)
       (resid   5 and name CA)
       (resid   5 and name C)
       1.0 -97  53 2

! Talos derived phi restraint:
assign (resid   6 and name C)
       (resid   7 and name N)
       (resid   7 and name CA)
       (resid   7 and name C)
       1.0 -69  19 2

! Talos derived phi restraint:
assign (resid   7 and name C)
       (resid   8 and name N)
       (resid   8 and name CA)
       (resid   8 and name C)
       1.0 -94  43 2

! Talos derived phi restraint:
assign (resid   8 and name C)
       (resid   9 and name N)
       (resid   9 and name CA)
       (resid   9 and name C)
       1.0 -97  31 2

! Talos derived phi restraint:
assign (resid   9 and name C)
       (resid  10 and name N)
       (resid  10 and name CA)
       (resid  10 and name C)
       1.0 -98  14 2

! Talos derived phi restraint:
assign (resid  10 and name C)
       (resid  11 and name N)
       (resid  11 and name CA)
       (resid  11 and name C)
       1.0 -102  46 2

! Talos derived phi restraint:
assign (resid  11 and name C)
       (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       1.0 -94  52 2

! Talos derived phi restraint:
assign (resid  19 and name C)
       (resid  20 and name N)
       (resid  20 and name CA)
       (resid  20 and name C)
       1.0 -110  34 2

! Talos derived phi restraint:
assign (resid  20 and name C)
       (resid  21 and name N)
       (resid  21 and name CA)
       (resid  21 and name C)
       1.0 -117  12 2

! Talos derived phi restraint:
assign (resid  21 and name C)
       (resid  22 and name N)
       (resid  22 and name CA)
       (resid  22 and name C)
       1.0 -124  18 2

! Talos derived phi restraint:
assign (resid  22 and name C)
       (resid  23 and name N)
       (resid  23 and name CA)
       (resid  23 and name C)
       1.0 -110  45 2

! Talos derived phi restraint:
assign (resid  23 and name C)
       (resid  24 and name N)
       (resid  24 and name CA)
       (resid  24 and name C)
       1.0 -131  32 2

! Talos derived phi restraint:
assign (resid  24 and name C)
       (resid  25 and name N)
       (resid  25 and name CA)
       (resid  25 and name C)
       1.0 -119  43 2

! Talos derived phi restraint:
assign (resid  25 and name C)
       (resid  26 and name N)
       (resid  26 and name CA)
       (resid  26 and name C)
       1.0 -113  42 2

! Talos derived phi restraint:
assign (resid  27 and name C)
       (resid  28 and name N)
       (resid  28 and name CA)
       (resid  28 and name C)
       1.0 -97  59 2

! Talos derived phi restraint:
assign (resid  33 and name C)
       (resid  34 and name N)
       (resid  34 and name CA)
       (resid  34 and name C)
       1.0 -124  45 2

! Talos derived phi restraint:
assign (resid  35 and name C)
       (resid  36 and name N)
       (resid  36 and name CA)
       (resid  36 and name C)
       1.0 -103  38 2

! Talos derived phi restraint:
assign (resid  36 and name C)
       (resid  37 and name N)
       (resid  37 and name CA)
       (resid  37 and name C)
       1.0 -120  22 2

! Talos derived phi restraint:
assign (resid  37 and name C)
       (resid  38 and name N)
       (resid  38 and name CA)
       (resid  38 and name C)
       1.0 -111  34 2

! Talos derived phi restraint:
assign (resid  38 and name C)
       (resid  39 and name N)
       (resid  39 and name CA)
       (resid  39 and name C)
       1.0 -126  28 2

! Talos derived phi restraint:
assign (resid  39 and name C)
       (resid  40 and name N)
       (resid  40 and name CA)
       (resid  40 and name C)
       1.0 -73  26 2

! Talos derived phi restraint:
assign (resid  40 and name C)
       (resid  41 and name N)
       (resid  41 and name CA)
       (resid  41 and name C)
       1.0 -102  41 2

! Talos derived phi restraint:
assign (resid  41 and name C)
       (resid  42 and name N)
       (resid  42 and name CA)
       (resid  42 and name C)
       1.0 -147  29 2

! Talos derived phi restraint:
assign (resid  42 and name C)
       (resid  43 and name N)
       (resid  43 and name CA)
       (resid  43 and name C)
       1.0 -119  36 2

! Talos derived phi restraint:
assign (resid  43 and name C)
       (resid  44 and name N)
       (resid  44 and name CA)
       (resid  44 and name C)
       1.0 -68  32 2

! Talos derived phi restraint:
assign (resid  47 and name C)
       (resid  48 and name N)
       (resid  48 and name CA)
       (resid  48 and name C)
       1.0 -82  29 2

! Talos derived phi restraint:
assign (resid  48 and name C)
       (resid  49 and name N)
       (resid  49 and name CA)
       (resid  49 and name C)
       1.0 -59   9 2

! Talos derived phi restraint:
assign (resid  50 and name C)
       (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       1.0 -62  13 2

! Talos derived phi restraint:
assign (resid  51 and name C)
       (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       1.0 -84  23 2

! Talos derived phi restraint:
assign (resid  53 and name C)
       (resid  54 and name N)
       (resid  54 and name CA)
       (resid  54 and name C)
       1.0 -80  30 2

! Talos derived phi restraint:
assign (resid  54 and name C)
       (resid  55 and name N)
       (resid  55 and name CA)
       (resid  55 and name C)
       1.0 -113  62 2

! Talos derived phi restraint:
assign (resid  55 and name C)
       (resid  56 and name N)
       (resid  56 and name CA)
       (resid  56 and name C)
       1.0 -61  25 2

! Talos derived phi restraint:
assign (resid  56 and name C)
       (resid  57 and name N)
       (resid  57 and name CA)
       (resid  57 and name C)
       1.0  91  19 2

! Talos derived phi restraint:
assign (resid  61 and name C)
       (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       1.0 -132  57 2

! Talos derived phi restraint:
assign (resid  62 and name C)
       (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
       1.0 -110  26 2

! Talos derived phi restraint:
assign (resid  63 and name C)
       (resid  64 and name N)
       (resid  64 and name CA)
       (resid  64 and name C)
       1.0  54  12 2

! Talos derived phi restraint:
assign (resid  64 and name C)
       (resid  65 and name N)
       (resid  65 and name CA)
       (resid  65 and name C)
       1.0  83  31 2

! Talos derived phi restraint:
assign (resid  65 and name C)
       (resid  66 and name N)
       (resid  66 and name CA)
       (resid  66 and name C)
       1.0 -101  32 2

! Talos derived phi restraint:
assign (resid  67 and name C)
       (resid  68 and name N)
       (resid  68 and name CA)
       (resid  68 and name C)
       1.0 -110  37 2

! Talos derived phi restraint:
assign (resid  68 and name C)
       (resid  69 and name N)
       (resid  69 and name CA)
       (resid  69 and name C)
       1.0 -71  43 2

! Talos derived phi restraint:
assign (resid  72 and name C)
       (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       1.0 -60  21 2

! Talos derived phi restraint:
assign (resid  73 and name C)
       (resid  74 and name N)
       (resid  74 and name CA)
       (resid  74 and name C)
       1.0 -63  10 2

! Talos derived phi restraint:
assign (resid  74 and name C)
       (resid  75 and name N)
       (resid  75 and name CA)
       (resid  75 and name C)
       1.0 -69  11 2

! Talos derived phi restraint:
assign (resid  75 and name C)
       (resid  76 and name N)
       (resid  76 and name CA)
       (resid  76 and name C)
       1.0 -65  13 2

! Talos derived phi restraint:
assign (resid  76 and name C)
       (resid  77 and name N)
       (resid  77 and name CA)
       (resid  77 and name C)
       1.0 -61  11 2

! Talos derived phi restraint:
assign (resid  77 and name C)
       (resid  78 and name N)
       (resid  78 and name CA)
       (resid  78 and name C)
       1.0 -59   9 2

! Talos derived phi restraint:
assign (resid  78 and name C)
       (resid  79 and name N)
       (resid  79 and name CA)
       (resid  79 and name C)
       1.0 -64   7 2

! Talos derived phi restraint:
assign (resid  79 and name C)
       (resid  80 and name N)
       (resid  80 and name CA)
       (resid  80 and name C)
       1.0 -66   8 2

! Talos derived phi restraint:
assign (resid  80 and name C)
       (resid  81 and name N)
       (resid  81 and name CA)
       (resid  81 and name C)
       1.0 -61  14 2

! Talos derived phi restraint:
assign (resid  81 and name C)
       (resid  82 and name N)
       (resid  82 and name CA)
       (resid  82 and name C)
       1.0 -68  12 2

! Talos derived phi restraint:
assign (resid  85 and name C)
       (resid  86 and name N)
       (resid  86 and name CA)
       (resid  86 and name C)
       1.0 -124  44 2

! Talos derived phi restraint:
assign (resid  86 and name C)
       (resid  87 and name N)
       (resid  87 and name CA)
       (resid  87 and name C)
       1.0 -136  36 2

! Talos derived phi restraint:
assign (resid  87 and name C)
       (resid  88 and name N)
       (resid  88 and name CA)
       (resid  88 and name C)
       1.0 -113  36 2

! Talos derived phi restraint:
assign (resid  88 and name C)
       (resid  89 and name N)
       (resid  89 and name CA)
       (resid  89 and name C)
       1.0 -115  35 2

! Talos derived phi restraint:
assign (resid  89 and name C)
       (resid  90 and name N)
       (resid  90 and name CA)
       (resid  90 and name C)
       1.0 -97  39 2

! Talos derived phi restraint:
assign (resid  90 and name C)
       (resid  91 and name N)
       (resid  91 and name CA)
       (resid  91 and name C)
       1.0 -123  36 2

! Talos derived phi restraint:
assign (resid  91 and name C)
       (resid  92 and name N)
       (resid  92 and name CA)
       (resid  92 and name C)
       1.0 -135  44 2

! Talos derived phi restraint:
assign (resid  92 and name C)
       (resid  93 and name N)
       (resid  93 and name CA)
       (resid  93 and name C)
       1.0 -73  37 2

! Talos derived phi restraint:
assign (resid  93 and name C)
       (resid  94 and name N)
       (resid  94 and name CA)
       (resid  94 and name C)
       1.0 -84  65 2

! Talos derived psi restraint:
assign (resid   5 and name N)
       (resid   5 and name CA)
       (resid   5 and name C)
       (resid   6 and name N)
       1.0 132  39 2

! Talos derived psi restraint:
assign (resid   7 and name N)
       (resid   7 and name CA)
       (resid   7 and name C)
       (resid   8 and name N)
       1.0 148  15 2

! Talos derived psi restraint:
assign (resid   8 and name N)
       (resid   8 and name CA)
       (resid   8 and name C)
       (resid   9 and name N)
       1.0 122  32 2

! Talos derived psi restraint:
assign (resid   9 and name N)
       (resid   9 and name CA)
       (resid   9 and name C)
       (resid  10 and name N)
       1.0 121  21 2

! Talos derived psi restraint:
assign (resid  10 and name N)
       (resid  10 and name CA)
       (resid  10 and name C)
       (resid  11 and name N)
       1.0 120  19 2

! Talos derived psi restraint:
assign (resid  11 and name N)
       (resid  11 and name CA)
       (resid  11 and name C)
       (resid  12 and name N)
       1.0 130  23 2

! Talos derived psi restraint:
assign (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       (resid  13 and name N)
       1.0 131  45 2

! Talos derived psi restraint:
assign (resid  20 and name N)
       (resid  20 and name CA)
       (resid  20 and name C)
       (resid  21 and name N)
       1.0 128  21 2

! Talos derived psi restraint:
assign (resid  21 and name N)
       (resid  21 and name CA)
       (resid  21 and name C)
       (resid  22 and name N)
       1.0 134  23 2

! Talos derived psi restraint:
assign (resid  22 and name N)
       (resid  22 and name CA)
       (resid  22 and name C)
       (resid  23 and name N)
       1.0 129  17 2

! Talos derived psi restraint:
assign (resid  23 and name N)
       (resid  23 and name CA)
       (resid  23 and name C)
       (resid  24 and name N)
       1.0 126  29 2

! Talos derived psi restraint:
assign (resid  24 and name N)
       (resid  24 and name CA)
       (resid  24 and name C)
       (resid  25 and name N)
       1.0 151  23 2

! Talos derived psi restraint:
assign (resid  25 and name N)
       (resid  25 and name CA)
       (resid  25 and name C)
       (resid  26 and name N)
       1.0 131  31 2

! Talos derived psi restraint:
assign (resid  26 and name N)
       (resid  26 and name CA)
       (resid  26 and name C)
       (resid  27 and name N)
       1.0 132  18 2

! Talos derived psi restraint:
assign (resid  28 and name N)
       (resid  28 and name CA)
       (resid  28 and name C)
       (resid  29 and name N)
       1.0 112  38 2

! Talos derived psi restraint:
assign (resid  34 and name N)
       (resid  34 and name CA)
       (resid  34 and name C)
       (resid  35 and name N)
       1.0 154  13 2

! Talos derived psi restraint:
assign (resid  36 and name N)
       (resid  36 and name CA)
       (resid  36 and name C)
       (resid  37 and name N)
       1.0 125  21 2

! Talos derived psi restraint:
assign (resid  37 and name N)
       (resid  37 and name CA)
       (resid  37 and name C)
       (resid  38 and name N)
       1.0 140  29 2

! Talos derived psi restraint:
assign (resid  38 and name N)
       (resid  38 and name CA)
       (resid  38 and name C)
       (resid  39 and name N)
       1.0 127  18 2

! Talos derived psi restraint:
assign (resid  39 and name N)
       (resid  39 and name CA)
       (resid  39 and name C)
       (resid  40 and name N)
       1.0 125  14 2

! Talos derived psi restraint:
assign (resid  40 and name N)
       (resid  40 and name CA)
       (resid  40 and name C)
       (resid  41 and name N)
       1.0 121  14 2

! Talos derived psi restraint:
assign (resid  41 and name N)
       (resid  41 and name CA)
       (resid  41 and name C)
       (resid  42 and name N)
       1.0 -37  19 2

! Talos derived psi restraint:
assign (resid  42 and name N)
       (resid  42 and name CA)
       (resid  42 and name C)
       (resid  43 and name N)
       1.0 146  24 2

! Talos derived psi restraint:
assign (resid  43 and name N)
       (resid  43 and name CA)
       (resid  43 and name C)
       (resid  44 and name N)
       1.0 129  25 2

! Talos derived psi restraint:
assign (resid  44 and name N)
       (resid  44 and name CA)
       (resid  44 and name C)
       (resid  45 and name N)
       1.0 136  29 2

! Talos derived psi restraint:
assign (resid  48 and name N)
       (resid  48 and name CA)
       (resid  48 and name C)
       (resid  49 and name N)
       1.0 163  44 2

! Talos derived psi restraint:
assign (resid  49 and name N)
       (resid  49 and name CA)
       (resid  49 and name C)
       (resid  50 and name N)
       1.0 -35  11 2

! Talos derived psi restraint:
assign (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       (resid  52 and name N)
       1.0 -30  28 2

! Talos derived psi restraint:
assign (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       (resid  53 and name N)
       1.0 -11  52 2

! Talos derived psi restraint:
assign (resid  54 and name N)
       (resid  54 and name CA)
       (resid  54 and name C)
       (resid  55 and name N)
       1.0 138  18 2

! Talos derived psi restraint:
assign (resid  55 and name N)
       (resid  55 and name CA)
       (resid  55 and name C)
       (resid  56 and name N)
       1.0 142  38 2

! Talos derived psi restraint:
assign (resid  56 and name N)
       (resid  56 and name CA)
       (resid  56 and name C)
       (resid  57 and name N)
       1.0 129  10 2

! Talos derived psi restraint:
assign (resid  57 and name N)
       (resid  57 and name CA)
       (resid  57 and name C)
       (resid  58 and name N)
       1.0 -12  22 2

! Talos derived psi restraint:
assign (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       (resid  63 and name N)
       1.0 152  24 2

! Talos derived psi restraint:
assign (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
       (resid  64 and name N)
       1.0 128  24 2

! Talos derived psi restraint:
assign (resid  64 and name N)
       (resid  64 and name CA)
       (resid  64 and name C)
       (resid  65 and name N)
       1.0  40  11 2

! Talos derived psi restraint:
assign (resid  65 and name N)
       (resid  65 and name CA)
       (resid  65 and name C)
       (resid  66 and name N)
       1.0  -2  37 2

! Talos derived psi restraint:
assign (resid  66 and name N)
       (resid  66 and name CA)
       (resid  66 and name C)
       (resid  67 and name N)
       1.0 125  44 2

! Talos derived psi restraint:
assign (resid  68 and name N)
       (resid  68 and name CA)
       (resid  68 and name C)
       (resid  69 and name N)
       1.0  14  45 2

! Talos derived psi restraint:
assign (resid  69 and name N)
       (resid  69 and name CA)
       (resid  69 and name C)
       (resid  70 and name N)
       1.0 137  22 2

! Talos derived psi restraint:
assign (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       (resid  74 and name N)
       1.0 -44  16 2

! Talos derived psi restraint:
assign (resid  74 and name N)
       (resid  74 and name CA)
       (resid  74 and name C)
       (resid  75 and name N)
       1.0 -35  14 2

! Talos derived psi restraint:
assign (resid  75 and name N)
       (resid  75 and name CA)
       (resid  75 and name C)
       (resid  76 and name N)
       1.0 -39  17 2

! Talos derived psi restraint:
assign (resid  76 and name N)
       (resid  76 and name CA)
       (resid  76 and name C)
       (resid  77 and name N)
       1.0 -43  14 2

! Talos derived psi restraint:
assign (resid  77 and name N)
       (resid  77 and name CA)
       (resid  77 and name C)
       (resid  78 and name N)
       1.0 -43  14 2

! Talos derived psi restraint:
assign (resid  78 and name N)
       (resid  78 and name CA)
       (resid  78 and name C)
       (resid  79 and name N)
       1.0 -42   6 2

! Talos derived psi restraint:
assign (resid  79 and name N)
       (resid  79 and name CA)
       (resid  79 and name C)
       (resid  80 and name N)
       1.0 -43  10 2

! Talos derived psi restraint:
assign (resid  80 and name N)
       (resid  80 and name CA)
       (resid  80 and name C)
       (resid  81 and name N)
       1.0 -40   5 2

! Talos derived psi restraint:
assign (resid  81 and name N)
       (resid  81 and name CA)
       (resid  81 and name C)
       (resid  82 and name N)
       1.0 -43  13 2

! Talos derived psi restraint:
assign (resid  82 and name N)
       (resid  82 and name CA)
       (resid  82 and name C)
       (resid  83 and name N)
       1.0 -23  24 2

! Talos derived psi restraint:
assign (resid  86 and name N)
       (resid  86 and name CA)
       (resid  86 and name C)
       (resid  87 and name N)
       1.0 149  23 2

! Talos derived psi restraint:
assign (resid  87 and name N)
       (resid  87 and name CA)
       (resid  87 and name C)
       (resid  88 and name N)
       1.0 135  40 2

! Talos derived psi restraint:
assign (resid  88 and name N)
       (resid  88 and name CA)
       (resid  88 and name C)
       (resid  89 and name N)
       1.0 127  27 2

! Talos derived psi restraint:
assign (resid  89 and name N)
       (resid  89 and name CA)
       (resid  89 and name C)
       (resid  90 and name N)
       1.0 117  14 2

! Talos derived psi restraint:
assign (resid  90 and name N)
       (resid  90 and name CA)
       (resid  90 and name C)
       (resid  91 and name N)
       1.0 132  39 2

! Talos derived psi restraint:
assign (resid  91 and name N)
       (resid  91 and name CA)
       (resid  91 and name C)
       (resid  92 and name N)
       1.0 150  25 2

! Talos derived psi restraint:
assign (resid  92 and name N)
       (resid  92 and name CA)
       (resid  92 and name C)
       (resid  93 and name N)
       1.0 140  23 2

! Talos derived psi restraint:
assign (resid  93 and name N)
       (resid  93 and name CA)
       (resid  93 and name C)
       (resid  94 and name N)
       1.0 142  18 2

! Talos derived psi restraint:
assign (resid  94 and name N)
       (resid  94 and name CA)
       (resid  94 and name C)
       (resid  95 and name N)
       1.0 133  22 2

assign (resid  4   and name C ) (resid  5  and name N)
       (resid  5   and name CA) (resid  5  and name C)  5.50  0.00629

assign (resid  8   and name C ) (resid  9  and name N)
       (resid  9   and name CA) (resid  9  and name C)  6.67  0.00324

assign (resid  9   and name C ) (resid  10  and name N)
       (resid  10   and name CA) (resid  10  and name C)  7.15  0.00517

assign (resid  10   and name C ) (resid  11  and name N)
       (resid  11   and name CA) (resid  11  and name C)  7.10  0.00471

assign (resid  11   and name C ) (resid  12  and name N)
       (resid  12   and name CA) (resid  12  and name C)  4.89  0.00297

assign (resid  15   and name C ) (resid  16  and name N)
       (resid  16   and name CA) (resid  16  and name C)  6.99  0.00309

assign (resid  16   and name C ) (resid  17  and name N)
       (resid  17   and name CA) (resid  17  and name C)  6.30  0.01598

assign (resid  18   and name C ) (resid  19  and name N)
       (resid  19   and name CA) (resid  19  and name C)  4.32  0.00201

assign (resid  19   and name C ) (resid  20  and name N)
       (resid  20   and name CA) (resid  20  and name C)  7.39  0.01079

assign (resid  20   and name C ) (resid  21  and name N)
       (resid  21   and name CA) (resid  21  and name C)  7.22  0.01301

assign (resid  21   and name C ) (resid  22  and name N)
       (resid  22   and name CA) (resid  22  and name C)  4.28  0.00678

assign (resid  23   and name C ) (resid  24  and name N)
       (resid  24   and name CA) (resid  24  and name C)  8.15  0.05839

assign (resid  25   and name C ) (resid  26  and name N)
       (resid  26   and name CA) (resid  26  and name C)  6.31  0.02124

assign (resid  26   and name C ) (resid  27  and name N)
       (resid  27   and name CA) (resid  27  and name C)  6.80  0.04648

assign (resid  30   and name C ) (resid  31  and name N)
       (resid  31   and name CA) (resid  31  and name C)  5.88  0.00410

assign (resid  31   and name C ) (resid  32  and name N)
       (resid  32   and name CA) (resid  32  and name C)  6.34  0.01122

assign (resid  32   and name C ) (resid  33  and name N)
       (resid  33   and name CA) (resid  33  and name C)  6.64  0.00508

assign (resid  35   and name C ) (resid  36  and name N)
       (resid  36   and name CA) (resid  36  and name C)  6.45  0.01295

assign (resid  37   and name C ) (resid  38  and name N)
       (resid  38   and name CA) (resid  38  and name C)  6.19  0.02112

assign (resid  38   and name C ) (resid  39  and name N)
       (resid  39   and name CA) (resid  39  and name C)  6.01  0.01112

assign (resid  39   and name C ) (resid  40  and name N)
       (resid  40   and name CA) (resid  40  and name C)  5.70  0.02502

assign (resid  40   and name C ) (resid  41  and name N)
       (resid  41   and name CA) (resid  41  and name C)  5.30  0.01506

assign (resid  41   and name C ) (resid  42  and name N)
       (resid  42   and name CA) (resid  42  and name C)  5.51  0.00324

assign (resid  43   and name C ) (resid  44  and name N)
       (resid  44   and name CA) (resid  44  and name C)  4.09  0.00407

assign (resid  48   and name C ) (resid  49  and name N)
       (resid  49   and name CA) (resid  49  and name C)  3.22  0.00245

assign (resid  50   and name C ) (resid  51  and name N)
       (resid  51   and name CA) (resid  51  and name C)  3.51  0.00171

assign (resid  53   and name C ) (resid  54  and name N)
       (resid  54   and name CA) (resid  54  and name C)  4.48  0.00217

assign (resid  54   and name C ) (resid  55  and name N)
       (resid  55   and name CA) (resid  55  and name C)  6.73  0.00907

assign (resid  55   and name C ) (resid  56  and name N)
       (resid  56   and name CA) (resid  56  and name C)  2.76  0.00236

assign (resid  56   and name C ) (resid  57  and name N)
       (resid  57   and name CA) (resid  57  and name C)  6.33  0.01440

assign (resid  60   and name C ) (resid  61  and name N)
       (resid  61   and name CA) (resid  61  and name C)  8.43  0.02067

assign (resid  63   and name C ) (resid  64  and name N)
       (resid  64   and name CA) (resid  64  and name C)  5.10  0.00467

assign (resid  65   and name C ) (resid  66  and name N)
       (resid  66   and name CA) (resid  66  and name C)  6.01  0.00239

assign (resid  67   and name C ) (resid  68  and name N)
       (resid  68   and name CA) (resid  68  and name C)  7.27  0.00877

assign (resid  68   and name C ) (resid  69  and name N)
       (resid  69   and name CA) (resid  69  and name C)  2.13  0.00357

assign (resid  70   and name C ) (resid  71  and name N)
       (resid  71   and name CA) (resid  71  and name C)  6.21  0.01004

assign (resid  71   and name C ) (resid  72  and name N)
       (resid  72   and name CA) (resid  72  and name C)  6.99  0.01534

assign (resid  74   and name C ) (resid  75  and name N)
       (resid  75   and name CA) (resid  75  and name C)  5.35  0.00429

assign (resid  75   and name C ) (resid  76  and name N)
       (resid  76   and name CA) (resid  76  and name C)  4.76  0.00309

assign (resid  78   and name C ) (resid  79  and name N)
       (resid  79   and name CA) (resid  79  and name C)  3.18  0.00182

assign (resid  80   and name C ) (resid  81  and name N)
       (resid  81   and name CA) (resid  81  and name C)  3.22  0.00286

assign (resid  81   and name C ) (resid  82  and name N)
       (resid  82   and name CA) (resid  82  and name C)  4.24  0.00173

assign (resid  82   and name C ) (resid  83  and name N)
       (resid  83   and name CA) (resid  83  and name C)  4.28  0.00181

assign (resid  85   and name C ) (resid  86  and name N)
       (resid  86   and name CA) (resid  86  and name C)  5.43  0.00161

assign (resid  87   and name C ) (resid  88  and name N)
       (resid  88   and name CA) (resid  88  and name C)  7.05  0.00559

assign (resid  88   and name C ) (resid  89  and name N)
       (resid  89   and name CA) (resid  89  and name C)  7.17  0.00627

assign (resid  91   and name C ) (resid  92  and name N)
       (resid  92   and name CA) (resid  92  and name C)  6.37  0.00748

assign (resid  93   and name C ) (resid  94  and name N)
       (resid  94   and name CA) (resid  94  and name C)  5.04  0.00355

assign (resid  94   and name C ) (resid  95  and name N)
       (resid  95   and name CA) (resid  95  and name C)  6.59  0.00633

assign (resid  95   and name C ) (resid  96  and name N)
       (resid  96   and name CA) (resid  96  and name C)  6.43  0.00102

!inter    
assign (resid   80 and name HD1#) (resid  113  and name   HG) 4.820   3.02    1.18  weight 1.000 
assign (resid   80 and name HD1#) (resid  113  and name HD1#) 3.650   1.85    2.35  weight 1.000 
assign (resid   80 and name HD1#) (resid  113  and name HD2#) 4.650   2.85    1.35  weight 1.000 
assign (resid   80 and name   HB) (resid  113  and name HD1#) 4.480   2.680   1.52  weight 1.000 
assign (resid   80 and name HG2#) (resid  113  and name   HG) 4.456   2.656   1.544  weight 1.000 
assign (resid   80 and name HG2#) (resid  113  and name HD1#) 3.038   1.238   2.962  weight 1.000 
assign (resid   80 and name HG2#) (resid  113  and name HD2#) 4.741   2.941   1.259  weight 1.000 
assign (resid   21 and name   HG) (resid  113  and name HD1#) 4.396   2.596   1.604  weight 1.000 
assign (resid   21 and name  HB2) (resid  113  and name HD1#) 4.465   2.665   1.535  weight 1.000 
assign (resid   21 and name  HB1) (resid  113  and name HD2#) 4.994   3.194   1.006  weight 1.000 
assign (resid   21 and name  HB1) (resid  113  and name HD1#) 4.454   2.654   1.546  weight 1.000 
assign (resid   21 and name  HB2) (resid  113  and name HD2#) 4.844   3.044   1.156  weight 1.000 
assign (resid   20 and name HG2#) (resid  112  and name   HA) 3.813   2.013   2.187  weight 1.000 
assign (resid   20 and name HG2#) (resid  112  and name  HB#) 3.38    1.58    2.62  weight 1.000 
assign (resid   20 and name HG2#) (resid  112  and name  HD#) 2.907   1.107   3.093  weight 1.000 
assign (resid   20 and name HG2#) (resid  113  and name   HN) 4.994   3.194   1.006  weight 1.000 
assign (resid   20 and name HG2#) (resid  110  and name  HG#) 3.20    1.4     2.8  weight 1.000 
assign (resid   20 and name HG2#) (resid  110  and name  HB1) 3.38    1.58    2.62  weight 1.000 
assign (resid   20 and name HG2#) (resid  110  and name  HB2) 3.38    1.58    2.62  weight 1.000 
assign (resid   77 and name   HA) (resid  111  and name HG2#) 4.972   3.172   1.028  weight 1.000 
assign (resid   77 and name   HA) (resid  113  and name HD1#) 4.064   2.264   1.936  weight 1.000 
assign (resid   77 and name HG1#) (resid  113  and name HD1#) 3.554   1.754   2.446  weight 1.000 
assign (resid   77 and name HG1#) (resid  113  and name   HG) 4.989   3.189   1.011  weight 1.000 
assign (resid   77 and name HG1#) (resid  111  and name HG2#) 1.800   0.000   0.700  weight 1.000 
assign (resid   77 and name HG2#) (resid  113  and name HD2#) 4.791   2.991   1.209  weight 1.000 
assign (resid   77 and name HG2#) (resid  113  and name HD1#) 3.532   1.732   2.468  weight 1.000 
assign (resid   77 and name HG2#) (resid  111  and name HG2#) 3.055   1.255   2.945  weight 1.000 
assign (resid   77 and name HG2#) (resid  111  and name   HA) 4.346   2.546   1.654  weight 1.000 
assign (resid   77 and name HG2#) (resid  113  and name HD1#) 4.831   3.031   1.169  weight 1.000 
assign (resid   77 and name HG2#) (resid  111  and name   HB) 4.714   2.914   1.286  weight 1.000 
assign (resid   17 and name  HB2) (resid  113  and name  HB#) 4.978   3.178   1.022  weight 1.000 
assign (resid   17 and name  HB1) (resid  113  and name  HB#) 4.885   3.085   1.115  weight 1.000 
assign (resid   17 and name  HE#) (resid  113  and name   HG) 4.504   2.704   1.496  weight 1.000 
assign (resid   17 and name  HD2) (resid  113  and name   HG) 3.730   1.930   2.27  weight 1.000 
assign (resid   17 and name  HD2) (resid  113  and name HD1#) 4.527   2.727   1.473  weight 1.000 
assign (resid   17 and name  HB1) (resid  113  and name HD1#) 5.00    3.2     1          weight 1.000 
assign (resid   17 and name  HE#) (resid  113  and name HD1#) 4.84    3.04    1.16  weight 1.000 
assign (resid   19 and name  HE#) (resid  113  and name   HG) 4.652   2.852   1.348  weight 1.000 
assign (resid   19 and name  HE#) (resid  113  and name HD1#) 4.697   2.897   1.303  weight 1.000 
assign (resid   19 and name  HD#) (resid  113  and name   HG) 4.666   2.866   1.334  weight 1.000 
assign (resid   19 and name  HD#) (resid  113  and name HD1#) 4.712   2.912   1.288  weight 1.000 
assign (resid   19 and name   HN) (resid  113  and name   HG) 4.283   2.483   1.717      weight 1.000   
assign (resid   19 and name   HN) (resid  113  and name HD1#) 4.712   2.912   1.288      weight 1.000   
assign (resid   22 and name   HA) (resid  110  and name   HA) 2.80    2.7     1.5  weight 1.000 
assign (resid   22 and name   HA) (resid  110  and name  HG#) 4.94    3.14    1.06  weight 1.000 
assign (resid   22 and name   HA) (resid  110  and name  HB#) 4.93    3.13    1.07  weight 1.000 
assign (resid   22 and name   HA) (resid  112  and name  HB#) 4.90    3.1     1.1  weight 1.000 
assign (resid   77 and name   HN) (resid  113  and name   HG) 3.534   1.734   2.466  weight 1.000 
assign (resid   77 and name   HN) (resid  113  and name HD1#) 3.731   1.931   2.269  weight 1.000 
assign (resid   77 and name   HN) (resid  113  and name HD2#) 4.823   3.023   1.177  weight 1.000 
assign (resid   21 and name   HN) (resid  113  and name   HG) 4.879   3.079   1.121  weight 1.000 
assign (resid   21 and name   HN) (resid  111  and name HG2#) 4.754   2.954   1.246  weight 1.000 
assign (resid   21 and name   HN) (resid  112  and name   HA) 3.999   2.199   2.001  weight 1.000 
assign (resid   21 and name   HN) (resid  113  and name HD1#) 4.32    2.52    1.68       weight 1.000   
assign (resid   21 and name   HN) (resid  113  and name HD2#) 5.00    3.2     1          weight 1.000
assign (resid   17 and name   HN) (resid  113  and name   HG) 4.547   2.747   1.453  weight 1.000
assign (resid   73 and name  HD2) (resid  109  and name  HA#) 4.790   2.990   1.210  weight 1.000
assign (resid   24 and name HG2#) (resid  104  and name   HA) 4.800   3.000   1.200  weight 1.000
assign (resid   24 and name HG2#) (resid  104  and name  HB#) 4.800   3.000   1.200  weight 1.000
assign (resid   24 and name HG2#) (resid  102  and name  HE3) 4.930   3.130   1.070  weight 1.000
assign (resid   24 and name HG2#) (resid  102  and name  HZ3) 4.900   3.100   1.100  weight 1.000
assign (resid   24 and name HG2#) (resid  102  and name  HZ2) 4.850   3.050   1.150  weight 1.000
assign (resid   24 and name HG2#) (resid  102  and name  HD1) 4.850   3.050   1.150  weight 1.000
assign (resid   24 and name HD1#) (resid  102  and name  HB#) 4.270   2.470   1.730  weight 1.000
assign (resid   24 and name HD1#) (resid  102  and name  HD1) 4.900   3.100   1.100  weight 1.000
assign (resid   24 and name HD1#) (resid  102  and name  HE3) 4.930   3.130   1.070  weight 1.000
assign (resid   24 and name HD1#) (resid  102  and name  HZ2) 4.900   3.100   1.100  weight 1.000
assign (resid   24 and name HD1#) (resid  102  and name  HZ3) 4.930   3.130   1.070  weight 1.000
assign (resid   24 and name HG2#) (resid  105  and name  HB#) 4.810   3.010   1.190  weight 1.000 
assign (resid   26 and name HG1#) (resid  102  and name  HB#) 4.450   2.650   1.550  weight 1.000 
assign (resid   26 and name HG1#) (resid  102  and name  HZ3) 4.950   3.150   1.050  weight 1.000 
assign (resid   26 and name HG2#) (resid  102  and name  HB#) 4.880   3.080   1.120  weight 1.000 
assign (resid   23 and name  HB1) (resid  105  and name  HB#) 4.750   2.950   1.250  weight 1.000 
assign (resid   23 and name  HB1) (resid  108  and name  HA#) 4.190   2.390   1.810  weight 1.000 
assign (resid   41 and name  HH2) (resid  102  and name  HH2) 4.950   3.150   1.050  weight 1.000 
assign (resid   41 and name  HH2) (resid  102  and name  HZ3) 4.950   3.150   1.050  weight 1.000 
assign (resid   41 and name  HZ2) (resid  102  and name  HZ3) 4.900   3.100   1.100  weight 1.000 

!intra
assign (resid 91 and name   HB) (resid   91 and name   HA) 2.497 0.780 0.780 weight 1.000
assign (resid 91 and name   HB) (resid   91 and name HG21) 2.228 0.620 0.620 weight 1.000
    or (resid 91 and name   HB) (resid   91 and name HG22)
    or (resid 91 and name   HB) (resid   91 and name HG23)
assign (resid 36 and name   HN) (resid   35 and name   HB) 2.597 0.843 0.843 weight 1.000
assign (resid 20 and name   HB) (resid   42 and name  HB2) 2.686 0.902 0.902 weight 1.000
assign (resid 20 and name   HB) (resid   42 and name  HB1) 2.547 0.811 0.811 weight 1.000
assign (resid 20 and name   HB) (resid   20 and name HG21) 2.285 0.653 0.653 weight 1.000
    or (resid 20 and name   HB) (resid   20 and name HG22)
    or (resid 20 and name   HB) (resid   20 and name HG23)
assign (resid 92 and name   HB) (resid   61 and name HG21) 1.987 0.493 0.493 weight 1.000
    or (resid 92 and name   HB) (resid   61 and name HG22)
    or (resid 92 and name   HB) (resid   61 and name HG23)
assign (resid 35 and name   HB) (resid   35 and name HG21) 2.058 0.529 0.529 weight 1.000
    or (resid 35 and name   HB) (resid   35 and name HG22)
    or (resid 35 and name   HB) (resid   35 and name HG23)
assign (resid 77 and name   HN) (resid   77 and name   HA) 2.368 0.701 0.701 weight 1.000
assign (resid 76 and name   HN) (resid   76 and name   HA) 2.319 0.672 0.672 weight 1.000
assign (resid 74 and name   HB) (resid   74 and name   HA) 2.244 0.630 0.630 weight 1.000
assign (resid 77 and name   HA) (resid   77 and name   HB) 2.209 0.610 0.610 weight 1.000
assign (resid 76 and name   HA) (resid   79 and name  HB2) 2.313 0.669 0.669 weight 1.000
assign (resid 76 and name   HA) (resid   76 and name   HB) 2.454 0.753 0.753 weight 1.000
assign (resid 74 and name   HB) (resid   74 and name HG21) 1.990 0.495 0.495 weight 1.000
    or (resid 74 and name   HB) (resid   74 and name HG22)
    or (resid 74 and name   HB) (resid   74 and name HG23)
assign (resid 61 and name   HB) (resid   61 and name HG21) 2.140 0.572 0.572 weight 1.000
    or (resid 61 and name   HB) (resid   61 and name HG22)
    or (resid 61 and name   HB) (resid   61 and name HG23)
assign (resid 77 and name   HA) (resid   77 and name HG12) 1.914 0.458 0.458 weight 1.000
    or (resid 77 and name   HA) (resid   77 and name HG11)
    or (resid 77 and name   HA) (resid   77 and name HG13)
assign (resid 77 and name   HA) (resid   77 and name HG22) 2.050 0.526 0.526 weight 1.000
    or (resid 77 and name   HA) (resid   77 and name HG21)
    or (resid 77 and name   HA) (resid   77 and name HG23)
assign (resid 76 and name   HA) (resid   76 and name HG12) 2.178 0.593 0.593 weight 1.000
    or (resid 76 and name   HA) (resid   76 and name HG11)
    or (resid 76 and name   HA) (resid   76 and name HG13)
assign (resid 77 and name   HN) (resid   74 and name   HA) 2.592 0.840 0.840 weight 1.000
assign (resid 80 and name   HN) (resid   80 and name   HA) 2.406 0.724 0.724 weight 1.000
assign (resid 31 and name  HB1) (resid   31 and name  HB2) 1.897 0.450 0.450 weight 1.000
assign (resid 48 and name   HA) (resid   48 and name  HB2) 2.368 0.701 0.701 weight 1.000
assign (resid 48 and name   HA) (resid   48 and name  HG1) 2.215 0.613 0.613 weight 1.000
assign (resid 74 and name   HA) (resid   77 and name   HB) 2.150 0.578 0.578 weight 1.000
assign (resid 74 and name   HA) (resid   74 and name HG21) 2.139 0.572 0.572 weight 1.000
    or (resid 74 and name   HA) (resid   74 and name HG22)
    or (resid 74 and name   HA) (resid   74 and name HG23)
assign (resid 80 and name   HA) (resid   80 and name HG22) 1.960 0.480 0.480 weight 1.000
    or (resid 80 and name   HA) (resid   80 and name HG21)
    or (resid 80 and name   HA) (resid   80 and name HG23)
assign (resid 76 and name   HA) (resid   71 and name HD22) 2.071 0.536 0.536 weight 1.000
    or (resid 76 and name   HA) (resid   71 and name HD21)
    or (resid 76 and name   HA) (resid   71 and name HD23)
    or (resid 76 and name   HA) (resid   71 and name HD12)
    or (resid 76 and name   HA) (resid   71 and name HD11)
    or (resid 76 and name   HA) (resid   71 and name HD13)
assign (resid 74 and name   HA) (resid   77 and name HG22) 2.409 0.725 0.725 weight 1.000
    or (resid 74 and name   HA) (resid   77 and name HG21)
    or (resid 74 and name   HA) (resid   77 and name HG23)
assign (resid 40 and name   HN) (resid   40 and name   HA) 2.215 0.613 0.613 weight 1.000
assign (resid 61 and name   HN) (resid   60 and name   HA) 2.310 0.667 0.667 weight 1.000
assign (resid 50 and name  HB1) (resid   50 and name   HN) 2.534 0.803 0.803 weight 1.000
assign (resid 50 and name   HN) (resid   50 and name  HB2) 2.499 0.781 0.781 weight 1.000
assign (resid 34 and name   HN) (resid   33 and name   HA) 2.011 0.506 0.506 weight 1.000
assign (resid 83 and name  HB2) (resid   83 and name   HN) 2.547 0.811 0.811 weight 1.000
assign (resid 67 and name   HA) (resid   67 and name  HB2) 2.229 0.621 0.621 weight 1.000
    or (resid 67 and name   HA) (resid   67 and name  HB1)
assign (resid  7 and name   HA) (resid    7 and name  HB2) 2.227 0.620 0.620 weight 1.000
assign (resid 83 and name  HB2) (resid   87 and name   HB) 2.568 0.824 0.824 weight 1.000
assign (resid 33 and name   HA) (resid   33 and name   HB) 2.437 0.742 0.742 weight 1.000
assign (resid 60 and name   HA) (resid   60 and name   HB) 2.406 0.724 0.724 weight 1.000
assign (resid 83 and name  HB1) (resid   87 and name HG22) 2.563 0.821 0.821 weight 1.000
    or (resid 83 and name  HB1) (resid   87 and name HG21)
    or (resid 83 and name  HB1) (resid   87 and name HG23)
assign (resid 33 and name   HA) (resid   33 and name HG22) 1.951 0.476 0.476 weight 1.000
    or (resid 33 and name   HA) (resid   33 and name HG21)
    or (resid 33 and name   HA) (resid   33 and name HG23)
assign (resid 60 and name   HA) (resid   60 and name HG22) 1.948 0.474 0.474 weight 1.000
    or (resid 60 and name   HA) (resid   60 and name HG21)
    or (resid 60 and name   HA) (resid   60 and name HG23)
assign (resid 64 and name   HN) (resid   63 and name   HA) 2.495 0.778 0.778 weight 1.000
assign (resid 92 and name   HN) (resid   91 and name   HA) 2.247 0.631 0.631 weight 1.000
assign (resid 81 and name   HN) (resid   78 and name   HA) 2.621 0.859 0.859 weight 1.000
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assign (resid 78 and name   HA) (resid   78 and name  HG2) 2.325 0.676 0.676 weight 1.000
assign (resid  6 and name   HA) (resid    6 and name  HB1) 2.519 0.793 0.793 weight 1.000
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assign (resid 79 and name  HB1) (resid   79 and name   HA) 2.454 0.753 0.753 weight 1.000
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    or (resid 71 and name  HB1) (resid   71 and name HD12)
    or (resid 71 and name  HB1) (resid   71 and name HD11)
    or (resid 71 and name  HB1) (resid   71 and name HD13)
assign (resid 89 and name   HB) (resid   89 and name HD12) 2.210 0.610 0.610 weight 1.000
    or (resid 89 and name   HB) (resid   89 and name HD11)
    or (resid 89 and name   HB) (resid   89 and name HD13)
assign (resid 94 and name  HB1) (resid   94 and name HD12) 1.998 0.499 0.499 weight 1.000
    or (resid 94 and name  HB1) (resid   94 and name HD11)
    or (resid 94 and name  HB1) (resid   94 and name HD13)
assign (resid 80 and name   HB) (resid   81 and name   HN) 2.464 0.759 0.759 weight 1.000
assign (resid 60 and name   HN) (resid   60 and name   HB) 2.558 0.818 0.818 weight 1.000
assign (resid 34 and name  HB1) (resid   34 and name  HB2) 2.409 0.725 0.725 weight 1.000
assign (resid  9 and name   HB) (resid    9 and name HG12) 2.066 0.533 0.533 weight 1.000
assign (resid 80 and name   HB) (resid   80 and name HG22) 1.952 0.476 0.476 weight 1.000
    or (resid 80 and name   HB) (resid   80 and name HG21)
    or (resid 80 and name   HB) (resid   80 and name HG23)
assign (resid 60 and name   HB) (resid   60 and name HG22) 1.969 0.485 0.485 weight 1.000
    or (resid 60 and name   HB) (resid   60 and name HG21)
    or (resid 60 and name   HB) (resid   60 and name HG23)
assign (resid  8 and name   HB) (resid    8 and name HG22) 1.853 0.429 0.429 weight 1.000
    or (resid  8 and name   HB) (resid    8 and name HG21)
    or (resid  8 and name   HB) (resid    8 and name HG23)
assign (resid  9 and name   HN) (resid    9 and name   HB) 2.163 0.585 0.585 weight 1.000
assign (resid 51 and name  HG1) (resid   51 and name   HN) 2.585 0.835 0.835 weight 1.000
assign (resid 64 and name HD21) (resid   64 and name  HB2) 2.301 0.662 0.662 weight 1.000
    or (resid 64 and name HD21) (resid   64 and name  HB1)
assign (resid 42 and name  HB1) (resid   42 and name  HB2) 2.212 0.612 0.612 weight 1.000
assign (resid 62 and name  HB2) (resid   62 and name  HB1) 2.353 0.692 0.692 weight 1.000
assign (resid 22 and name  HB2) (resid   22 and name  HB1) 2.014 0.507 0.507 weight 1.000
assign (resid 86 and name  HB1) (resid   86 and name  HB2) 1.800 0.405 0.405 weight 1.000
assign (resid 66 and name  HG2) (resid   79 and name HD22) 2.632 0.866 0.866 weight 1.000
    or (resid 66 and name  HG2) (resid   79 and name HD21)
    or (resid 66 and name  HG2) (resid   79 and name HD23)
    or (resid 66 and name  HG2) (resid   79 and name HD12)
    or (resid 66 and name  HG2) (resid   79 and name HD11)
    or (resid 66 and name  HG2) (resid   79 and name HD13)
assign (resid 55 and name   HN) (resid   55 and name  HB2) 2.359 0.695 0.695 weight 1.000
    or (resid 55 and name   HN) (resid   55 and name  HB1)
assign (resid 41 and name  HB2) (resid   41 and name  HB1) 2.337 0.683 0.683 weight 1.000
assign (resid 55 and name  HB2) (resid   55 and name  HD2) 2.365 0.699 0.699 weight 1.000
    or (resid 55 and name  HB2) (resid   55 and name  HD1)
    or (resid 55 and name  HB1) (resid   55 and name  HD2)
    or (resid 55 and name  HB1) (resid   55 and name  HD1)
assign (resid 37 and name  HB1) (resid   37 and name  HB2) 2.279 0.649 0.649 weight 1.000
assign (resid 48 and name  HB1) (resid   48 and name  HB2) 2.057 0.529 0.529 weight 1.000
assign (resid 56 and name  HG2) (resid   56 and name  HB2) 1.994 0.497 0.497 weight 1.000
assign (resid 93 and name  HB1) (resid   93 and name  HB2) 1.750 0.383 0.383 weight 1.000
assign (resid 41 and name  HB2) (resid   20 and name HG21) 2.649 0.877 0.877 weight 1.000
    or (resid 41 and name  HB2) (resid   20 and name HG22)
    or (resid 41 and name  HB2) (resid   20 and name HG23)
assign (resid  7 and name  HB1) (resid    7 and name  HB2) 1.866 0.435 0.435 weight 1.000
assign (resid  7 and name  HB2) (resid   88 and name  HB2) 2.454 0.753 0.753 weight 1.000
    or (resid  7 and name  HB2) (resid   88 and name  HB1)
    or (resid  7 and name  HB2) (resid   88 and name  HB3)
assign (resid 48 and name  HB2) (resid   10 and name HG22) 2.449 0.749 0.749 weight 1.000
    or (resid 48 and name  HB2) (resid   10 and name HG21)
    or (resid 48 and name  HB2) (resid   10 and name HG23)
assign (resid 33 and name   HB) (resid   33 and name HG12) 1.864 0.434 0.434 weight 1.000
    or (resid 33 and name   HB) (resid   33 and name HG11)
    or (resid 33 and name   HB) (resid   33 and name HG13)
assign (resid 93 and name  HB1) (resid   94 and name HD12) 2.089 0.545 0.545 weight 1.000
    or (resid 93 and name  HB1) (resid   94 and name HD11)
    or (resid 93 and name  HB1) (resid   94 and name HD13)
assign (resid 25 and name  HB1) (resid   25 and name  HB2) 2.236 0.625 0.625 weight 1.000
assign (resid 37 and name  HB2) (resid   59 and name HD22) 2.423 0.734 0.734 weight 1.000
    or (resid 37 and name  HB2) (resid   59 and name HD21)
    or (resid 37 and name  HB2) (resid   59 and name HD23)
    or (resid 37 and name  HB2) (resid   59 and name HD12)
    or (resid 37 and name  HB2) (resid   59 and name HD11)
    or (resid 37 and name  HB2) (resid   59 and name HD13)
assign (resid 40 and name   HN) (resid   40 and name   HB) 2.420 0.732 0.732 weight 1.000
assign (resid 11 and name  HB2) (resid   11 and name   HN) 2.519 0.793 0.793 weight 1.000
assign (resid 66 and name   HN) (resid   66 and name  HB1) 2.449 0.749 0.749 weight 1.000
assign (resid 76 and name   HB) (resid   77 and name   HN) 2.484 0.771 0.771 weight 1.000
assign (resid 80 and name   HN) (resid   80 and name HG11) 2.552 0.814 0.814 weight 1.000
assign (resid 76 and name   HN) (resid   75 and name  HB2) 2.558 0.818 0.818 weight 1.000
assign (resid 79 and name   HN) (resid   78 and name  HB1) 2.513 0.790 0.790 weight 1.000
assign (resid  5 and name  HB2) (resid    5 and name  HD2) 2.580 0.832 0.832 weight 1.000
    or (resid  5 and name  HB2) (resid    5 and name  HD1)
    or (resid  5 and name  HB1) (resid    5 and name  HD2)
    or (resid  5 and name  HB1) (resid    5 and name  HD1)
assign (resid 38 and name  HB1) (resid   38 and name  HB2) 2.274 0.647 0.647 weight 1.000
assign (resid  6 and name  HB2) (resid    6 and name  HG2) 1.914 0.458 0.458 weight 1.000
assign (resid 28 and name  HB2) (resid   28 and name  HG1) 1.877 0.441 0.441 weight 1.000
assign (resid  6 and name  HB1) (resid    6 and name  HB2) 1.755 0.385 0.385 weight 1.000
assign (resid 80 and name HG11) (resid   80 and name HG12) 2.020 0.510 0.510 weight 1.000
assign (resid 75 and name  HB2) (resid   71 and name  HB1) 2.629 0.864 0.864 weight 1.000
assign (resid 12 and name  HB2) (resid   12 and name  HB1) 1.839 0.423 0.423 weight 1.000
assign (resid 38 and name  HB1) (resid   21 and name HD12) 2.495 0.778 0.778 weight 1.000
    or (resid 38 and name  HB1) (resid   21 and name HD11)
    or (resid 38 and name  HB1) (resid   21 and name HD13)
assign (resid 38 and name  HB1) (resid   60 and name HD12) 2.643 0.873 0.873 weight 1.000
    or (resid 38 and name  HB1) (resid   60 and name HD11)
    or (resid 38 and name  HB1) (resid   60 and name HD13)
assign (resid 40 and name   HB) (resid   60 and name HD12) 1.976 0.488 0.488 weight 1.000
    or (resid 40 and name   HB) (resid   60 and name HD11)
    or (resid 40 and name   HB) (resid   60 and name HD13)
assign (resid 12 and name  HB1) (resid   12 and name  HG2) 2.532 0.801 0.801 weight 1.000
assign (resid 12 and name  HB2) (resid   12 and name  HG2) 2.532 0.801 0.801 weight 1.000
assign (resid 39 and name  HG2) (resid   59 and name HD22) 2.597 0.843 0.843 weight 1.000
    or (resid 39 and name  HG2) (resid   59 and name HD21)
    or (resid 39 and name  HG2) (resid   59 and name HD23)
    or (resid 39 and name  HG2) (resid   59 and name HD12)
    or (resid 39 and name  HG2) (resid   59 and name HD11)
    or (resid 39 and name  HG2) (resid   59 and name HD13)
    or (resid 39 and name  HG1) (resid   59 and name HD22)
    or (resid 39 and name  HG1) (resid   59 and name HD21)
    or (resid 39 and name  HG1) (resid   59 and name HD23)
    or (resid 39 and name  HG1) (resid   59 and name HD12)
    or (resid 39 and name  HG1) (resid   59 and name HD11)
    or (resid 39 and name  HG1) (resid   59 and name HD13)
assign (resid 68 and name   HB) (resid   68 and name HG22) 1.926 0.464 0.464 weight 1.000
    or (resid 68 and name   HB) (resid   68 and name HG21)
    or (resid 68 and name   HB) (resid   68 and name HG23)
    or (resid 68 and name   HB) (resid   68 and name HG12)
    or (resid 68 and name   HB) (resid   68 and name HG11)
    or (resid 68 and name   HB) (resid   68 and name HG13)
assign (resid 68 and name   HB) (resid   76 and name HG12) 2.336 0.682 0.682 weight 1.000
    or (resid 68 and name   HB) (resid   76 and name HG11)
    or (resid 68 and name   HB) (resid   76 and name HG13)
assign (resid 78 and name  HB2) (resid   78 and name   HA) 2.426 0.736 0.736 weight 1.000
assign (resid 78 and name   HA) (resid   78 and name  HB1) 2.409 0.725 0.725 weight 1.000
assign (resid 73 and name  HB2) (resid   73 and name  HB1) 2.530 0.800 0.800 weight 1.000
assign (resid  6 and name  HG1) (resid    6 and name  HD1) 2.530 0.800 0.800 weight 1.000
assign (resid 48 and name  HG1) (resid   48 and name  HB2) 2.536 0.804 0.804 weight 1.000
assign (resid 82 and name  HE2) (resid   82 and name  HD2) 2.122 0.563 0.563 weight 1.000
    or (resid 82 and name  HE2) (resid   82 and name  HD1)
    or (resid 82 and name  HE1) (resid   82 and name  HD2)
    or (resid 82 and name  HE1) (resid   82 and name  HD1)
assign (resid 86 and name  HD2) (resid   86 and name  HE2) 2.332 0.680 0.680 weight 1.000
    or (resid 86 and name  HD2) (resid   86 and name  HE1)
assign (resid  8 and name   HB) (resid    8 and name HG11) 2.220 0.616 0.616 weight 1.000
assign (resid  9 and name HG11) (resid    9 and name HG12) 1.754 0.385 0.385 weight 1.000
assign (resid  8 and name HG11) (resid    8 and name HG12) 1.627 0.331 0.331 weight 1.000
assign (resid 21 and name  HB1) (resid   21 and name HD22) 2.076 0.539 0.539 weight 1.000
    or (resid 21 and name  HB1) (resid   21 and name HD21)
    or (resid 21 and name  HB1) (resid   21 and name HD23)
assign (resid 89 and name HG12) (resid   89 and name HG11) 1.794 0.402 0.402 weight 1.000
assign (resid  9 and name HG11) (resid    9 and name HD12) 2.188 0.599 0.599 weight 1.000
    or (resid  9 and name HG11) (resid    9 and name HD11)
    or (resid  9 and name HG11) (resid    9 and name HD13)
assign (resid 22 and name   HN) (resid   21 and name HD12) 2.549 0.812 0.812 weight 1.000
    or (resid 22 and name   HN) (resid   21 and name HD11)
    or (resid 22 and name   HN) (resid   21 and name HD13)
assign (resid 55 and name  HG1) (resid   55 and name  HD2) 2.287 0.654 0.654 weight 1.000
    or (resid 55 and name  HG1) (resid   55 and name  HD1)
assign (resid 16 and name  HG1) (resid   16 and name  HE2) 2.626 0.862 0.862 weight 1.000
    or (resid 16 and name  HG1) (resid   16 and name  HE1)
assign (resid 15 and name  HG1) (resid   15 and name  HD2) 1.806 0.408 0.408 weight 1.000
    or (resid 15 and name  HG1) (resid   15 and name  HD1)
assign (resid 21 and name HD12) (resid   60 and name HG12) 2.370 0.702 0.702 weight 1.000
    or (resid 21 and name HD12) (resid   60 and name HG11)
    or (resid 21 and name HD11) (resid   60 and name HG12)
    or (resid 21 and name HD11) (resid   60 and name HG11)
    or (resid 21 and name HD13) (resid   60 and name HG12)
    or (resid 21 and name HD13) (resid   60 and name HG11)
assign (resid 21 and name HD12) (resid   21 and name   HG) 2.180 0.594 0.594 weight 1.000
    or (resid 21 and name HD11) (resid   21 and name   HG)
    or (resid 21 and name HD13) (resid   21 and name   HG)
assign (resid 21 and name   HG) (resid   21 and name  HB1) 2.076 0.539 0.539 weight 1.000
assign (resid 81 and name  HB1) (resid   81 and name HD12) 2.033 0.517 0.517 weight 1.000
    or (resid 81 and name  HB1) (resid   81 and name HD11)
    or (resid 81 and name  HB1) (resid   81 and name HD13)
assign (resid 54 and name  HB2) (resid   54 and name HD12) 1.970 0.485 0.485 weight 1.000
    or (resid 54 and name  HB2) (resid   54 and name HD11)
    or (resid 54 and name  HB2) (resid   54 and name HD13)
assign (resid 54 and name HD12) (resid   54 and name HD22) 1.846 0.426 0.426 weight 1.000
    or (resid 54 and name HD12) (resid   54 and name HD21)
    or (resid 54 and name HD12) (resid   54 and name HD23)
    or (resid 54 and name HD11) (resid   54 and name HD22)
    or (resid 54 and name HD11) (resid   54 and name HD21)
    or (resid 54 and name HD11) (resid   54 and name HD23)
    or (resid 54 and name HD13) (resid   54 and name HD22)
    or (resid 54 and name HD13) (resid   54 and name HD21)
    or (resid 54 and name HD13) (resid   54 and name HD23)
assign (resid 54 and name   HG) (resid   54 and name HD12) 2.273 0.646 0.646 weight 1.000
    or (resid 54 and name   HG) (resid   54 and name HD11)
    or (resid 54 and name   HG) (resid   54 and name HD13)
assign (resid 21 and name   HN) (resid   20 and name HG21) 2.454 0.753 0.753 weight 1.000
    or (resid 21 and name   HN) (resid   20 and name HG22)
    or (resid 21 and name   HN) (resid   20 and name HG23)
assign (resid 41 and name   HN) (resid   40 and name HG22) 2.332 0.680 0.680 weight 1.000
    or (resid 41 and name   HN) (resid   40 and name HG21)
    or (resid 41 and name   HN) (resid   40 and name HG23)
assign (resid 81 and name HD22) (resid   81 and name   HN) 2.530 0.800 0.800 weight 1.000
    or (resid 81 and name HD21) (resid   81 and name   HN)
    or (resid 81 and name HD23) (resid   81 and name   HN)
assign (resid 74 and name   HN) (resid   74 and name HG21) 2.387 0.712 0.712 weight 1.000
    or (resid 74 and name   HN) (resid   74 and name HG22)
    or (resid 74 and name   HN) (resid   74 and name HG23)
assign (resid 55 and name   HN) (resid   54 and name HD22) 2.437 0.742 0.742 weight 1.000
    or (resid 55 and name   HN) (resid   54 and name HD21)
    or (resid 55 and name   HN) (resid   54 and name HD23)
assign (resid 77 and name   HN) (resid   77 and name HG22) 2.075 0.538 0.538 weight 1.000
    or (resid 77 and name   HN) (resid   77 and name HG21)
    or (resid 77 and name   HN) (resid   77 and name HG23)
assign (resid 76 and name   HN) (resid   76 and name HG12) 2.247 0.631 0.631 weight 1.000
    or (resid 76 and name   HN) (resid   76 and name HG11)
    or (resid 76 and name   HN) (resid   76 and name HG13)
assign (resid 36 and name HG21) (resid   34 and name  HD1) 2.325 0.676 0.676 weight 1.000
assign (resid 72 and name   HB) (resid   72 and name HG22) 2.102 0.552 0.552 weight 1.000
    or (resid 72 and name   HB) (resid   72 and name HG21)
    or (resid 72 and name   HB) (resid   72 and name HG23)
assign (resid 40 and name HG22) (resid   40 and name   HB) 2.071 0.536 0.536 weight 1.000
    or (resid 40 and name HG21) (resid   40 and name   HB)
    or (resid 40 and name HG23) (resid   40 and name   HB)
assign (resid 77 and name HG12) (resid   77 and name   HB) 1.751 0.383 0.383 weight 1.000
    or (resid 77 and name HG11) (resid   77 and name   HB)
    or (resid 77 and name HG13) (resid   77 and name   HB)
assign (resid 43 and name   HB) (resid   43 and name HG12) 1.877 0.440 0.440 weight 1.000
    or (resid 43 and name   HB) (resid   43 and name HG11)
    or (resid 43 and name   HB) (resid   43 and name HG13)
assign (resid 77 and name   HB) (resid   77 and name HG22) 1.982 0.491 0.491 weight 1.000
    or (resid 77 and name   HB) (resid   77 and name HG21)
    or (resid 77 and name   HB) (resid   77 and name HG23)
assign (resid 76 and name   HB) (resid   76 and name HG22) 1.990 0.495 0.495 weight 1.000
    or (resid 76 and name   HB) (resid   76 and name HG21)
    or (resid 76 and name   HB) (resid   76 and name HG23)
assign (resid 76 and name   HB) (resid   76 and name HG12) 2.132 0.568 0.568 weight 1.000
    or (resid 76 and name   HB) (resid   76 and name HG11)
    or (resid 76 and name   HB) (resid   76 and name HG13)
assign (resid 81 and name HD22) (resid   81 and name  HB1) 1.835 0.421 0.421 weight 1.000
    or (resid 81 and name HD21) (resid   81 and name  HB1)
    or (resid 81 and name HD23) (resid   81 and name  HB1)
assign (resid 54 and name HD22) (resid   54 and name  HB2) 1.906 0.454 0.454 weight 1.000
    or (resid 54 and name HD21) (resid   54 and name  HB2)
    or (resid 54 and name HD23) (resid   54 and name  HB2)
assign (resid 77 and name HG21) (resid   21 and name  HB1) 2.340 0.684 0.684 weight 1.000
assign (resid 76 and name HG12) (resid   71 and name  HB1) 2.416 0.730 0.730 weight 1.000
    or (resid 76 and name HG11) (resid   71 and name  HB1)
    or (resid 76 and name HG13) (resid   71 and name  HB1)
assign (resid 77 and name HG12) (resid   77 and name HG22) 1.904 0.453 0.453 weight 1.000
    or (resid 77 and name HG12) (resid   77 and name HG21)
    or (resid 77 and name HG12) (resid   77 and name HG23)
    or (resid 77 and name HG11) (resid   77 and name HG22)
    or (resid 77 and name HG11) (resid   77 and name HG21)
    or (resid 77 and name HG11) (resid   77 and name HG23)
    or (resid 77 and name HG13) (resid   77 and name HG22)
    or (resid 77 and name HG13) (resid   77 and name HG21)
    or (resid 77 and name HG13) (resid   77 and name HG23)
assign (resid 76 and name HG12) (resid   71 and name HD22) 1.884 0.443 0.443 weight 1.000
    or (resid 76 and name HG12) (resid   71 and name HD21)
    or (resid 76 and name HG12) (resid   71 and name HD23)
    or (resid 76 and name HG12) (resid   71 and name HD12)
    or (resid 76 and name HG12) (resid   71 and name HD11)
    or (resid 76 and name HG12) (resid   71 and name HD13)
    or (resid 76 and name HG11) (resid   71 and name HD22)
    or (resid 76 and name HG11) (resid   71 and name HD21)
    or (resid 76 and name HG11) (resid   71 and name HD23)
    or (resid 76 and name HG11) (resid   71 and name HD12)
    or (resid 76 and name HG11) (resid   71 and name HD11)
    or (resid 76 and name HG11) (resid   71 and name HD13)
    or (resid 76 and name HG13) (resid   71 and name HD22)
    or (resid 76 and name HG13) (resid   71 and name HD21)
    or (resid 76 and name HG13) (resid   71 and name HD23)
    or (resid 76 and name HG13) (resid   71 and name HD12)
    or (resid 76 and name HG13) (resid   71 and name HD11)
    or (resid 76 and name HG13) (resid   71 and name HD13)
assign (resid 40 and name HG22) (resid   54 and name HD12) 2.468 0.761 0.761 weight 1.000
    or (resid 40 and name HG22) (resid   54 and name HD11)
    or (resid 40 and name HG22) (resid   54 and name HD13)
    or (resid 40 and name HG21) (resid   54 and name HD12)
    or (resid 40 and name HG21) (resid   54 and name HD11)
    or (resid 40 and name HG21) (resid   54 and name HD13)
    or (resid 40 and name HG23) (resid   54 and name HD12)
    or (resid 40 and name HG23) (resid   54 and name HD11)
    or (resid 40 and name HG23) (resid   54 and name HD13)
assign (resid 40 and name   HN) (resid   40 and name HG12) 2.306 0.665 0.665 weight 1.000
    or (resid 40 and name   HN) (resid   40 and name HG11)
    or (resid 40 and name   HN) (resid   40 and name HG13)
assign (resid 11 and name   HN) (resid   10 and name HG22) 2.343 0.686 0.686 weight 1.000
    or (resid 11 and name   HN) (resid   10 and name HG21)
    or (resid 11 and name   HN) (resid   10 and name HG23)
assign (resid 87 and name   HN) (resid   87 and name HG12) 2.197 0.603 0.603 weight 1.000
    or (resid 87 and name   HN) (resid   87 and name HG11)
    or (resid 87 and name   HN) (resid   87 and name HG13)
assign (resid 52 and name   HN) (resid   52 and name  HB2) 1.929 0.465 0.465 weight 1.000
    or (resid 52 and name   HN) (resid   52 and name  HB1)
    or (resid 52 and name   HN) (resid   52 and name  HB3)
assign (resid 88 and name   HN) (resid   88 and name  HB2) 2.167 0.587 0.587 weight 1.000
    or (resid 88 and name   HN) (resid   88 and name  HB1)
    or (resid 88 and name   HN) (resid   88 and name  HB3)
assign (resid 33 and name HG22) (resid   34 and name   HN) 2.426 0.736 0.736 weight 1.000
    or (resid 33 and name HG21) (resid   34 and name   HN)
    or (resid 33 and name HG23) (resid   34 and name   HN)
assign (resid 53 and name   HN) (resid   52 and name  HB2) 2.592 0.840 0.840 weight 1.000
    or (resid 53 and name   HN) (resid   52 and name  HB1)
    or (resid 53 and name   HN) (resid   52 and name  HB3)
assign (resid 10 and name   HA) (resid   52 and name  HB2) 2.376 0.706 0.706 weight 1.000
    or (resid 10 and name   HA) (resid   52 and name  HB1)
    or (resid 10 and name   HA) (resid   52 and name  HB3)
assign (resid 52 and name  HB2) (resid   49 and name   HA) 2.521 0.795 0.795 weight 1.000
    or (resid 52 and name  HB1) (resid   49 and name   HA)
    or (resid 52 and name  HB3) (resid   49 and name   HA)
assign (resid 49 and name  HB2) (resid   19 and name  HB2) 2.501 0.782 0.782 weight 1.000
    or (resid 49 and name  HB1) (resid   19 and name  HB2)
    or (resid 49 and name  HB3) (resid   19 and name  HB2)
assign (resid 13 and name  HB2) (resid   48 and name  HG1) 2.640 0.871 0.871 weight 1.000
    or (resid 13 and name  HB1) (resid   48 and name  HG1)
    or (resid 13 and name  HB3) (resid   48 and name  HG1)
assign (resid 40 and name HG12) (resid   40 and name   HB) 2.096 0.549 0.549 weight 1.000
    or (resid 40 and name HG11) (resid   40 and name   HB)
    or (resid 40 and name HG13) (resid   40 and name   HB)
assign (resid 48 and name  HB1) (resid   10 and name HG22) 2.515 0.791 0.791 weight 1.000
    or (resid 48 and name  HB1) (resid   10 and name HG21)
    or (resid 48 and name  HB1) (resid   10 and name HG23)
assign (resid 61 and name HG21) (resid    5 and name  HG2) 2.295 0.658 0.658 weight 1.000
    or (resid 61 and name HG22) (resid    5 and name  HG2)
    or (resid 61 and name HG23) (resid    5 and name  HG2)
assign (resid 88 and name  HB2) (resid    7 and name  HG2) 2.198 0.604 0.604 weight 1.000
    or (resid 88 and name  HB2) (resid    7 and name  HG1)
    or (resid 88 and name  HB1) (resid    7 and name  HG2)
    or (resid 88 and name  HB1) (resid    7 and name  HG1)
    or (resid 88 and name  HB3) (resid    7 and name  HG2)
    or (resid 88 and name  HB3) (resid    7 and name  HG1)
assign (resid 63 and name HG22) (resid   63 and name   HB) 1.891 0.447 0.447 weight 1.000
    or (resid 63 and name HG21) (resid   63 and name   HB)
    or (resid 63 and name HG23) (resid   63 and name   HB)
assign (resid 87 and name   HB) (resid   87 and name HG12) 2.136 0.570 0.570 weight 1.000
    or (resid 87 and name   HB) (resid   87 and name HG11)
    or (resid 87 and name   HB) (resid   87 and name HG13)
assign (resid 72 and name HG12) (resid   74 and name HG21) 2.188 0.599 0.599 weight 1.000
    or (resid 72 and name HG12) (resid   74 and name HG22)
    or (resid 72 and name HG12) (resid   74 and name HG23)
    or (resid 72 and name HG11) (resid   74 and name HG21)
    or (resid 72 and name HG11) (resid   74 and name HG22)
    or (resid 72 and name HG11) (resid   74 and name HG23)
    or (resid 72 and name HG13) (resid   74 and name HG21)
    or (resid 72 and name HG13) (resid   74 and name HG22)
    or (resid 72 and name HG13) (resid   74 and name HG23)
assign (resid 10 and name   HB) (resid   10 and name HG22) 1.849 0.427 0.427 weight 1.000
    or (resid 10 and name   HB) (resid   10 and name HG21)
    or (resid 10 and name   HB) (resid   10 and name HG23)
assign (resid 87 and name HG12) (resid   10 and name   HB) 2.045 0.523 0.523 weight 1.000
    or (resid 87 and name HG11) (resid   10 and name   HB)
    or (resid 87 and name HG13) (resid   10 and name   HB)
assign (resid 88 and name  HB2) (resid    9 and name HD12) 2.083 0.543 0.543 weight 1.000
    or (resid 88 and name  HB2) (resid    9 and name HD11)
    or (resid 88 and name  HB2) (resid    9 and name HD13)
    or (resid 88 and name  HB1) (resid    9 and name HD12)
    or (resid 88 and name  HB1) (resid    9 and name HD11)
    or (resid 88 and name  HB1) (resid    9 and name HD13)
    or (resid 88 and name  HB3) (resid    9 and name HD12)
    or (resid 88 and name  HB3) (resid    9 and name HD11)
    or (resid 88 and name  HB3) (resid    9 and name HD13)
assign (resid 49 and name  HB2) (resid   43 and name HG22) 2.013 0.506 0.506 weight 1.000
    or (resid 49 and name  HB2) (resid   43 and name HG21)
    or (resid 49 and name  HB2) (resid   43 and name HG23)
    or (resid 49 and name  HB1) (resid   43 and name HG22)
    or (resid 49 and name  HB1) (resid   43 and name HG21)
    or (resid 49 and name  HB1) (resid   43 and name HG23)
    or (resid 49 and name  HB3) (resid   43 and name HG22)
    or (resid 49 and name  HB3) (resid   43 and name HG21)
    or (resid 49 and name  HB3) (resid   43 and name HG23)
assign (resid 87 and name HG12) (resid   87 and name HG22) 1.827 0.417 0.417 weight 1.000
    or (resid 87 and name HG12) (resid   87 and name HG21)
    or (resid 87 and name HG12) (resid   87 and name HG23)
    or (resid 87 and name HG11) (resid   87 and name HG22)
    or (resid 87 and name HG11) (resid   87 and name HG21)
    or (resid 87 and name HG11) (resid   87 and name HG23)
    or (resid 87 and name HG13) (resid   87 and name HG22)
    or (resid 87 and name HG13) (resid   87 and name HG21)
    or (resid 87 and name HG13) (resid   87 and name HG23)
assign (resid 40 and name HG12) (resid   54 and name HD12) 2.301 0.662 0.662 weight 1.000
    or (resid 40 and name HG12) (resid   54 and name HD11)
    or (resid 40 and name HG12) (resid   54 and name HD13)
    or (resid 40 and name HG11) (resid   54 and name HD12)
    or (resid 40 and name HG11) (resid   54 and name HD11)
    or (resid 40 and name HG11) (resid   54 and name HD13)
    or (resid 40 and name HG13) (resid   54 and name HD12)
    or (resid 40 and name HG13) (resid   54 and name HD11)
    or (resid 40 and name HG13) (resid   54 and name HD13)
assign (resid 72 and name   HN) (resid   72 and name HG12) 2.147 0.576 0.576 weight 1.000
    or (resid 72 and name   HN) (resid   72 and name HG11)
    or (resid 72 and name   HN) (resid   72 and name HG13)
assign (resid 81 and name   HN) (resid   80 and name HG22) 2.649 0.877 0.877 weight 1.000
    or (resid 81 and name   HN) (resid   80 and name HG21)
    or (resid 81 and name   HN) (resid   80 and name HG23)
assign (resid 74 and name   HN) (resid   72 and name HG12) 2.568 0.824 0.824 weight 1.000
    or (resid 74 and name   HN) (resid   72 and name HG11)
    or (resid 74 and name   HN) (resid   72 and name HG13)
assign (resid 49 and name   HN) (resid   49 and name  HB2) 2.101 0.552 0.552 weight 1.000
    or (resid 49 and name   HN) (resid   49 and name  HB1)
    or (resid 49 and name   HN) (resid   49 and name  HB3)
assign (resid 80 and name HG22) (resid   80 and name   HN) 2.643 0.873 0.873 weight 1.000
    or (resid 80 and name HG21) (resid   80 and name   HN)
    or (resid 80 and name HG23) (resid   80 and name   HN)
assign (resid 75 and name   HN) (resid   72 and name HG12) 2.106 0.554 0.554 weight 1.000
    or (resid 75 and name   HN) (resid   72 and name HG11)
    or (resid 75 and name   HN) (resid   72 and name HG13)
assign (resid 49 and name  HB2) (resid   19 and name  HD1) 2.190 0.599 0.599 weight 1.000
    or (resid 49 and name  HB2) (resid   19 and name  HD2)
    or (resid 49 and name  HB1) (resid   19 and name  HD1)
    or (resid 49 and name  HB1) (resid   19 and name  HD2)
    or (resid 49 and name  HB3) (resid   19 and name  HD1)
    or (resid 49 and name  HB3) (resid   19 and name  HD2)
assign (resid 80 and name HG22) (resid   17 and name  HE1) 2.427 0.737 0.737 weight 1.000
    or (resid 80 and name HG22) (resid   17 and name  HE2)
    or (resid 80 and name HG21) (resid   17 and name  HE1)
    or (resid 80 and name HG21) (resid   17 and name  HE2)
    or (resid 80 and name HG23) (resid   17 and name  HE1)
    or (resid 80 and name HG23) (resid   17 and name  HE2)
assign (resid 49 and name  HB2) (resid   19 and name  HB1) 2.610 0.852 0.852 weight 1.000
    or (resid 49 and name  HB1) (resid   19 and name  HB1)
    or (resid 49 and name  HB3) (resid   19 and name  HB1)
assign (resid 72 and name   HB) (resid   72 and name HG12) 2.113 0.558 0.558 weight 1.000
    or (resid 72 and name   HB) (resid   72 and name HG11)
    or (resid 72 and name   HB) (resid   72 and name HG13)
assign (resid 75 and name  HB2) (resid   72 and name HG12) 2.440 0.744 0.744 weight 1.000
    or (resid 75 and name  HB2) (resid   72 and name HG11)
    or (resid 75 and name  HB2) (resid   72 and name HG13)
assign (resid 75 and name  HG2) (resid   72 and name HG12) 2.010 0.505 0.505 weight 1.000
    or (resid 75 and name  HG2) (resid   72 and name HG11)
    or (resid 75 and name  HG2) (resid   72 and name HG13)
    or (resid 75 and name  HG1) (resid   72 and name HG12)
    or (resid 75 and name  HG1) (resid   72 and name HG11)
    or (resid 75 and name  HG1) (resid   72 and name HG13)
assign (resid 89 and name   HB) (resid   89 and name HG22) 1.839 0.423 0.423 weight 1.000
    or (resid 89 and name   HB) (resid   89 and name HG21)
    or (resid 89 and name   HB) (resid   89 and name HG23)
assign (resid 80 and name HG22) (resid   80 and name HG12) 1.828 0.418 0.418 weight 1.000
    or (resid 80 and name HG21) (resid   80 and name HG12)
    or (resid 80 and name HG23) (resid   80 and name HG12)
assign (resid  9 and name HG22) (resid    9 and name   HB) 1.870 0.437 0.437 weight 1.000
    or (resid  9 and name HG21) (resid    9 and name   HB)
    or (resid  9 and name HG23) (resid    9 and name   HB)
assign (resid 52 and name  HB2) (resid    8 and name HG22) 1.741 0.379 0.379 weight 1.000
    or (resid 52 and name  HB2) (resid    8 and name HG21)
    or (resid 52 and name  HB2) (resid    8 and name HG23)
    or (resid 52 and name  HB1) (resid    8 and name HG22)
    or (resid 52 and name  HB1) (resid    8 and name HG21)
    or (resid 52 and name  HB1) (resid    8 and name HG23)
    or (resid 52 and name  HB3) (resid    8 and name HG22)
    or (resid 52 and name  HB3) (resid    8 and name HG21)
    or (resid 52 and name  HB3) (resid    8 and name HG23)
assign (resid  8 and name HG11) (resid    8 and name HG22) 2.004 0.502 0.502 weight 1.000
    or (resid  8 and name HG11) (resid    8 and name HG21)
    or (resid  8 and name HG11) (resid    8 and name HG23)
assign (resid  9 and name HG11) (resid    9 and name HG22) 2.017 0.509 0.509 weight 1.000
    or (resid  9 and name HG11) (resid    9 and name HG21)
    or (resid  9 and name HG11) (resid    9 and name HG23)
assign (resid 49 and name  HB2) (resid   10 and name HD12) 2.144 0.575 0.575 weight 1.000
    or (resid 49 and name  HB2) (resid   10 and name HD11)
    or (resid 49 and name  HB2) (resid   10 and name HD13)
    or (resid 49 and name  HB1) (resid   10 and name HD12)
    or (resid 49 and name  HB1) (resid   10 and name HD11)
    or (resid 49 and name  HB1) (resid   10 and name HD13)
    or (resid 49 and name  HB3) (resid   10 and name HD12)
    or (resid 49 and name  HB3) (resid   10 and name HD11)
    or (resid 49 and name  HB3) (resid   10 and name HD13)
assign (resid 49 and name  HB2) (resid   54 and name HD12) 2.049 0.525 0.525 weight 1.000
    or (resid 49 and name  HB2) (resid   54 and name HD11)
    or (resid 49 and name  HB2) (resid   54 and name HD13)
    or (resid 49 and name  HB1) (resid   54 and name HD12)
    or (resid 49 and name  HB1) (resid   54 and name HD11)
    or (resid 49 and name  HB1) (resid   54 and name HD13)
    or (resid 49 and name  HB3) (resid   54 and name HD12)
    or (resid 49 and name  HB3) (resid   54 and name HD11)
    or (resid 49 and name  HB3) (resid   54 and name HD13)
assign (resid 80 and name   HN) (resid   80 and name HD12) 2.437 0.742 0.742 weight 1.000
    or (resid 80 and name   HN) (resid   80 and name HD11)
    or (resid 80 and name   HN) (resid   80 and name HD13)
assign (resid 80 and name HD12) (resid   19 and name  HE1) 2.310 0.667 0.667 weight 1.000
    or (resid 80 and name HD12) (resid   19 and name  HE2)
    or (resid 80 and name HD11) (resid   19 and name  HE1)
    or (resid 80 and name HD11) (resid   19 and name  HE2)
    or (resid 80 and name HD13) (resid   19 and name  HE1)
    or (resid 80 and name HD13) (resid   19 and name  HE2)
assign (resid 49 and name   HA) (resid   10 and name HD12) 2.590 0.838 0.838 weight 1.000
    or (resid 49 and name   HA) (resid   10 and name HD11)
    or (resid 49 and name   HA) (resid   10 and name HD13)
assign (resid 80 and name HD12) (resid   77 and name   HA) 2.610 0.852 0.852 weight 1.000
    or (resid 80 and name HD11) (resid   77 and name   HA)
    or (resid 80 and name HD13) (resid   77 and name   HA)
assign (resid 80 and name HG12) (resid   80 and name HD12) 1.767 0.390 0.390 weight 1.000
    or (resid 80 and name HG12) (resid   80 and name HD11)
    or (resid 80 and name HG12) (resid   80 and name HD13)
assign (resid 24 and name HD12) (resid   24 and name HG12) 2.097 0.550 0.550 weight 1.000
    or (resid 24 and name HD12) (resid   24 and name HG11)
    or (resid 24 and name HD11) (resid   24 and name HG12)
    or (resid 24 and name HD11) (resid   24 and name HG11)
    or (resid 24 and name HD13) (resid   24 and name HG12)
    or (resid 24 and name HD13) (resid   24 and name HG11)
assign (resid 10 and name   HB) (resid   10 and name HD12) 1.757 0.386 0.386 weight 1.000
    or (resid 10 and name   HB) (resid   10 and name HD11)
    or (resid 10 and name   HB) (resid   10 and name HD13)
assign (resid 10 and name HG22) (resid   10 and name HD12) 1.856 0.430 0.430 weight 1.000
    or (resid 10 and name HG22) (resid   10 and name HD11)
    or (resid 10 and name HG22) (resid   10 and name HD13)
    or (resid 10 and name HG21) (resid   10 and name HD12)
    or (resid 10 and name HG21) (resid   10 and name HD11)
    or (resid 10 and name HG21) (resid   10 and name HD13)
    or (resid 10 and name HG23) (resid   10 and name HD12)
    or (resid 10 and name HG23) (resid   10 and name HD11)
    or (resid 10 and name HG23) (resid   10 and name HD13)
assign (resid 10 and name HD12) (resid   54 and name HD12) 2.300 0.661 0.661 weight 1.000
    or (resid 10 and name HD12) (resid   54 and name HD11)
    or (resid 10 and name HD12) (resid   54 and name HD13)
    or (resid 10 and name HD11) (resid   54 and name HD12)
    or (resid 10 and name HD11) (resid   54 and name HD11)
    or (resid 10 and name HD11) (resid   54 and name HD13)
    or (resid 10 and name HD13) (resid   54 and name HD12)
    or (resid 10 and name HD13) (resid   54 and name HD11)
    or (resid 10 and name HD13) (resid   54 and name HD13)
assign (resid 89 and name HD12) (resid   60 and name HG12) 2.136 0.570 0.570 weight 1.000
    or (resid 89 and name HD12) (resid   60 and name HG11)
    or (resid 89 and name HD11) (resid   60 and name HG12)
    or (resid 89 and name HD11) (resid   60 and name HG11)
    or (resid 89 and name HD13) (resid   60 and name HG12)
    or (resid 89 and name HD13) (resid   60 and name HG11)
assign (resid  8 and name HG12) (resid    8 and name HD12) 1.875 0.439 0.439 weight 1.000
    or (resid  8 and name HG12) (resid    8 and name HD11)
    or (resid  8 and name HG12) (resid    8 and name HD13)
assign (resid  8 and name HG11) (resid    8 and name HD12) 1.904 0.453 0.453 weight 1.000
    or (resid  8 and name HG11) (resid    8 and name HD11)
    or (resid  8 and name HG11) (resid    8 and name HD13)
assign (resid 60 and name HD12) (resid   19 and name  HE1) 2.590 0.838 0.838 weight 1.000
    or (resid 60 and name HD12) (resid   19 and name  HE2)
    or (resid 60 and name HD11) (resid   19 and name  HE1)
    or (resid 60 and name HD11) (resid   19 and name  HE2)
    or (resid 60 and name HD13) (resid   19 and name  HE1)
    or (resid 60 and name HD13) (resid   19 and name  HE2)
assign (resid 10 and name   HN) (resid    9 and name HG22) 2.682 0.899 0.899 weight 1.000
    or (resid 10 and name   HN) (resid    9 and name HG21)
    or (resid 10 and name   HN) (resid    9 and name HG23)
assign (resid 86 and name  HE2) (resid    9 and name HG22) 2.655 0.881 0.881 weight 1.000
    or (resid 86 and name  HE2) (resid    9 and name HG21)
    or (resid 86 and name  HE2) (resid    9 and name HG23)
    or (resid 86 and name  HE1) (resid    9 and name HG22)
    or (resid 86 and name  HE1) (resid    9 and name HG21)
    or (resid 86 and name  HE1) (resid    9 and name HG23)
assign (resid 48 and name  HG2) (resid   48 and name  HB2) 2.454 0.753 0.753 weight 1.000
assign (resid 12 and name  HD1) (resid   12 and name  HD2) 1.929 0.465 0.465 weight 1.000
assign (resid 79 and name  HB1) (resid   63 and name HG22) 1.972 0.486 0.486 weight 1.000
    or (resid 79 and name  HB1) (resid   63 and name HG21)
    or (resid 79 and name  HB1) (resid   63 and name HG23)
assign (resid  6 and name  HG1) (resid    6 and name  HD2) 2.530 0.800 0.800 weight 1.000
assign (resid 80 and name   HA) (resid   80 and name   HB) 2.877 1.035 1.035 weight 1.000
assign (resid  8 and name   HN) (resid    8 and name HG11) 2.833 1.003 1.003 weight 1.000
assign (resid 55 and name  HG1) (resid   55 and name   HN) 2.772 0.960 0.960 weight 1.000
assign (resid 55 and name   HN) (resid   55 and name  HG2) 2.823 0.996 0.996 weight 1.000
assign (resid 10 and name   HB) (resid   87 and name   HN) 2.837 1.006 1.006 weight 1.000
assign (resid 81 and name  HB2) (resid   82 and name   HN) 2.772 0.960 0.960 weight 1.000
assign (resid 81 and name  HB2) (resid   81 and name   HA) 2.814 0.990 0.990 weight 1.000
assign (resid 81 and name  HB2) (resid   78 and name   HA) 2.726 0.929 0.929 weight 1.000
assign (resid 81 and name  HB1) (resid   82 and name   HN) 2.877 1.035 1.035 weight 1.000
assign (resid 19 and name  HB2) (resid   54 and name HD12) 2.810 0.987 0.987 weight 1.000
    or (resid 19 and name  HB2) (resid   54 and name HD11)
    or (resid 19 and name  HB2) (resid   54 and name HD13)
assign (resid 20 and name   HN) (resid   19 and name  HB2) 2.862 1.024 1.024 weight 1.000
assign (resid 17 and name  HB2) (resid   49 and name  HB2) 2.801 0.981 0.981 weight 1.000
    or (resid 17 and name  HB2) (resid   49 and name  HB1)
    or (resid 17 and name  HB2) (resid   49 and name  HB3)
assign (resid 17 and name  HB2) (resid   10 and name HG22) 2.792 0.975 0.975 weight 1.000
    or (resid 17 and name  HB2) (resid   10 and name HG21)
    or (resid 17 and name  HB2) (resid   10 and name HG23)
assign (resid 58 and name   HN) (resid   58 and name  HB2) 2.847 1.013 1.013 weight 1.000
assign (resid 58 and name   HN) (resid   58 and name  HB1) 2.797 0.978 0.978 weight 1.000
assign (resid 58 and name  HB2) (resid   91 and name HG21) 2.695 0.908 0.908 weight 1.000
    or (resid 58 and name  HB2) (resid   91 and name HG22)
    or (resid 58 and name  HB2) (resid   91 and name HG23)
assign (resid 17 and name  HB1) (resid   10 and name HG11) 2.741 0.939 0.939 weight 1.000
assign (resid 80 and name   HN) (resid   79 and name  HB1) 2.452 0.752 0.752 weight 1.000
assign (resid 25 and name  HD2) (resid   25 and name  HB1) 2.745 0.942 0.942 weight 1.000
assign (resid 21 and name  HB1) (resid   76 and name HG22) 2.719 0.924 0.924 weight 1.000
    or (resid 21 and name  HB1) (resid   76 and name HG21)
    or (resid 21 and name  HB1) (resid   76 and name HG23)
assign (resid 76 and name HG22) (resid   21 and name  HB2) 2.276 0.648 0.648 weight 1.000
    or (resid 76 and name HG21) (resid   21 and name  HB2)
    or (resid 76 and name HG23) (resid   21 and name  HB2)
assign (resid 28 and name   HA) (resid   28 and name  HG1) 2.784 0.969 0.969 weight 1.000
assign (resid 58 and name   HA) (resid   58 and name  HB1) 2.797 0.978 0.978 weight 1.000
assign (resid 11 and name   HA) (resid   86 and name   HA) 2.686 0.902 0.902 weight 1.000
assign (resid 11 and name   HA) (resid   86 and name  HB1) 2.702 0.913 0.913 weight 1.000
assign (resid 11 and name   HA) (resid   10 and name HG22) 2.819 0.993 0.993 weight 1.000
    or (resid 11 and name   HA) (resid   10 and name HG21)
    or (resid 11 and name   HA) (resid   10 and name HG23)
assign (resid 79 and name  HB2) (resid   79 and name   HA) 2.314 0.669 0.669 weight 1.000
assign (resid  5 and name  HG1) (resid    5 and name  HD2) 2.361 0.697 0.697 weight 1.000
    or (resid  5 and name  HG1) (resid    5 and name  HD1)
assign (resid  8 and name   HN) (resid    7 and name  HB1) 2.695 0.908 0.908 weight 1.000
assign (resid 72 and name   HN) (resid   75 and name  HB2) 2.823 0.996 0.996 weight 1.000
assign (resid 73 and name  HB2) (resid   74 and name HG21) 2.682 0.899 0.899 weight 1.000
    or (resid 73 and name  HB2) (resid   74 and name HG22)
    or (resid 73 and name  HB2) (resid   74 and name HG23)
assign (resid 73 and name  HB1) (resid   23 and name  HB2) 2.768 0.958 0.958 weight 1.000
    or (resid 73 and name  HB1) (resid   23 and name  HB1)
    or (resid 73 and name  HB1) (resid   23 and name  HB3)
assign (resid 89 and name HG11) (resid   89 and name HD12) 1.833 0.420 0.420 weight 1.000
    or (resid 89 and name HG11) (resid   89 and name HD11)
    or (resid 89 and name HG11) (resid   89 and name HD13)
assign (resid 89 and name HD12) (resid   89 and name HG12) 1.794 0.402 0.402 weight 1.000
    or (resid 89 and name HD11) (resid   89 and name HG12)
    or (resid 89 and name HD13) (resid   89 and name HG12)
assign (resid 43 and name   HB) (resid   43 and name HG22) 1.804 0.407 0.407 weight 1.000
    or (resid 43 and name   HB) (resid   43 and name HG21)
    or (resid 43 and name   HB) (resid   43 and name HG23)
assign (resid 28 and name  HG2) (resid   28 and name  HB1) 1.904 0.453 0.453 weight 1.000
assign (resid 28 and name  HB2) (resid   28 and name  HG2) 1.877 0.441 0.441 weight 1.000
assign (resid 11 and name   HA) (resid   11 and name  HB1) 2.418 0.731 0.731 weight 1.000
assign (resid 49 and name   HA) (resid   10 and name HG11) 2.266 0.642 0.642 weight 1.000
assign (resid 48 and name   HA) (resid   48 and name  HB1) 2.215 0.613 0.613 weight 1.000
assign (resid 60 and name HD12) (resid   60 and name HG12) 1.851 0.428 0.428 weight 1.000
    or (resid 60 and name HD12) (resid   60 and name HG11)
    or (resid 60 and name HD11) (resid   60 and name HG12)
    or (resid 60 and name HD11) (resid   60 and name HG11)
    or (resid 60 and name HD13) (resid   60 and name HG12)
    or (resid 60 and name HD13) (resid   60 and name HG11)
assign (resid  8 and name HD12) (resid    8 and name   HB) 1.875 0.439 0.439 weight 1.000
    or (resid  8 and name HD11) (resid    8 and name   HB)
    or (resid  8 and name HD13) (resid    8 and name   HB)
assign (resid  7 and name  HB1) (resid   88 and name  HB2) 1.878 0.441 0.441 weight 1.000
    or (resid  7 and name  HB1) (resid   88 and name  HB1)
    or (resid  7 and name  HB1) (resid   88 and name  HB3)
assign (resid 69 and name   HA) (resid   69 and name  HB1) 2.369 0.702 0.702 weight 1.000
assign (resid 12 and name  HD2) (resid   12 and name  HG2) 2.396 0.717 0.717 weight 1.000
assign (resid 12 and name  HD1) (resid   12 and name  HG2) 2.434 0.740 0.740 weight 1.000
assign (resid 17 and name   HA) (resid   17 and name  HB1) 2.797 0.978 0.978 weight 1.000
assign (resid 43 and name HG12) (resid   56 and name   HA) 2.667 0.889 0.889 weight 1.000
    or (resid 43 and name HG11) (resid   56 and name   HA)
    or (resid 43 and name HG13) (resid   56 and name   HA)
assign (resid 19 and name  HB1) (resid   43 and name HG12) 2.797 0.978 0.978 weight 1.000
    or (resid 19 and name  HB1) (resid   43 and name HG11)
    or (resid 19 and name  HB1) (resid   43 and name HG13)
assign (resid 76 and name HG22) (resid   21 and name   HG) 2.293 0.657 0.657 weight 1.000
    or (resid 76 and name HG21) (resid   21 and name   HG)
    or (resid 76 and name HG23) (resid   21 and name   HG)
assign (resid 49 and name  HB2) (resid   10 and name HG11) 2.144 0.575 0.575 weight 1.000
    or (resid 49 and name  HB1) (resid   10 and name HG11)
    or (resid 49 and name  HB3) (resid   10 and name HG11)
assign (resid 56 and name   HA) (resid   56 and name  HG1) 2.388 0.713 0.713 weight 1.000
assign (resid 56 and name   HA) (resid   56 and name  HB1) 2.300 0.661 0.661 weight 1.000
assign (resid 78 and name   HA) (resid   78 and name  HG1) 2.325 0.676 0.676 weight 1.000
assign (resid 80 and name   HB) (resid   77 and name   HA) 2.209 0.610 0.610 weight 1.000
assign (resid  6 and name  HD2) (resid    6 and name  HD1) 1.939 0.470 0.470 weight 1.000
assign (resid  6 and name  HG2) (resid    6 and name  HD2) 2.165 0.586 0.586 weight 1.000
assign (resid  6 and name  HG2) (resid    6 and name  HD1) 1.882 0.443 0.443 weight 1.000
assign (resid 48 and name  HG2) (resid   48 and name  HG1) 2.109 0.556 0.556 weight 1.000
assign (resid  7 and name  HG2) (resid    7 and name  HB1) 2.233 0.623 0.623 weight 1.000
    or (resid  7 and name  HG1) (resid    7 and name  HB1)
assign (resid 93 and name  HG1) (resid    6 and name  HD1) 2.273 0.646 0.646 weight 1.000
assign (resid 12 and name  HD1) (resid   12 and name  HB2) 2.256 0.636 0.636 weight 1.000
assign (resid 12 and name  HB2) (resid   12 and name  HD2) 2.464 0.759 0.759 weight 1.000
assign (resid 80 and name HG11) (resid   80 and name   HA) 1.960 0.480 0.480 weight 1.000
assign (resid 76 and name HG22) (resid   76 and name HG12) 1.884 0.443 0.443 weight 1.000
    or (resid 76 and name HG22) (resid   76 and name HG11)
    or (resid 76 and name HG22) (resid   76 and name HG13)
    or (resid 76 and name HG21) (resid   76 and name HG12)
    or (resid 76 and name HG21) (resid   76 and name HG11)
    or (resid 76 and name HG21) (resid   76 and name HG13)
    or (resid 76 and name HG23) (resid   76 and name HG12)
    or (resid 76 and name HG23) (resid   76 and name HG11)
    or (resid 76 and name HG23) (resid   76 and name HG13)
assign (resid 60 and name   HB) (resid   60 and name HD12) 1.969 0.485 0.485 weight 1.000
    or (resid 60 and name   HB) (resid   60 and name HD11)
    or (resid 60 and name   HB) (resid   60 and name HD13)
assign (resid  9 and name HG11) (resid    9 and name   HB) 2.163 0.585 0.585 weight 1.000
assign (resid 41 and name  HB1) (resid   20 and name HG21) 2.667 0.889 0.889 weight 1.000
    or (resid 41 and name  HB1) (resid   20 and name HG22)
    or (resid 41 and name  HB1) (resid   20 and name HG23)
assign (resid 30 and name   HA) (resid   30 and name  HB2) 2.632 0.866 0.866 weight 1.000
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assign (resid 15 and name  HB1) (resid   15 and name  HG2) 2.081 0.541 0.541 weight 1.000
assign (resid 16 and name  HG2) (resid   16 and name  HE2) 2.626 0.862 0.862 weight 1.000
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assign (resid 44 and name   HA) (resid   44 and name   HN) 2.776 0.963 0.963 weight 1.000
assign (resid 39 and name  HB2) (resid   39 and name  HB1) 2.149 0.577 0.577 weight 1.000
assign (resid 81 and name   HN) (resid   81 and name   HG) 2.365 0.699 0.699 weight 1.000
assign (resid 27 and name   HN) (resid   27 and name  HD1) 2.965 1.099 1.099 weight 1.000
    or (resid 27 and name   HN) (resid   27 and name  HD2)
assign (resid 27 and name  HB2) (resid   27 and name  HD1) 2.651 0.879 0.879 weight 1.000
    or (resid 27 and name  HB2) (resid   27 and name  HD2)
assign (resid 34 and name  HD1) (resid   34 and name  HB2) 2.771 0.960 0.960 weight 1.000
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assign (resid 34 and name  HD1) (resid   34 and name  HB1) 2.707 0.916 0.916 weight 1.000
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assign (resid 17 and name  HD1) (resid   17 and name  HB2) 2.540 0.807 0.807 weight 1.000
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assign (resid 19 and name  HD1) (resid   19 and name  HB1) 2.578 0.831 0.831 weight 1.000
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assign (resid 17 and name  HD1) (resid   17 and name  HB1) 2.548 0.811 0.811 weight 1.000
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assign (resid 10 and name HG22) (resid   17 and name  HD1) 2.190 0.600 0.600 weight 1.000
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    or (resid 10 and name HG21) (resid   17 and name  HD1)
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assign (resid 19 and name  HD1) (resid   54 and name HD12) 2.780 0.966 0.966 weight 1.000
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    or (resid 19 and name  HD1) (resid   54 and name HD13)
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    or (resid 19 and name  HD2) (resid   54 and name HD11)
    or (resid 19 and name  HD2) (resid   54 and name HD13)
assign (resid 73 and name  HD2) (resid   74 and name   HA) 3.034 1.151 1.151 weight 1.000
assign (resid 73 and name  HD2) (resid   73 and name  HB2) 2.987 1.115 1.115 weight 1.000
assign (resid 19 and name  HE1) (resid   17 and name  HB2) 3.042 1.157 1.157 weight 1.000
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assign (resid 19 and name  HE1) (resid   17 and name  HB1) 3.077 1.184 1.184 weight 1.000
    or (resid 19 and name  HE2) (resid   17 and name  HB1)
assign (resid 19 and name  HE1) (resid   80 and name HG12) 3.018 1.138 1.138 weight 1.000
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assign (resid 73 and name  HD2) (resid   74 and name HG21) 2.638 0.870 0.870 weight 1.000
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assign (resid 41 and name  HD1) (resid   41 and name  HB1) 2.849 1.014 1.014 weight 1.000
assign (resid 41 and name  HD1) (resid   41 and name  HB2) 2.707 0.916 0.916 weight 1.000
assign (resid 20 and name HG21) (resid   41 and name  HD1) 2.423 0.734 0.734 weight 1.000
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assign (resid 41 and name  HE3) (resid   41 and name  HB1) 3.087 1.191 1.191 weight 1.000
assign (resid 41 and name  HE3) (resid   39 and name  HB1) 2.994 1.121 1.121 weight 1.000
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assign (resid 12 and name   HN) (resid   17 and name  HE1) 2.384 0.711 0.711 weight 1.000
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assign (resid 17 and name  HD1) (resid   17 and name  HE1) 1.880 0.442 0.442 weight 1.000
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    or (resid 17 and name  HD2) (resid   17 and name  HE1)
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assign (resid 42 and name  HD2) (resid   44 and name  HG2) 3.018 1.138 1.138 weight 1.000
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assign (resid 69 and name  HD2) (resid   68 and name   HB) 3.180 1.264 1.264 weight 1.000
assign (resid 62 and name  HD2) (resid   67 and name  HB2) 3.010 1.132 1.132 weight 1.000
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assign (resid 17 and name  HE1) (resid   12 and name  HB2) 2.629 0.864 0.864 weight 1.000
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assign (resid 34 and name  HE1) (resid   36 and name HG22) 2.099 0.551 0.551 weight 1.000
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    or (resid 34 and name  HE2) (resid   36 and name HG22)
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assign (resid 69 and name  HD2) (resid   68 and name HG22) 2.226 0.619 0.619 weight 1.000
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    or (resid 69 and name  HD2) (resid   68 and name HG12)
    or (resid 69 and name  HD2) (resid   68 and name HG11)
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assign (resid 87 and name HG12) (resid   17 and name  HE1) 2.513 0.789 0.789 weight 1.000
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    or (resid 87 and name HG13) (resid   17 and name  HE1)
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assign (resid 41 and name  HH2) (resid   41 and name  HZ2) 2.250 0.633 0.633 weight 1.000
assign (resid 62 and name  HD2) (resid   62 and name  HB1) 2.972 1.104 1.104 weight 1.000
assign (resid 17 and name   HN) (resid   17 and name  HD1) 2.871 1.030 1.030 weight 1.000
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assign (resid 62 and name  HD2) (resid   62 and name  HB2) 3.298 1.359 1.359 weight 1.000
assign (resid 41 and name  HE3) (resid   41 and name  HZ3) 2.144 0.575 0.575 weight 1.000
assign (resid 11 and name  HD2) (resid   86 and name  HB2) 3.298 1.359 1.359 weight 1.000
assign (resid 26 and name   HN) (resid   37 and name  HD2) 3.313 1.372 1.372 weight 1.000
assign (resid 41 and name  HZ3) (resid   39 and name  HB2) 3.361 1.412 1.412 weight 1.000
assign (resid 17 and name  HD1) (resid   48 and name  HB1) 3.158 1.246 1.246 weight 1.000
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assign (resid 17 and name  HD1) (resid   10 and name HD12) 2.754 0.948 0.948 weight 1.000
    or (resid 17 and name  HD1) (resid   10 and name HD11)
    or (resid 17 and name  HD1) (resid   10 and name HD13)
    or (resid 17 and name  HD2) (resid   10 and name HD12)
    or (resid 17 and name  HD2) (resid   10 and name HD11)
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assign (resid 21 and name HD12) (resid   19 and name  HE1) 2.219 0.615 0.615 weight 1.000
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    or (resid 21 and name HD11) (resid   19 and name  HE1)
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assign (resid 89 and name HD12) (resid   19 and name  HE1) 2.219 0.615 0.615 weight 1.000
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assign (resid 19 and name  HD1) (resid   40 and name HG22) 2.345 0.687 0.687 weight 1.000
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    or (resid 19 and name  HD2) (resid   40 and name HG22)
    or (resid 19 and name  HD2) (resid   40 and name HG21)
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assign (resid 27 and name  HB1) (resid   27 and name  HD1) 2.651 0.879 0.879 weight 1.000
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assign (resid 11 and name  HD2) (resid   11 and name  HB2) 2.573 0.827 0.827 weight 1.000
assign (resid 73 and name  HD2) (resid   77 and name HG22) 2.638 0.870 0.870 weight 1.000
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assign (resid 41 and name   HN) (resid   42 and name   HN) 2.860 1.022 1.022 weight 1.000
assign (resid 41 and name   HN) (resid   21 and name   HA) 3.157 1.246 1.246 weight 1.000
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assign (resid 41 and name   HN) (resid   41 and name  HB1) 2.848 1.014 1.014 weight 1.000
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assign (resid 41 and name   HN) (resid   20 and name HG21) 3.328 1.385 1.385 weight 1.000
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assign (resid 41 and name   HN) (resid   21 and name HD12) 3.705 1.716 1.716 weight 1.000
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assign (resid 21 and name   HN) (resid   19 and name  HD1) 3.651 1.666 1.666 weight 1.000
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assign (resid 41 and name  HE1) (resid   41 and name  HZ2) 2.726 0.929 0.929 weight 1.000
assign (resid 41 and name  HE1) (resid   41 and name  HD1) 2.371 0.703 0.703 weight 1.000
assign (resid 41 and name  HE1) (resid   20 and name HG21) 3.514 1.543 1.543 weight 1.000
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assign (resid 23 and name   HN) (resid   22 and name   HN) 3.648 1.664 1.664 weight 1.000
assign (resid  9 and name   HN) (resid   89 and name   HN) 3.668 1.682 1.682 weight 1.000
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assign (resid 88 and name   HN) (resid   87 and name   HN) 3.322 1.380 1.380 weight 1.000
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assign (resid 88 and name   HN) (resid   64 and name   HN) 3.024 1.143 1.143 weight 1.000
assign (resid 88 and name   HN) (resid   88 and name   HA) 2.851 1.016 1.016 weight 1.000
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assign (resid 23 and name   HN) (resid   22 and name  HD2) 3.562 1.586 1.586 weight 1.000
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assign (resid 88 and name   HN) (resid   87 and name   HB) 2.871 1.031 1.031 weight 1.000
assign (resid 64 and name   HN) (resid   88 and name  HB2) 2.637 0.869 0.869 weight 1.000
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assign (resid 64 and name   HN) (resid   87 and name HG22) 3.119 1.216 1.216 weight 1.000
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assign (resid  9 and name   HN) (resid    9 and name HG11) 2.724 0.928 0.928 weight 1.000
assign (resid 88 and name   HN) (resid   87 and name HG22) 2.322 0.674 0.674 weight 1.000
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assign (resid 64 and name   HN) (resid   63 and name HG22) 2.483 0.770 0.770 weight 1.000
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assign (resid  9 and name   HN) (resid    8 and name HG22) 2.370 0.702 0.702 weight 1.000
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assign (resid 88 and name   HN) (resid   87 and name HG12) 3.001 1.125 1.125 weight 1.000
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assign (resid 27 and name   HN) (resid   26 and name   HA) 2.705 0.915 0.915 weight 1.000
assign (resid 27 and name   HN) (resid   27 and name  HB1) 2.989 1.116 1.116 weight 1.000
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assign (resid 27 and name   HN) (resid   26 and name HG12) 3.351 1.404 1.404 weight 1.000
    or (resid 27 and name   HN) (resid   26 and name HG11)
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assign (resid 37 and name   HN) (resid   36 and name   HN) 3.125 1.220 1.220 weight 1.000
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assign (resid 37 and name   HN) (resid   37 and name  HD2) 3.225 1.300 1.300 weight 1.000
assign (resid 11 and name   HN) (resid   17 and name  HE1) 3.660 1.674 1.674 weight 1.000
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assign (resid 37 and name   HN) (resid   24 and name HG12) 2.821 0.995 0.995 weight 1.000
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assign (resid 55 and name   HN) (resid   54 and name   HN) 3.514 1.543 1.543 weight 1.000
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assign (resid 33 and name   HN) (resid   33 and name HG12) 2.291 0.656 0.656 weight 1.000
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assign (resid 62 and name   HN) (resid   61 and name HG21) 2.952 1.089 1.089 weight 1.000
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assign (resid 62 and name   HN) (resid   60 and name HG22) 2.328 0.678 0.678 weight 1.000
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assign (resid 76 and name   HN) (resid   72 and name HG12) 3.023 1.142 1.142 weight 1.000
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assign (resid 76 and name   HN) (resid   71 and name HD22) 2.738 0.937 0.937 weight 1.000
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    or (resid 76 and name   HN) (resid   71 and name HD12)
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assign (resid 49 and name   HN) (resid   10 and name HD12) 3.211 1.289 1.289 weight 1.000
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assign (resid 76 and name   HN) (resid   76 and name HG22) 2.651 0.878 0.878 weight 1.000
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assign (resid 49 and name   HN) (resid   54 and name HD12) 3.411 1.455 1.455 weight 1.000
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assign (resid 71 and name   HN) (resid   76 and name HG12) 3.267 1.334 1.334 weight 1.000
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assign (resid 38 and name  HD2) (resid   76 and name HG12) 3.116 1.214 1.214 weight 1.000
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assign (resid 87 and name   HN) (resid   17 and name  HE1) 2.873 1.032 1.032 weight 1.000
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assign (resid 87 and name   HN) (resid   11 and name   HA) 2.880 1.037 1.037 weight 1.000
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assign (resid 24 and name   HN) (resid   24 and name HG12) 2.794 0.976 0.976 weight 1.000
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assign (resid 24 and name   HN) (resid   24 and name HD12) 3.026 1.145 1.145 weight 1.000
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assign (resid 58 and name   HN) (resid   40 and name HG12) 3.297 1.358 1.358 weight 1.000
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assign (resid 86 and name   HN) (resid   85 and name  HB2) 2.757 0.950 0.950 weight 1.000
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assign (resid 78 and name   HN) (resid   77 and name HG22) 2.745 0.942 0.942 weight 1.000
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assign (resid 20 and name   HN) (resid   20 and name HG21) 2.983 1.112 1.112 weight 1.000
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assign (resid 70 and name   HN) (resid   69 and name   HA) 2.965 1.099 1.099 weight 1.000
assign (resid 42 and name   HN) (resid   42 and name   HA) 2.610 0.852 0.852 weight 1.000
assign (resid 35 and name   HN) (resid   35 and name   HB) 3.031 1.148 1.148 weight 1.000
assign (resid 70 and name   HN) (resid   70 and name  HA2) 3.269 1.336 1.336 weight 1.000
assign (resid 42 and name   HN) (resid   20 and name   HB) 2.379 0.708 0.708 weight 1.000
assign (resid 70 and name   HN) (resid   70 and name  HA1) 3.200 1.280 1.280 weight 1.000
assign (resid 70 and name   HN) (resid   69 and name  HB1) 3.567 1.590 1.590 weight 1.000
assign (resid 42 and name   HN) (resid   42 and name  HB2) 2.661 0.885 0.885 weight 1.000
assign (resid 42 and name   HN) (resid   42 and name  HB1) 2.564 0.822 0.822 weight 1.000
assign (resid 35 and name   HN) (resid   34 and name  HB2) 2.817 0.992 0.992 weight 1.000
assign (resid 42 and name   HN) (resid   22 and name  HD2) 3.490 1.523 1.523 weight 1.000
    or (resid 42 and name   HN) (resid   22 and name  HD1)
assign (resid 35 and name   HN) (resid   34 and name  HB1) 3.002 1.127 1.127 weight 1.000
assign (resid 42 and name   HN) (resid   56 and name  HG1) 3.518 1.547 1.547 weight 1.000
assign (resid 42 and name   HN) (resid   20 and name HG21) 2.895 1.048 1.048 weight 1.000
    or (resid 42 and name   HN) (resid   20 and name HG22)
    or (resid 42 and name   HN) (resid   20 and name HG23)
assign (resid 35 and name   HN) (resid   35 and name HG21) 3.073 1.180 1.180 weight 1.000
    or (resid 35 and name   HN) (resid   35 and name HG22)
    or (resid 35 and name   HN) (resid   35 and name HG23)
assign (resid 35 and name   HN) (resid   33 and name HG22) 3.268 1.335 1.335 weight 1.000
    or (resid 35 and name   HN) (resid   33 and name HG21)
    or (resid 35 and name   HN) (resid   33 and name HG23)
assign (resid 42 and name   HN) (resid   40 and name HG22) 2.605 0.848 0.848 weight 1.000
    or (resid 42 and name   HN) (resid   40 and name HG21)
    or (resid 42 and name   HN) (resid   40 and name HG23)
assign (resid 81 and name   HN) (resid   83 and name   HN) 3.520 1.549 1.549 weight 1.000
assign (resid 82 and name   HN) (resid   83 and name   HN) 2.391 0.714 0.714 weight 1.000
assign (resid 83 and name   HN) (resid   64 and name HD22) 3.406 1.450 1.450 weight 1.000
assign (resid 83 and name   HN) (resid   84 and name   HN) 2.838 1.007 1.007 weight 1.000
assign (resid 25 and name HH21) (resid   25 and name HH22) 1.915 0.458 0.458 weight 1.000
assign (resid 83 and name   HN) (resid   83 and name  HB1) 2.259 0.638 0.638 weight 1.000
assign (resid 83 and name   HN) (resid   80 and name   HA) 2.987 1.115 1.115 weight 1.000
assign (resid 83 and name   HN) (resid   82 and name  HD2) 3.052 1.164 1.164 weight 1.000
    or (resid 83 and name   HN) (resid   82 and name  HD1)
assign (resid 83 and name   HN) (resid   87 and name HG22) 2.920 1.066 1.066 weight 1.000
    or (resid 83 and name   HN) (resid   87 and name HG21)
    or (resid 83 and name   HN) (resid   87 and name HG23)
assign (resid 68 and name   HN) (resid   62 and name  HD2) 3.484 1.517 1.517 weight 1.000
assign (resid 68 and name   HN) (resid   62 and name   HA) 2.757 0.950 0.950 weight 1.000
assign (resid 68 and name   HN) (resid   67 and name   HA) 2.177 0.593 0.593 weight 1.000
assign (resid 68 and name   HN) (resid   67 and name  HD2) 3.607 1.626 1.626 weight 1.000
assign (resid 68 and name   HN) (resid   68 and name   HB) 3.010 1.133 1.133 weight 1.000
assign (resid 68 and name   HN) (resid   67 and name  HB2) 2.702 0.912 0.912 weight 1.000
    or (resid 68 and name   HN) (resid   67 and name  HB1)
assign (resid 68 and name   HN) (resid   68 and name HG22) 2.200 0.605 0.605 weight 1.000
    or (resid 68 and name   HN) (resid   68 and name HG21)
    or (resid 68 and name   HN) (resid   68 and name HG23)
    or (resid 68 and name   HN) (resid   68 and name HG12)
    or (resid 68 and name   HN) (resid   68 and name HG11)
    or (resid 68 and name   HN) (resid   68 and name HG13)
assign (resid 68 and name   HN) (resid   76 and name HG12) 3.662 1.677 1.677 weight 1.000
    or (resid 68 and name   HN) (resid   76 and name HG11)
    or (resid 68 and name   HN) (resid   76 and name HG13)
assign (resid 17 and name   HN) (resid   18 and name   HN) 2.527 0.798 0.798 weight 1.000
assign (resid 18 and name   HN) (resid   19 and name  HD1) 3.172 1.258 1.258 weight 1.000
    or (resid 18 and name   HN) (resid   19 and name  HD2)
assign (resid 18 and name   HN) (resid   16 and name   HA) 2.956 1.092 1.092 weight 1.000
assign (resid 18 and name   HN) (resid   18 and name  HA1) 2.629 0.864 0.864 weight 1.000
assign (resid 18 and name   HN) (resid   18 and name  HA2) 2.461 0.757 0.757 weight 1.000
assign (resid 18 and name   HN) (resid   17 and name  HB2) 3.228 1.302 1.302 weight 1.000
assign (resid 18 and name   HN) (resid   16 and name  HB2) 2.662 0.886 0.886 weight 1.000
assign (resid 18 and name   HN) (resid   16 and name  HB1) 2.819 0.993 0.993 weight 1.000
assign (resid 47 and name   HN) (resid   50 and name   HN) 3.164 1.251 1.251 weight 1.000
assign (resid 47 and name   HN) (resid   51 and name   HN) 3.404 1.449 1.449 weight 1.000
assign (resid 74 and name   HN) (resid   73 and name  HD2) 3.431 1.472 1.472 weight 1.000
assign (resid 47 and name   HN) (resid   47 and name  HA1) 2.425 0.735 0.735 weight 1.000
assign (resid 74 and name   HN) (resid   74 and name   HB) 2.953 1.090 1.090 weight 1.000
assign (resid 74 and name   HN) (resid   73 and name   HA) 3.233 1.306 1.306 weight 1.000
assign (resid 47 and name   HN) (resid   47 and name  HA2) 2.126 0.565 0.565 weight 1.000
assign (resid 74 and name   HN) (resid   74 and name   HA) 2.729 0.931 0.931 weight 1.000
assign (resid 47 and name   HN) (resid   46 and name  HA2) 2.630 0.864 0.864 weight 1.000
assign (resid 47 and name   HN) (resid   48 and name  HD1) 3.107 1.206 1.206 weight 1.000
assign (resid 74 and name   HN) (resid   73 and name  HB2) 2.726 0.929 0.929 weight 1.000
assign (resid 74 and name   HN) (resid   73 and name  HB1) 2.944 1.083 1.083 weight 1.000
assign (resid 74 and name   HN) (resid   72 and name   HB) 3.437 1.477 1.477 weight 1.000
assign (resid 47 and name   HN) (resid   51 and name  HG2) 3.344 1.397 1.397 weight 1.000
assign (resid 47 and name   HN) (resid   44 and name  HB1) 3.265 1.333 1.333 weight 1.000
assign (resid 84 and name   HN) (resid   84 and name  HA1) 2.646 0.875 0.875 weight 1.000
assign (resid 54 and name   HN) (resid   53 and name   HN) 2.189 0.599 0.599 weight 1.000
assign (resid 53 and name   HN) (resid   53 and name  HA2) 2.352 0.691 0.691 weight 1.000
assign (resid 53 and name   HN) (resid   51 and name   HA) 2.814 0.990 0.990 weight 1.000
assign (resid 53 and name   HN) (resid   51 and name  HB2) 3.448 1.486 1.486 weight 1.000
    or (resid 53 and name   HN) (resid   51 and name  HB1)
assign (resid 53 and name   HN) (resid   54 and name  HB1) 3.241 1.313 1.313 weight 1.000
assign (resid 53 and name   HN) (resid    8 and name HG22) 3.164 1.251 1.251 weight 1.000
    or (resid 53 and name   HN) (resid    8 and name HG21)
    or (resid 53 and name   HN) (resid    8 and name HG23)
assign (resid 65 and name   HN) (resid   65 and name  HA2) 2.940 1.080 1.080 weight 1.000
assign (resid 65 and name   HN) (resid   65 and name  HA1) 2.903 1.053 1.053 weight 1.000
assign (resid 65 and name   HN) (resid   64 and name  HB2) 3.626 1.643 1.643 weight 1.000
    or (resid 65 and name   HN) (resid   64 and name  HB1)
assign (resid 65 and name   HN) (resid   62 and name  HB1) 3.594 1.615 1.615 weight 1.000
assign (resid 74 and name   HN) (resid   75 and name  HB2) 3.875 1.877 1.877 weight 1.000
assign (resid 74 and name   HN) (resid   75 and name  HG2) 3.762 1.769 1.769 weight 1.000
    or (resid 74 and name   HN) (resid   75 and name  HG1)
assign (resid 74 and name   HN) (resid   77 and name   HB) 3.821 1.825 1.825 weight 1.000
assign (resid 18 and name   HN) (resid   48 and name  HD1) 3.837 1.841 1.841 weight 1.000
assign (resid 16 and name   HN) (resid   18 and name   HN) 3.871 1.873 1.873 weight 1.000
assign (resid 16 and name   HN) (resid   16 and name  HE2) 3.806 1.810 1.810 weight 1.000
    or (resid 16 and name   HN) (resid   16 and name  HE1)
assign (resid 16 and name   HN) (resid   12 and name  HD2) 3.708 1.719 1.719 weight 1.000
assign (resid 80 and name   HN) (resid   77 and name   HA) 2.664 0.887 0.887 weight 1.000
assign (resid 82 and name   HN) (resid   82 and name  HE2) 3.849 1.852 1.852 weight 1.000
    or (resid 82 and name   HN) (resid   82 and name  HE1)
assign (resid 82 and name   HN) (resid   78 and name  HG2) 3.744 1.753 1.753 weight 1.000
assign (resid 69 and name   HN) (resid   62 and name   HA) 3.769 1.776 1.776 weight 1.000
assign (resid 69 and name   HN) (resid   71 and name   HG) 3.875 1.877 1.877 weight 1.000
assign (resid 71 and name   HN) (resid   75 and name  HB2) 3.728 1.737 1.737 weight 1.000
assign (resid 75 and name   HN) (resid   73 and name  HB2) 3.915 1.916 1.916 weight 1.000
assign (resid 63 and name   HN) (resid   65 and name  HA1) 3.741 1.749 1.749 weight 1.000
assign (resid 63 and name   HN) (resid   66 and name   HA) 3.715 1.725 1.725 weight 1.000
assign (resid 60 and name   HN) (resid   38 and name  HB2) 3.648 1.664 1.664 weight 1.000
assign (resid 60 and name   HN) (resid   38 and name  HB1) 3.802 1.807 1.807 weight 1.000
assign (resid 66 and name   HN) (resid   79 and name   HG) 3.769 1.776 1.776 weight 1.000
assign (resid 44 and name   HN) (resid   54 and name HD12) 3.985 1.985 1.985 weight 1.000
    or (resid 44 and name   HN) (resid   54 and name HD11)
    or (resid 44 and name   HN) (resid   54 and name HD13)
assign (resid 64 and name   HN) (resid   65 and name  HA1) 3.751 1.759 1.759 weight 1.000
assign (resid 64 and name   HN) (resid   62 and name  HB2) 3.813 1.818 1.818 weight 1.000
assign (resid 41 and name   HN) (resid   40 and name   HB) 3.765 1.772 1.772 weight 1.000
assign (resid 41 and name   HN) (resid   22 and name  HD2) 4.023 2.023 2.023 weight 1.000
    or (resid 41 and name   HN) (resid   22 and name  HD1)
assign (resid 41 and name   HN) (resid   39 and name  HB1) 3.762 1.769 1.769 weight 1.000
assign (resid 41 and name   HN) (resid   41 and name  HD1) 3.858 1.860 1.860 weight 1.000
assign (resid 19 and name   HN) (resid   54 and name HD12) 3.969 1.969 1.969 weight 1.000
    or (resid 19 and name   HN) (resid   54 and name HD11)
    or (resid 19 and name   HN) (resid   54 and name HD13)
assign (resid 71 and name   HN) (resid   71 and name   HA) 2.708 0.916 0.916 weight 1.000
assign (resid 73 and name   HN) (resid   72 and name   HA) 3.312 1.371 1.371 weight 1.000
assign (resid 27 and name   HN) (resid   27 and name   HA) 3.104 1.204 1.204 weight 1.000
assign (resid 11 and name   HN) (resid   86 and name   HA) 3.755 1.762 1.762 weight 1.000
assign (resid 73 and name   HN) (resid   73 and name   HA) 4.029 2.029 2.029 weight 1.000
assign (resid 73 and name   HN) (resid   72 and name HG22) 3.930 1.930 1.930 weight 1.000
    or (resid 73 and name   HN) (resid   72 and name HG21)
    or (resid 73 and name   HN) (resid   72 and name HG23)
assign (resid 90 and name   HN) (resid    7 and name  HB2) 3.692 1.704 1.704 weight 1.000
assign (resid 57 and name   HN) (resid   58 and name  HB2) 3.758 1.766 1.766 weight 1.000
assign (resid 40 and name   HN) (resid   58 and name   HN) 3.985 1.985 1.985 weight 1.000
assign (resid 59 and name   HN) (resid   58 and name   HN) 3.985 1.985 1.985 weight 1.000
assign (resid 92 and name   HN) (resid   59 and name   HN) 2.672 0.892 0.892 weight 1.000
assign (resid 60 and name   HN) (resid   59 and name   HG) 2.589 0.838 0.838 weight 1.000
assign (resid 60 and name   HN) (resid   40 and name   HN) 3.939 1.940 1.940 weight 1.000
assign (resid 60 and name   HN) (resid   38 and name   HN) 3.939 1.940 1.940 weight 1.000
assign (resid 41 and name   HN) (resid   22 and name   HN) 3.325 1.382 1.382 weight 1.000
assign (resid 49 and name   HN) (resid   18 and name   HN) 3.964 1.964 1.964 weight 1.000
assign (resid 65 and name   HN) (resid   68 and name HG22) 3.925 1.925 1.925 weight 1.000
    or (resid 65 and name   HN) (resid   68 and name HG21)
    or (resid 65 and name   HN) (resid   68 and name HG23)
    or (resid 65 and name   HN) (resid   68 and name HG12)
    or (resid 65 and name   HN) (resid   68 and name HG11)
    or (resid 65 and name   HN) (resid   68 and name HG13)
assign (resid 65 and name   HN) (resid   88 and name  HB2) 3.884 1.885 1.885 weight 1.000
    or (resid 65 and name   HN) (resid   88 and name  HB1)
    or (resid 65 and name   HN) (resid   88 and name  HB3)
assign (resid 65 and name   HN) (resid   62 and name  HB2) 3.738 1.746 1.746 weight 1.000
assign (resid 74 and name   HN) (resid   73 and name   HN) 3.817 1.822 1.822 weight 1.000
assign (resid 47 and name   HN) (resid   45 and name  HB2) 3.708 1.719 1.719 weight 1.000
    or (resid 47 and name   HN) (resid   45 and name  HB1)
assign (resid 68 and name   HN) (resid   69 and name  HD2) 3.738 1.746 1.746 weight 1.000
assign (resid 68 and name   HN) (resid   71 and name   HG) 3.806 1.810 1.810 weight 1.000
assign (resid 68 and name   HN) (resid   62 and name  HB2) 3.875 1.877 1.877 weight 1.000
assign (resid 90 and name   HN) (resid   64 and name   HN) 3.711 1.722 1.722 weight 1.000
assign (resid 37 and name   HN) (resid   35 and name   HB) 4.012 2.012 2.012 weight 1.000
assign (resid 18 and name   HN) (resid   17 and name  HD1) 3.172 1.258 1.258 weight 1.000
    or (resid 18 and name   HN) (resid   17 and name  HD2)
assign (resid 33 and name   HN) (resid   31 and name  HB2) 2.502 0.783 0.783 weight 1.000
assign (resid 83 and name   HN) (resid   82 and name  HG2) 3.052 1.164 1.164 weight 1.000
    or (resid 83 and name   HN) (resid   82 and name  HG1)
assign (resid 69 and name   HN) (resid   69 and name  HB1) 2.326 0.676 0.676 weight 1.000
assign (resid 70 and name   HN) (resid   69 and name  HB2) 3.567 1.590 1.590 weight 1.000
assign (resid 27 and name   HN) (resid   27 and name  HB2) 2.989 1.116 1.116 weight 1.000
assign (resid 78 and name   HN) (resid   77 and name   HB) 2.120 0.562 0.562 weight 1.000
assign (resid 51 and name   HN) (resid   51 and name  HG2) 2.016 0.508 0.508 weight 1.000
assign (resid 66 and name   HN) (resid   67 and name  HD2) 2.908 1.057 1.057 weight 1.000
assign (resid 12 and name   HN) (resid   12 and name  HB1) 2.368 0.701 0.701 weight 1.000
assign (resid 78 and name   HN) (resid   78 and name  HG2) 2.657 0.882 0.882 weight 1.000
assign (resid 51 and name   HN) (resid   50 and name  HB2) 2.084 0.543 0.543 weight 1.000
assign (resid 56 and name   HN) (resid   56 and name  HB1) 2.234 0.624 0.624 weight 1.000
assign (resid 24 and name   HN) (resid   36 and name HG12) 3.026 1.145 1.145 weight 1.000
    or (resid 24 and name   HN) (resid   36 and name HG11)
    or (resid 24 and name   HN) (resid   36 and name HG13)
assign (resid 38 and name   HN) (resid   37 and name  HB2) 2.867 1.027 1.027 weight 1.000
assign (resid 36 and name   HN) (resid   35 and name HG21) 2.622 0.859 0.859 weight 1.000
    or (resid 36 and name   HN) (resid   35 and name HG22)
    or (resid 36 and name   HN) (resid   35 and name HG23)
assign (resid 76 and name   HN) (resid   77 and name   HN) 2.284 0.652 0.652 weight 1.000
assign (resid 92 and name   HN) (resid   93 and name  HD1) 3.645 1.661 1.661 weight 1.000
assign (resid 50 and name   HN) (resid   54 and name HD12) 3.734 1.743 1.743 weight 1.000
    or (resid 50 and name   HN) (resid   54 and name HD11)
    or (resid 50 and name   HN) (resid   54 and name HD13)
assign (resid 64 and name HD21) (resid   83 and name   HA) 3.456 1.493 1.493 weight 1.000
assign (resid 64 and name HD22) (resid   83 and name   HA) 3.254 1.323 1.323 weight 1.000
assign (resid 83 and name   HN) (resid   87 and name HG12) 3.794 1.800 1.800 weight 1.000
    or (resid 83 and name   HN) (resid   87 and name HG11)
    or (resid 83 and name   HN) (resid   87 and name HG13)
assign (resid 88 and name   HN) (resid    9 and name HG22) 2.894 1.047 1.047 weight 1.000
    or (resid 88 and name   HN) (resid    9 and name HG21)
    or (resid 88 and name   HN) (resid    9 and name HG23)
assign (resid 68 and name   HN) (resid   69 and name  HB1) 3.518 1.547 1.547 weight 1.000
assign (resid 42 and name   HN) (resid   41 and name  HB2) 2.564 0.822 0.822 weight 1.000
assign (resid 42 and name   HN) (resid   41 and name  HB1) 2.661 0.885 0.885 weight 1.000
assign (resid 82 and name   HN) (resid   82 and name  HB2) 2.109 0.556 0.556 weight 1.000
assign (resid 79 and name   HN) (resid   78 and name  HB2) 2.098 0.550 0.550 weight 1.000
assign (resid 64 and name   HN) (resid   87 and name HG12) 3.718 1.728 1.728 weight 1.000
    or (resid 64 and name   HN) (resid   87 and name HG11)
    or (resid 64 and name   HN) (resid   87 and name HG13)
assign (resid 22 and name   HN) (resid   21 and name   HN) 3.230 1.304 1.304 weight 1.000
assign (resid 34 and name   HN) (resid   34 and name  HB2) 3.003 1.127 1.127 weight 1.000
assign (resid 57 and name   HN) (resid   56 and name  HG2) 2.982 1.112 1.112 weight 1.000
assign (resid 83 and name   HN) (resid   82 and name  HB2) 2.639 0.870 0.870 weight 1.000
assign (resid 20 and name   HN) (resid   54 and name HD12) 3.944 1.944 1.944 weight 1.000
    or (resid 20 and name   HN) (resid   54 and name HD11)
    or (resid 20 and name   HN) (resid   54 and name HD13)
assign (resid 96 and name   HN) (resid   95 and name  HB1) 2.866 1.026 1.026 weight 1.000
assign (resid 96 and name   HN) (resid   95 and name  HB2) 2.866 1.026 1.026 weight 1.000
assign (resid 38 and name  HD2) (resid   71 and name  HB2) 3.147 1.238 1.238 weight 1.000
assign (resid 88 and name   HN) (resid   63 and name HG22) 2.894 1.047 1.047 weight 1.000
    or (resid 88 and name   HN) (resid   63 and name HG21)
    or (resid 88 and name   HN) (resid   63 and name HG23)
assign (resid 57 and name   HN) (resid   56 and name  HB2) 2.984 1.113 1.113 weight 1.000
assign (resid 10 and name   HN) (resid   10 and name HD12) 2.308 0.666 0.666 weight 1.000
    or (resid 10 and name   HN) (resid   10 and name HD11)
    or (resid 10 and name   HN) (resid   10 and name HD13)
assign (resid 35 and name   HN) (resid   26 and name   HB) 3.002 1.127 1.127 weight 1.000
assign (resid 35 and name   HN) (resid   34 and name   HN) 3.762 1.769 1.769 weight 1.000
assign (resid 17 and name   HN) (resid   18 and name  HA1) 3.527 1.555 1.555 weight 1.000
assign (resid 24 and name   HN) (resid   24 and name   HB) 2.794 0.976 0.976 weight 1.000
assign (resid 16 and name   HN) (resid   15 and name  HD2) 2.339 0.684 0.684 weight 1.000
    or (resid 16 and name   HN) (resid   15 and name  HD1)
assign (resid 16 and name   HN) (resid   12 and name  HG1) 3.139 1.232 1.232 weight 1.000
assign (resid 19 and name   HN) (resid   43 and name HG22) 2.967 1.100 1.100 weight 1.000
    or (resid 19 and name   HN) (resid   43 and name HG21)
    or (resid 19 and name   HN) (resid   43 and name HG23)
assign (resid 17 and name   HN) (resid   10 and name HG22) 3.399 1.444 1.444 weight 1.000
    or (resid 17 and name   HN) (resid   10 and name HG21)
    or (resid 17 and name   HN) (resid   10 and name HG23)
assign (resid 16 and name   HN) (resid   15 and name  HB2) 2.339 0.684 0.684 weight 1.000
assign (resid 16 and name   HN) (resid   12 and name  HG2) 3.139 1.232 1.232 weight 1.000

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1HT      GLY   1  -9.803 -11.517 -12.936
    2    H2   GLY   1           2HT      GLY   1  -8.984 -10.604 -14.099
    3    H3   GLY   1           3HT      GLY   1 -10.673 -10.627 -14.078
    4    HA2  GLY   1           1HA      GLY   1 -10.656  -9.563 -11.889
    5    HA3  GLY   1           2HA      GLY   1  -8.905  -9.453 -12.012
    6    H    GLY   2           H        GLY   2  -8.142  -7.583 -12.751
    7    HA2  GLY   2           2HA      GLY   2  -9.678  -6.105 -14.761
    8    HA3  GLY   2           1HA      GLY   2  -9.277  -5.285 -13.259
    9    H    SER   3           H        SER   3  -8.428  -4.286 -15.671
   10    HA   SER   3           HA       SER   3  -5.532  -4.778 -15.527
   11    HB2  SER   3           2HB      SER   3  -7.089  -4.075 -18.024
   12    HB3  SER   3           1HB      SER   3  -5.368  -4.446 -17.921
   13    HG   SER   3           HG       SER   3  -6.209  -6.532 -16.956
   14    H    MET   4           H        MET   4  -4.207  -3.012 -15.712
   15    HA   MET   4           HA       MET   4  -3.510  -0.880 -15.483
   16    HB2  MET   4           2HB      MET   4  -6.119  -0.237 -16.859
   17    HB3  MET   4           1HB      MET   4  -4.856   0.942 -16.529
   18    HG2  MET   4           2HG      MET   4  -3.312  -0.585 -17.861
   19    HG3  MET   4           1HG      MET   4  -4.777  -1.405 -18.396
   20    HE1  MET   4           3HE      MET   4  -3.963   2.438 -17.739
   21    HE2  MET   4           1HE      MET   4  -3.567   2.923 -19.387
   22    HE3  MET   4           2HE      MET   4  -2.562   1.740 -18.552
   23    H    ARG   5           H        ARG   5  -3.572  -1.016 -13.235
   24    HA   ARG   5           HA       ARG   5  -5.897  -0.320 -11.737
   25    HB2  ARG   5           2HB      ARG   5  -2.984  -0.566 -10.971
   26    HB3  ARG   5           1HB      ARG   5  -4.244  -0.143  -9.819
   27    HG2  ARG   5           2HG      ARG   5  -4.028  -2.412  -9.502
   28    HG3  ARG   5           1HG      ARG   5  -5.381  -2.322 -10.629
   29    HD2  ARG   5           2HD      ARG   5  -3.744  -2.671 -12.489
   30    HD3  ARG   5           1HD      ARG   5  -2.508  -2.965 -11.268
   31    HE   ARG   5           HE       ARG   5  -4.540  -4.688 -10.648
   32   HH11  ARG   5          1HH1      ARG   5  -2.535  -4.112 -13.466
   33   HH12  ARG   5          2HH1      ARG   5  -2.630  -5.756 -14.016
   34   HH21  ARG   5          1HH2      ARG   5  -4.666  -6.840 -11.374
   35   HH22  ARG   5          2HH2      ARG   5  -3.841  -7.302 -12.831
   36    HA   PRO   6           HA       PRO   6  -5.278   4.075 -12.135
   37    HB2  PRO   6           2HB      PRO   6  -7.432   4.596 -10.333
   38    HB3  PRO   6           1HB      PRO   6  -7.493   4.546 -12.096
   39    HG2  PRO   6           2HG      PRO   6  -8.760   2.723 -10.449
   40    HG3  PRO   6           1HG      PRO   6  -8.311   2.415 -12.129
   41    HD2  PRO   6           2HD      PRO   6  -6.880   1.684  -9.602
   42    HD3  PRO   6           1HD      PRO   6  -7.214   0.698 -11.042
   43    HA   PRO   7           HA       PRO   7  -2.966   4.772  -8.283
   44    HB2  PRO   7           2HB      PRO   7  -1.834   7.040  -9.704
   45    HB3  PRO   7           1HB      PRO   7  -1.019   5.636  -9.026
   46    HG2  PRO   7           2HG      PRO   7  -1.259   6.037 -11.683
   47    HG3  PRO   7           1HG      PRO   7  -1.236   4.416 -10.964
   48    HD2  PRO   7           2HD      PRO   7  -3.573   6.022 -11.947
   49    HD3  PRO   7           1HD      PRO   7  -3.259   4.279 -12.099
   50    H    ILE   8           H        ILE   8  -3.753   5.846  -6.654
   51    HA   ILE   8           HA       ILE   8  -5.371   8.226  -7.076
   52    HB   ILE   8           HB       ILE   8  -4.858   6.986  -4.404
   53   HG12  ILE   8          2HG1      ILE   8  -6.940   5.965  -6.317
   54   HG13  ILE   8          1HG1      ILE   8  -5.376   5.213  -6.145
   55   HG21  ILE   8          1HG2      ILE   8  -6.176   9.043  -4.598
   56   HG22  ILE   8          2HG2      ILE   8  -7.132   7.691  -3.991
   57   HG23  ILE   8          3HG2      ILE   8  -7.293   8.197  -5.670
   58   HD11  ILE   8          3HD1      ILE   8  -6.580   5.571  -3.580
   59   HD12  ILE   8          1HD1      ILE   8  -6.035   4.091  -4.367
   60   HD13  ILE   8          2HD1      ILE   8  -7.663   4.699  -4.664
   61    H    ILE   9           H        ILE   9  -4.317  10.088  -7.074
   62    HA   ILE   9           HA       ILE   9  -1.699  10.320  -5.927
   63    HB   ILE   9           HB       ILE   9  -3.258  12.697  -6.847
   64   HG12  ILE   9          2HG1      ILE   9  -3.608  10.866  -8.520
   65   HG13  ILE   9          1HG1      ILE   9  -2.755  12.263  -9.159
   66   HG21  ILE   9          1HG2      ILE   9  -1.080  13.120  -5.942
   67   HG22  ILE   9          2HG2      ILE   9  -0.998  13.356  -7.689
   68   HG23  ILE   9          3HG2      ILE   9  -0.359  11.877  -6.965
   69   HD11  ILE   9          3HD1      ILE   9  -1.734  10.284 -10.002
   70   HD12  ILE   9          1HD1      ILE   9  -1.576   9.613  -8.377
   71   HD13  ILE   9          2HD1      ILE   9  -0.629  11.025  -8.844
   72    H    ILE  10           H        ILE  10  -1.675  10.252  -3.736
   73    HA   ILE  10           HA       ILE  10  -3.560  11.766  -2.135
   74    HB   ILE  10           HB       ILE  10  -0.951  10.500  -1.213
   75   HG12  ILE  10          2HG1      ILE  10  -3.439   9.151  -0.494
   76   HG13  ILE  10          1HG1      ILE  10  -3.053   9.054  -2.185
   77   HG21  ILE  10          1HG2      ILE  10  -2.311  10.396   0.975
   78   HG22  ILE  10          2HG2      ILE  10  -3.320  11.630   0.223
   79   HG23  ILE  10          3HG2      ILE  10  -1.604  11.936   0.488
   80   HD11  ILE  10          3HD1      ILE  10  -0.852   8.165  -1.624
   81   HD12  ILE  10          1HD1      ILE  10  -2.169   7.159  -1.018
   82   HD13  ILE  10          2HD1      ILE  10  -1.301   8.231   0.080
   83    H    HIS  11           H        HIS  11  -2.595  13.399  -0.523
   84    HA   HIS  11           HA       HIS  11  -0.208  14.742  -1.491
   85    HB2  HIS  11           2HB      HIS  11  -2.054  15.844  -2.706
   86    HB3  HIS  11           1HB      HIS  11  -2.882  16.149  -1.183
   87    HD2  HIS  11           2HD      HIS  11   0.580  17.201  -2.786
   88    HE1  HIS  11           1HE      HIS  11  -0.908  20.300  -0.317
   89    HE2  HIS  11           2HE      HIS  11   0.874  19.663  -2.001
   90    H    ARG  12           H        ARG  12   0.999  14.868   0.244
   91    HA   ARG  12           HA       ARG  12   0.029  14.595   2.885
   92    HB2  ARG  12           2HB      ARG  12   2.306  13.955   2.087
   93    HB3  ARG  12           1HB      ARG  12   2.696  15.663   1.952
   94    HG2  ARG  12           2HG      ARG  12   2.463  15.957   4.324
   95    HG3  ARG  12           1HG      ARG  12   1.902  14.291   4.506
   96    HD2  ARG  12           2HD      ARG  12   4.037  13.469   3.696
   97    HD3  ARG  12           1HD      ARG  12   4.600  15.121   3.465
   98    HE   ARG  12           HE       ARG  12   3.836  14.128   6.140
   99   HH11  ARG  12          1HH1      ARG  12   6.224  15.577   4.008
  100   HH12  ARG  12          2HH1      ARG  12   7.331  15.922   5.296
  101   HH21  ARG  12          1HH2      ARG  12   5.281  14.621   7.821
  102   HH22  ARG  12          2HH2      ARG  12   6.796  15.385   7.460
  103    H    ALA  13           H        ALA  13  -1.392  16.141   3.509
  104    HA   ALA  13           HA       ALA  13  -1.009  18.923   2.978
  105    HB1  ALA  13           1HB      ALA  13  -3.245  18.129   3.130
  106    HB2  ALA  13           2HB      ALA  13  -2.974  19.187   4.515
  107    HB3  ALA  13           3HB      ALA  13  -2.956  17.436   4.726
  108    H    GLY  14           H        GLY  14   1.293  18.385   4.051
  109    HA2  GLY  14           2HA      GLY  14   2.757  19.175   5.631
  110    HA3  GLY  14           1HA      GLY  14   1.410  20.020   6.375
  111    H    LYS  15           H        LYS  15   0.902  16.662   6.019
  112    HA   LYS  15           HA       LYS  15   1.964  16.109   8.679
  113    HB2  LYS  15           2HB      LYS  15  -0.315  14.859   9.083
  114    HB3  LYS  15           1HB      LYS  15  -0.145  16.569   9.444
  115    HG2  LYS  15           2HG      LYS  15  -1.464  17.215   7.681
  116    HG3  LYS  15           1HG      LYS  15  -1.121  15.754   6.753
  117    HD2  LYS  15           2HD      LYS  15  -3.352  15.523   7.464
  118    HD3  LYS  15           1HD      LYS  15  -2.412  14.496   8.545
  119    HE2  LYS  15           2HE      LYS  15  -2.427  16.288  10.228
  120    HE3  LYS  15           1HE      LYS  15  -3.410  17.277   9.148
  121    HZ1  LYS  15           3HZ      LYS  15  -5.109  15.514   9.225
  122    HZ2  LYS  15           1HZ      LYS  15  -4.813  16.201  10.741
  123    HZ3  LYS  15           2HZ      LYS  15  -4.178  14.683  10.367
  124    H    LYS  16           H        LYS  16  -0.310  14.228   6.672
  125    HA   LYS  16           HA       LYS  16   1.785  12.419   5.856
  126    HB2  LYS  16           2HB      LYS  16   0.427  10.472   6.908
  127    HB3  LYS  16           1HB      LYS  16   1.530  11.387   7.915
  128    HG2  LYS  16           2HG      LYS  16  -0.473  12.773   8.613
  129    HG3  LYS  16           1HG      LYS  16  -1.462  11.534   7.835
  130    HD2  LYS  16           2HD      LYS  16  -0.650   9.851   9.302
  131    HD3  LYS  16           1HD      LYS  16   0.596  10.921   9.942
  132    HE2  LYS  16           2HE      LYS  16  -1.148  12.352  10.902
  133    HE3  LYS  16           1HE      LYS  16  -2.382  11.260  10.282
  134    HZ1  LYS  16           3HZ      LYS  16  -1.402  11.087  12.727
  135    HZ2  LYS  16           1HZ      LYS  16  -0.308  10.067  11.938
  136    HZ3  LYS  16           2HZ      LYS  16  -1.969   9.744  11.875
  137    H    TYR  17           H        TYR  17   0.622  10.361   4.845
  138    HA   TYR  17           HA       TYR  17  -1.241  11.454   2.892
  139    HB2  TYR  17           2HB      TYR  17  -0.055   8.680   2.930
  140    HB3  TYR  17           1HB      TYR  17  -0.784   9.521   1.556
  141    HD1  TYR  17           1HD      TYR  17   2.195   9.267   3.685
  142    HD2  TYR  17           2HD      TYR  17   0.409  11.265   0.391
  143    HE1  TYR  17           1HE      TYR  17   4.378  10.191   3.079
  144    HE2  TYR  17           2HE      TYR  17   2.604  12.201  -0.234
  145    HH   TYR  17           HH       TYR  17   4.758  12.490   0.444
  146    H    GLY  18           H        GLY  18  -1.536  10.238   5.821
  147    HA2  GLY  18           2HA      GLY  18  -3.217   9.340   7.044
  148    HA3  GLY  18           1HA      GLY  18  -4.251   9.984   5.805
  149    H    PHE  19           H        PHE  19  -1.992   7.264   5.701
  150    HA   PHE  19           HA       PHE  19  -4.109   5.363   5.928
  151    HB2  PHE  19           2HB      PHE  19  -4.172   4.422   3.787
  152    HB3  PHE  19           1HB      PHE  19  -4.285   6.131   3.535
  153    HD1  PHE  19           2HD      PHE  19  -2.067   7.361   2.943
  154    HD2  PHE  19           1HD      PHE  19  -2.617   3.152   2.691
  155    HE1  PHE  19           2HE      PHE  19  -0.137   7.197   1.413
  156    HE2  PHE  19           1HE      PHE  19  -0.695   2.982   1.168
  157    HZ   PHE  19           HZ       PHE  19   0.543   5.007   0.526
  158    H    THR  20           H        THR  20  -3.560   3.336   6.145
  159    HA   THR  20           HA       THR  20  -0.805   2.860   7.040
  160    HB   THR  20           HB       THR  20  -3.280   1.164   7.384
  161    HG1  THR  20           1HG      THR  20  -2.998   3.439   8.365
  162   HG21  THR  20          3HG2      THR  20  -1.146  -0.076   7.646
  163   HG22  THR  20          1HG2      THR  20  -2.067   0.031   9.148
  164   HG23  THR  20          2HG2      THR  20  -0.664   1.073   8.894
  165    H    LEU  21           H        LEU  21   0.651   1.819   5.748
  166    HA   LEU  21           HA       LEU  21  -0.341   0.109   3.601
  167    HB2  LEU  21           2HB      LEU  21   1.722   1.878   3.556
  168    HB3  LEU  21           1HB      LEU  21   2.588   0.419   3.953
  169    HG   LEU  21           HG       LEU  21   2.444  -0.368   1.869
  170   HD11  LEU  21          1HD1      LEU  21  -0.380   0.675   1.710
  171   HD12  LEU  21          2HD1      LEU  21   0.111  -0.982   2.064
  172   HD13  LEU  21          3HD1      LEU  21   0.422  -0.292   0.473
  173   HD21  LEU  21          3HD2      LEU  21   2.311   1.294   0.156
  174   HD22  LEU  21          1HD2      LEU  21   3.091   1.994   1.572
  175   HD23  LEU  21          2HD2      LEU  21   1.407   2.375   1.216
  176    H    ARG  22           H        ARG  22  -1.077  -1.627   4.873
  177    HA   ARG  22           HA       ARG  22   0.581  -2.996   6.752
  178    HB2  ARG  22           2HB      ARG  22  -2.081  -3.008   6.178
  179    HB3  ARG  22           1HB      ARG  22  -1.587  -4.512   5.419
  180    HG2  ARG  22           2HG      ARG  22  -2.277  -5.042   7.612
  181    HG3  ARG  22           1HG      ARG  22  -0.514  -5.144   7.598
  182    HD2  ARG  22           2HD      ARG  22  -0.348  -2.956   8.615
  183    HD3  ARG  22           1HD      ARG  22  -2.100  -2.759   8.539
  184    HE   ARG  22           HE       ARG  22  -1.442  -5.098   9.977
  185   HH11  ARG  22          1HH1      ARG  22  -1.420  -1.607  10.288
  186   HH12  ARG  22          2HH1      ARG  22  -1.557  -1.637  12.013
  187   HH21  ARG  22          1HH2      ARG  22  -1.623  -5.133  12.243
  188   HH22  ARG  22          2HH2      ARG  22  -1.635  -3.634  13.127
  189    H    ALA  23           H        ALA  23   2.238  -4.324   6.296
  190    HA   ALA  23           HA       ALA  23   2.671  -5.304   3.598
  191    HB1  ALA  23           1HB      ALA  23   4.346  -5.760   6.059
  192    HB2  ALA  23           2HB      ALA  23   4.504  -4.355   5.002
  193    HB3  ALA  23           3HB      ALA  23   4.839  -5.972   4.378
  194    H    ILE  24           H        ILE  24   2.380  -7.407   2.926
  195    HA   ILE  24           HA       ILE  24   2.208  -9.514   4.911
  196    HB   ILE  24           HB       ILE  24   0.015 -10.293   3.650
  197   HG12  ILE  24          2HG1      ILE  24  -0.339  -7.292   3.706
  198   HG13  ILE  24          1HG1      ILE  24   0.007  -8.205   2.238
  199   HG21  ILE  24          1HG2      ILE  24   0.088  -8.352   5.952
  200   HG22  ILE  24          2HG2      ILE  24   0.240 -10.107   6.043
  201   HG23  ILE  24          3HG2      ILE  24  -1.284  -9.379   5.533
  202   HD11  ILE  24          3HD1      ILE  24  -2.063  -9.470   2.554
  203   HD12  ILE  24          1HD1      ILE  24  -2.363  -7.737   2.431
  204   HD13  ILE  24          2HD1      ILE  24  -2.411  -8.531   4.006
  205    H    ARG  25           H        ARG  25   3.740 -10.785   4.060
  206    HA   ARG  25           HA       ARG  25   3.916 -11.334   1.244
  207    HB2  ARG  25           2HB      ARG  25   5.226 -12.688   3.619
  208    HB3  ARG  25           1HB      ARG  25   5.615 -13.027   1.943
  209    HG2  ARG  25           2HG      ARG  25   6.434 -10.788   1.629
  210    HG3  ARG  25           1HG      ARG  25   5.970 -10.364   3.279
  211    HD2  ARG  25           2HD      ARG  25   7.904 -12.564   2.592
  212    HD3  ARG  25           1HD      ARG  25   8.385 -10.918   2.965
  213    HE   ARG  25           HE       ARG  25   6.822 -12.501   4.897
  214   HH11  ARG  25          1HH1      ARG  25   9.709 -10.678   4.083
  215   HH12  ARG  25          2HH1      ARG  25  10.312 -10.667   5.707
  216   HH21  ARG  25          1HH2      ARG  25   7.600 -12.504   7.016
  217   HH22  ARG  25          2HH2      ARG  25   9.107 -11.717   7.393
  218    H    VAL  26           H        VAL  26   2.170 -12.356   0.420
  219    HA   VAL  26           HA       VAL  26   0.739 -14.332   1.932
  220    HB   VAL  26           HB       VAL  26  -0.536 -14.638  -0.263
  221   HG11  VAL  26          1HG1      VAL  26  -1.688 -12.410   0.035
  222   HG12  VAL  26          2HG1      VAL  26  -0.444 -12.021   1.221
  223   HG13  VAL  26          3HG1      VAL  26  -1.525 -13.387   1.494
  224   HG21  VAL  26          3HG2      VAL  26  -0.333 -12.892  -1.911
  225   HG22  VAL  26          1HG2      VAL  26   1.220 -13.704  -1.721
  226   HG23  VAL  26          2HG2      VAL  26   0.954 -12.124  -0.983
  227    H    TYR  27           H        TYR  27   1.705 -16.210   2.277
  228    HA   TYR  27           HA       TYR  27   3.358 -17.496   0.311
  229    HB2  TYR  27           2HB      TYR  27   2.367 -18.236   3.047
  230    HB3  TYR  27           1HB      TYR  27   3.071 -19.468   2.014
  231    HD1  TYR  27           2HD      TYR  27   3.782 -16.218   3.670
  232    HD2  TYR  27           1HD      TYR  27   5.400 -19.697   1.833
  233    HE1  TYR  27           2HE      TYR  27   6.024 -15.584   4.455
  234    HE2  TYR  27           1HE      TYR  27   7.645 -19.076   2.617
  235    HH   TYR  27           HH       TYR  27   8.877 -17.125   3.347
  236    H    MET  28           H        MET  28   2.877 -19.480  -0.750
  237    HA   MET  28           HA       MET  28   0.054 -19.728  -1.402
  238    HB2  MET  28           2HB      MET  28   2.358 -21.275  -2.579
  239    HB3  MET  28           1HB      MET  28   0.754 -21.096  -3.237
  240    HG2  MET  28           2HG      MET  28   2.808 -18.997  -2.971
  241    HG3  MET  28           1HG      MET  28   2.272 -19.756  -4.450
  242    HE1  MET  28           3HE      MET  28   0.914 -16.131  -4.879
  243    HE2  MET  28           1HE      MET  28   1.895 -17.420  -5.574
  244    HE3  MET  28           2HE      MET  28   2.432 -16.594  -4.111
  245    H    GLY  29           H        GLY  29   2.001 -20.990   0.904
  246    HA2  GLY  29           2HA      GLY  29   0.375 -22.721   2.097
  247    HA3  GLY  29           1HA      GLY  29   1.000 -23.716   0.789
  248    H    ASP  30           H        ASP  30   2.366 -25.101   1.715
  249    HA   ASP  30           HA       ASP  30   4.064 -24.305   3.920
  250    HB2  ASP  30           2HB      ASP  30   2.983 -26.564   3.775
  251    HB3  ASP  30           1HB      ASP  30   4.022 -26.922   2.399
  252    H    SER  31           H        SER  31   4.237 -24.396   0.527
  253    HA   SER  31           HA       SER  31   7.026 -24.838   0.227
  254    HB2  SER  31           2HB      SER  31   6.346 -23.547  -2.047
  255    HB3  SER  31           1HB      SER  31   6.022 -25.257  -1.772
  256    HG   SER  31           HG       SER  31   4.173 -24.028  -2.500
  257    H    ASP  32           H        ASP  32   8.485 -23.181  -0.759
  258    HA   ASP  32           HA       ASP  32   8.576 -20.874   0.954
  259    HB2  ASP  32           2HB      ASP  32  10.540 -22.320   0.110
  260    HB3  ASP  32           1HB      ASP  32  10.419 -21.378  -1.370
  261    H    VAL  33           H        VAL  33   6.931 -21.391  -1.865
  262    HA   VAL  33           HA       VAL  33   7.506 -18.897  -3.157
  263    HB   VAL  33           HB       VAL  33   6.847 -20.639  -4.613
  264   HG11  VAL  33          1HG1      VAL  33   5.647 -22.085  -3.117
  265   HG12  VAL  33          2HG1      VAL  33   4.624 -21.716  -4.504
  266   HG13  VAL  33          3HG1      VAL  33   4.345 -20.907  -2.962
  267   HG21  VAL  33          3HG2      VAL  33   6.075 -18.487  -5.317
  268   HG22  VAL  33          1HG2      VAL  33   4.623 -18.631  -4.325
  269   HG23  VAL  33          2HG2      VAL  33   4.844 -19.683  -5.724
  270    H    TYR  34           H        TYR  34   6.673 -17.033  -2.800
  271    HA   TYR  34           HA       TYR  34   4.013 -16.640  -1.771
  272    HB2  TYR  34           2HB      TYR  34   4.657 -15.406   0.225
  273    HB3  TYR  34           1HB      TYR  34   5.311 -17.037   0.310
  274    HD1  TYR  34           1HD      TYR  34   6.149 -13.478  -0.128
  275    HD2  TYR  34           2HD      TYR  34   7.680 -17.421   0.283
  276    HE1  TYR  34           1HE      TYR  34   8.389 -12.559   0.301
  277    HE2  TYR  34           2HE      TYR  34   9.918 -16.513   0.705
  278    HH   TYR  34           HH       TYR  34  11.200 -14.579   0.396
  279    H    THR  35           H        THR  35   3.323 -14.442  -1.938
  280    HA   THR  35           HA       THR  35   5.129 -12.792  -3.586
  281    HB   THR  35           HB       THR  35   2.471 -11.818  -3.770
  282    HG1  THR  35           1HG      THR  35   1.270 -13.565  -4.004
  283   HG21  THR  35          3HG2      THR  35   4.217 -13.315  -5.726
  284   HG22  THR  35          1HG2      THR  35   4.161 -11.568  -5.490
  285   HG23  THR  35          2HG2      THR  35   2.764 -12.413  -6.157
  286    H    VAL  36           H        VAL  36   5.706 -10.845  -2.825
  287    HA   VAL  36           HA       VAL  36   4.806 -10.077  -0.184
  288    HB   VAL  36           HB       VAL  36   6.652  -8.448  -1.908
  289   HG11  VAL  36          1HG1      VAL  36   7.548  -7.689   0.187
  290   HG12  VAL  36          2HG1      VAL  36   6.556  -8.845   1.076
  291   HG13  VAL  36          3HG1      VAL  36   5.794  -7.507   0.218
  292   HG21  VAL  36          3HG2      VAL  36   7.506 -10.724  -1.974
  293   HG22  VAL  36          1HG2      VAL  36   7.403 -10.831  -0.217
  294   HG23  VAL  36          2HG2      VAL  36   8.537  -9.709  -0.966
  295    H    HIS  37           H        HIS  37   2.745  -9.311  -0.266
  296    HA   HIS  37           HA       HIS  37   2.205  -7.084  -2.112
  297    HB2  HIS  37           2HB      HIS  37   0.281  -8.982  -0.753
  298    HB3  HIS  37           1HB      HIS  37  -0.213  -7.571  -1.673
  299    HD2  HIS  37           2HD      HIS  37  -0.881 -10.752  -2.499
  300    HE1  HIS  37           1HE      HIS  37   1.593  -9.745  -5.779
  301    HE2  HIS  37           2HE      HIS  37  -0.316 -11.213  -4.989
  302    H    HIS  38           H        HIS  38   0.342  -5.684  -1.146
  303    HA   HIS  38           HA       HIS  38   0.613  -5.163   1.697
  304    HB2  HIS  38           2HB      HIS  38   1.290  -3.057  -0.381
  305    HB3  HIS  38           1HB      HIS  38   1.136  -2.768   1.347
  306    HD2  HIS  38           2HD      HIS  38   3.768  -3.587  -1.201
  307    HE1  HIS  38           1HE      HIS  38   5.390  -4.598   2.566
  308    HE2  HIS  38           2HE      HIS  38   5.829  -4.531   0.077
  309    H    MET  39           H        MET  39  -1.091  -3.777   2.463
  310    HA   MET  39           HA       MET  39  -3.173  -3.044   0.548
  311    HB2  MET  39           2HB      MET  39  -3.597  -5.017   2.807
  312    HB3  MET  39           1HB      MET  39  -4.917  -4.159   2.028
  313    HG2  MET  39           2HG      MET  39  -3.851  -5.183  -0.148
  314    HG3  MET  39           1HG      MET  39  -3.193  -6.347   0.995
  315    HE1  MET  39           3HE      MET  39  -5.210  -6.899   3.135
  316    HE2  MET  39           1HE      MET  39  -4.586  -8.229   2.159
  317    HE3  MET  39           2HE      MET  39  -6.320  -8.082   2.443
  318    H    VAL  40           H        VAL  40  -4.438  -1.337   1.256
  319    HA   VAL  40           HA       VAL  40  -3.376   0.123   3.469
  320    HB   VAL  40           HB       VAL  40  -4.105   1.459   1.662
  321   HG11  VAL  40          1HG1      VAL  40  -5.622   0.151   0.475
  322   HG12  VAL  40          2HG1      VAL  40  -6.576   1.515   1.059
  323   HG13  VAL  40          3HG1      VAL  40  -6.682  -0.047   1.869
  324   HG21  VAL  40          3HG2      VAL  40  -5.484   3.041   2.740
  325   HG22  VAL  40          1HG2      VAL  40  -4.588   2.227   4.024
  326   HG23  VAL  40          2HG2      VAL  40  -6.272   1.802   3.717
  327    H    TRP  41           H        TRP  41  -3.683  -0.627   5.359
  328    HA   TRP  41           HA       TRP  41  -5.888  -2.178   6.227
  329    HB2  TRP  41           2HB      TRP  41  -3.431  -1.985   7.098
  330    HB3  TRP  41           1HB      TRP  41  -4.081  -0.699   8.094
  331    HD1  TRP  41           HD       TRP  41  -4.344  -1.630  10.427
  332    HE1  TRP  41           1HE      TRP  41  -5.354  -3.744  11.474
  333    HE3  TRP  41           3HE      TRP  41  -5.529  -4.146   6.139
  334    HZ2  TRP  41           2HZ      TRP  41  -6.519  -6.173  10.585
  335    HZ3  TRP  41           3HZ      TRP  41  -6.590  -6.353   6.323
  336    HH2  TRP  41           HH       TRP  41  -7.075  -7.345   8.500
  337    H    HIS  42           H        HIS  42  -4.996   1.167   6.527
  338    HA   HIS  42           HA       HIS  42  -7.711   1.895   7.220
  339    HB2  HIS  42           2HB      HIS  42  -6.209   1.244   9.306
  340    HB3  HIS  42           1HB      HIS  42  -5.641   2.887   9.114
  341    HD2  HIS  42           2HD      HIS  42  -7.547   4.888   9.613
  342    HE1  HIS  42           1HE      HIS  42 -10.266   2.222  11.456
  343    HE2  HIS  42           2HE      HIS  42  -9.560   4.644  11.231
  344    H    VAL  43           H        VAL  43  -8.149   3.719   6.206
  345    HA   VAL  43           HA       VAL  43  -5.943   5.609   5.783
  346    HB   VAL  43           HB       VAL  43  -6.431   4.669   3.638
  347   HG11  VAL  43          1HG1      VAL  43  -8.579   3.751   3.959
  348   HG12  VAL  43          2HG1      VAL  43  -8.676   4.903   2.629
  349   HG13  VAL  43          3HG1      VAL  43  -9.281   5.345   4.226
  350   HG21  VAL  43          3HG2      VAL  43  -5.980   7.059   3.683
  351   HG22  VAL  43          1HG2      VAL  43  -7.709   7.383   3.846
  352   HG23  VAL  43          2HG2      VAL  43  -7.094   6.635   2.374
  353    H    GLU  44           H        GLU  44  -6.204   7.497   6.569
  354    HA   GLU  44           HA       GLU  44  -8.361   8.189   8.228
  355    HB2  GLU  44           2HB      GLU  44  -5.862   9.449   7.260
  356    HB3  GLU  44           1HB      GLU  44  -7.091  10.515   7.906
  357    HG2  GLU  44           2HG      GLU  44  -7.091   9.257   9.998
  358    HG3  GLU  44           1HG      GLU  44  -5.862   8.177   9.340
  359    H    ASP  45           H        ASP  45 -10.320   8.639   7.471
  360    HA   ASP  45           HA       ASP  45 -10.707   9.943   4.927
  361    HB2  ASP  45           2HB      ASP  45 -13.131   9.723   5.472
  362    HB3  ASP  45           1HB      ASP  45 -12.265   8.195   5.534
  363    H    GLY  46           H        GLY  46  -9.217  11.590   6.378
  364    HA2  GLY  46           2HA      GLY  46 -11.110  13.722   7.121
  365    HA3  GLY  46           1HA      GLY  46  -9.698  13.385   8.105
  366    H    GLY  47           H        GLY  47  -9.107  13.020   4.740
  367    HA2  GLY  47           2HA      GLY  47  -8.804  15.495   3.719
  368    HA3  GLY  47           1HA      GLY  47  -7.467  15.410   4.845
  369    HA   PRO  48           HA       PRO  48  -4.744  13.494   2.003
  370    HB2  PRO  48           2HB      PRO  48  -4.574  11.090   3.745
  371    HB3  PRO  48           1HB      PRO  48  -3.284  12.105   3.092
  372    HG2  PRO  48           2HG      PRO  48  -3.944  12.362   5.609
  373    HG3  PRO  48           1HG      PRO  48  -3.748  13.833   4.631
  374    HD2  PRO  48           2HD      PRO  48  -6.283  12.407   5.396
  375    HD3  PRO  48           1HD      PRO  48  -5.890  14.135   5.507
  376    H    ALA  49           H        ALA  49  -4.435  10.408   2.217
  377    HA   ALA  49           HA       ALA  49  -5.162   9.656  -0.246
  378    HB1  ALA  49           1HB      ALA  49  -4.268   7.718   0.332
  379    HB2  ALA  49           2HB      ALA  49  -5.494   7.411   1.570
  380    HB3  ALA  49           3HB      ALA  49  -4.075   8.391   1.957
  381    H    SER  50           H        SER  50  -7.395   9.554   2.516
  382    HA   SER  50           HA       SER  50  -9.358   7.981   1.250
  383    HB2  SER  50           2HB      SER  50  -9.233   9.759   3.597
  384    HB3  SER  50           1HB      SER  50 -10.832   9.494   2.914
  385    HG   SER  50           HG       SER  50 -10.016   7.146   2.965
  386    H    GLU  51           H        GLU  51  -9.213  11.524   1.636
  387    HA   GLU  51           HA       GLU  51 -11.477  12.044   0.023
  388    HB2  GLU  51           2HB      GLU  51  -9.142  13.831   0.711
  389    HB3  GLU  51           1HB      GLU  51 -10.636  14.371  -0.042
  390    HG2  GLU  51           2HG      GLU  51 -10.715  12.931   2.571
  391    HG3  GLU  51           1HG      GLU  51 -10.313  14.647   2.506
  392    H    ALA  52           H        ALA  52  -8.132  11.502  -0.662
  393    HA   ALA  52           HA       ALA  52  -8.031  12.534  -3.277
  394    HB1  ALA  52           1HB      ALA  52  -6.427  10.140  -2.514
  395    HB2  ALA  52           2HB      ALA  52  -6.166  11.656  -1.651
  396    HB3  ALA  52           3HB      ALA  52  -5.943  11.586  -3.402
  397    H    GLY  53           H        GLY  53  -9.294   9.571  -1.955
  398    HA2  GLY  53           2HA      GLY  53 -11.088   8.663  -3.493
  399    HA3  GLY  53           1HA      GLY  53  -9.796   8.568  -4.674
  400    H    LEU  54           H        LEU  54  -8.273   7.866  -1.893
  401    HA   LEU  54           HA       LEU  54  -8.154   5.088  -2.513
  402    HB2  LEU  54           2HB      LEU  54  -6.381   6.673  -1.371
  403    HB3  LEU  54           1HB      LEU  54  -7.142   6.098   0.092
  404    HG   LEU  54           HG       LEU  54  -5.887   4.339  -2.017
  405   HD11  LEU  54          1HD1      LEU  54  -4.153   5.519  -0.888
  406   HD12  LEU  54          2HD1      LEU  54  -4.223   3.890  -0.212
  407   HD13  LEU  54          3HD1      LEU  54  -4.914   5.247   0.679
  408   HD21  LEU  54          3HD2      LEU  54  -6.784   3.579   0.734
  409   HD22  LEU  54          1HD2      LEU  54  -6.275   2.522  -0.583
  410   HD23  LEU  54          2HD2      LEU  54  -7.799   3.402  -0.694
  411    H    ARG  55           H        ARG  55  -9.648   3.717  -2.064
  412    HA   ARG  55           HA       ARG  55 -11.386   4.112   0.238
  413    HB2  ARG  55           2HB      ARG  55 -12.666   2.185  -0.714
  414    HB3  ARG  55           1HB      ARG  55 -12.563   3.577  -1.779
  415    HG2  ARG  55           2HG      ARG  55 -11.972   2.124  -3.355
  416    HG3  ARG  55           1HG      ARG  55 -10.404   2.068  -2.548
  417    HD2  ARG  55           2HD      ARG  55 -11.343  -0.174  -2.960
  418    HD3  ARG  55           1HD      ARG  55 -11.091   0.153  -1.248
  419    HE   ARG  55           HE       ARG  55 -13.631   0.817  -1.461
  420   HH11  ARG  55          1HH1      ARG  55 -12.002  -1.914  -2.930
  421   HH12  ARG  55          2HH1      ARG  55 -13.386  -2.954  -2.820
  422   HH21  ARG  55          1HH2      ARG  55 -15.457  -0.527  -1.355
  423   HH22  ARG  55          2HH2      ARG  55 -15.359  -2.160  -1.935
  424    H    GLN  56           H        GLN  56 -10.930   3.211   2.106
  425    HA   GLN  56           HA       GLN  56  -8.798   1.614   2.730
  426    HB2  GLN  56           2HB      GLN  56 -10.341   2.819   4.295
  427    HB3  GLN  56           1HB      GLN  56 -11.444   1.479   4.144
  428    HG2  GLN  56           2HG      GLN  56 -10.046   0.083   5.255
  429    HG3  GLN  56           1HG      GLN  56  -8.625   1.068   4.984
  430   HE21  GLN  56          1HE2      GLN  56  -9.952  -0.025   7.452
  431   HE22  GLN  56          2HE2      GLN  56 -10.130   1.353   8.483
  432    H    GLY  57           H        GLY  57  -8.350  -0.541   2.906
  433    HA2  GLY  57           2HA      GLY  57  -8.807  -2.846   2.891
  434    HA3  GLY  57           1HA      GLY  57 -10.427  -2.497   2.309
  435    H    ASP  58           H        ASP  58  -8.009  -0.848   0.602
  436    HA   ASP  58           HA       ASP  58  -8.389  -2.600  -1.710
  437    HB2  ASP  58           2HB      ASP  58  -8.489   0.086  -1.542
  438    HB3  ASP  58           1HB      ASP  58  -6.794  -0.127  -1.975
  439    H    LEU  59           H        LEU  59  -6.672  -3.327  -2.972
  440    HA   LEU  59           HA       LEU  59  -4.227  -3.820  -1.438
  441    HB2  LEU  59           2HB      LEU  59  -5.151  -5.864  -2.169
  442    HB3  LEU  59           1HB      LEU  59  -5.542  -5.221  -3.750
  443    HG   LEU  59           HG       LEU  59  -2.915  -5.016  -3.952
  444   HD11  LEU  59          1HD1      LEU  59  -2.368  -5.732  -1.716
  445   HD12  LEU  59          2HD1      LEU  59  -1.828  -6.961  -2.862
  446   HD13  LEU  59          3HD1      LEU  59  -3.300  -7.214  -1.923
  447   HD21  LEU  59          3HD2      LEU  59  -4.231  -6.293  -5.479
  448   HD22  LEU  59          1HD2      LEU  59  -4.521  -7.540  -4.267
  449   HD23  LEU  59          2HD2      LEU  59  -2.902  -7.311  -4.924
  450    H    ILE  60           H        ILE  60  -2.349  -2.948  -2.025
  451    HA   ILE  60           HA       ILE  60  -2.367  -1.075  -4.243
  452    HB   ILE  60           HB       ILE  60  -0.270  -1.618  -2.129
  453   HG12  ILE  60          2HG1      ILE  60  -0.922   0.812  -1.540
  454   HG13  ILE  60          1HG1      ILE  60  -2.356   0.523  -2.515
  455   HG21  ILE  60          1HG2      ILE  60   0.850   0.404  -2.979
  456   HG22  ILE  60          2HG2      ILE  60  -0.313   0.481  -4.305
  457   HG23  ILE  60          3HG2      ILE  60   0.801  -0.882  -4.183
  458   HD11  ILE  60          3HD1      ILE  60  -1.556  -1.094  -0.106
  459   HD12  ILE  60          1HD1      ILE  60  -3.048  -1.246  -1.034
  460   HD13  ILE  60          2HD1      ILE  60  -2.733   0.220  -0.104
  461    H    THR  61           H        THR  61  -1.595  -1.524  -6.167
  462    HA   THR  61           HA       THR  61  -0.047  -3.982  -6.527
  463    HB   THR  61           HB       THR  61  -0.699  -3.843  -8.875
  464    HG1  THR  61           1HG      THR  61  -0.861  -1.739  -9.406
  465   HG21  THR  61          3HG2      THR  61  -3.121  -3.255  -7.176
  466   HG22  THR  61          1HG2      THR  61  -2.277  -4.807  -7.164
  467   HG23  THR  61          2HG2      THR  61  -3.046  -4.233  -8.644
  468    H    HIS  62           H        HIS  62   0.006  -0.518  -7.144
  469    HA   HIS  62           HA       HIS  62   2.891  -0.642  -7.629
  470    HB2  HIS  62           2HB      HIS  62   0.981   0.879  -9.420
  471    HB3  HIS  62           1HB      HIS  62   2.727   0.855  -9.561
  472    HD2  HIS  62           2HD      HIS  62   3.792  -1.566 -10.597
  473    HE1  HIS  62           1HE      HIS  62   0.027  -2.905 -11.990
  474    HE2  HIS  62           2HE      HIS  62   2.509  -3.402 -11.914
  475    H    VAL  63           H        VAL  63   3.909   1.488  -7.472
  476    HA   VAL  63           HA       VAL  63   2.303   3.577  -6.246
  477    HB   VAL  63           HB       VAL  63   3.165   2.304  -4.350
  478   HG11  VAL  63          1HG1      VAL  63   5.533   2.148  -3.860
  479   HG12  VAL  63          2HG1      VAL  63   5.918   2.958  -5.379
  480   HG13  VAL  63          3HG1      VAL  63   5.167   1.362  -5.396
  481   HG21  VAL  63          3HG2      VAL  63   4.167   5.074  -4.854
  482   HG22  VAL  63          1HG2      VAL  63   4.558   4.253  -3.340
  483   HG23  VAL  63          2HG2      VAL  63   2.873   4.525  -3.788
  484    H    ASN  64           H        ASN  64   2.656   5.328  -7.390
  485    HA   ASN  64           HA       ASN  64   3.645   6.941  -8.651
  486    HB2  ASN  64           2HB      ASN  64   5.496   6.303  -6.575
  487    HB3  ASN  64           1HB      ASN  64   6.404   6.634  -8.045
  488   HD21  ASN  64          1HD2      ASN  64   7.236   8.536  -7.208
  489   HD22  ASN  64          2HD2      ASN  64   6.275   9.961  -7.011
  490    H    GLY  65           H        GLY  65   3.531   4.121  -9.631
  491    HA2  GLY  65           2HA      GLY  65   4.003   3.226 -11.725
  492    HA3  GLY  65           1HA      GLY  65   5.147   4.532 -11.988
  493    H    GLU  66           H        GLU  66   5.040   2.282  -9.309
  494    HA   GLU  66           HA       GLU  66   7.315   0.809 -10.251
  495    HB2  GLU  66           2HB      GLU  66   7.782   2.985  -8.781
  496    HB3  GLU  66           1HB      GLU  66   7.471   1.848  -7.482
  497    HG2  GLU  66           2HG      GLU  66   9.863   2.043  -8.010
  498    HG3  GLU  66           1HG      GLU  66   9.244   0.407  -8.228
  499    HA   PRO  67           HA       PRO  67   4.413  -2.233  -8.586
  500    HB2  PRO  67           2HB      PRO  67   6.489  -4.168  -8.786
  501    HB3  PRO  67           1HB      PRO  67   5.131  -3.930  -9.883
  502    HG2  PRO  67           2HG      PRO  67   7.926  -3.027 -10.128
  503    HG3  PRO  67           1HG      PRO  67   6.723  -3.335 -11.392
  504    HD2  PRO  67           2HD      PRO  67   7.481  -0.848 -10.671
  505    HD3  PRO  67           1HD      PRO  67   5.856  -1.193 -11.256
  506    H    VAL  68           H        VAL  68   4.061  -2.657  -6.609
  507    HA   VAL  68           HA       VAL  68   6.104  -2.236  -4.593
  508    HB   VAL  68           HB       VAL  68   4.312  -2.384  -2.943
  509   HG11  VAL  68          1HG1      VAL  68   4.683  -0.219  -3.902
  510   HG12  VAL  68          2HG1      VAL  68   2.950  -0.448  -3.679
  511   HG13  VAL  68          3HG1      VAL  68   3.663  -0.605  -5.286
  512   HG21  VAL  68          3HG2      VAL  68   2.954  -4.085  -3.993
  513   HG22  VAL  68          1HG2      VAL  68   2.522  -2.973  -5.291
  514   HG23  VAL  68          2HG2      VAL  68   1.978  -2.659  -3.640
  515    H    HIS  69           H        HIS  69   4.756  -4.602  -6.344
  516    HA   HIS  69           HA       HIS  69   4.568  -6.823  -4.737
  517    HB2  HIS  69           2HB      HIS  69   4.991  -6.212  -7.623
  518    HB3  HIS  69           1HB      HIS  69   5.126  -7.855  -7.079
  519    HD2  HIS  69           2HD      HIS  69   2.416  -5.543  -5.562
  520    HE1  HIS  69           1HE      HIS  69   0.533  -8.392  -8.065
  521    HE2  HIS  69           2HE      HIS  69   0.185  -6.698  -6.214
  522    H    GLY  70           H        GLY  70   6.272  -7.063  -3.310
  523    HA2  GLY  70           2HA      GLY  70   8.264  -8.540  -3.207
  524    HA3  GLY  70           1HA      GLY  70   8.903  -7.603  -4.551
  525    H    LEU  71           H        LEU  71   7.534  -5.233  -3.026
  526    HA   LEU  71           HA       LEU  71   9.962  -4.371  -1.754
  527    HB2  LEU  71           2HB      LEU  71   7.226  -3.097  -1.854
  528    HB3  LEU  71           1HB      LEU  71   8.659  -2.331  -1.203
  529    HG   LEU  71           HG       LEU  71   8.112  -3.042  -4.077
  530   HD11  LEU  71          1HD1      LEU  71   8.359  -0.650  -4.430
  531   HD12  LEU  71          2HD1      LEU  71   8.683  -0.414  -2.713
  532   HD13  LEU  71          3HD1      LEU  71   7.096  -0.972  -3.241
  533   HD21  LEU  71          3HD2      LEU  71  10.409  -3.597  -3.685
  534   HD22  LEU  71          1HD2      LEU  71  10.671  -2.093  -2.801
  535   HD23  LEU  71          2HD2      LEU  71  10.348  -2.053  -4.534
  536    H    VAL  72           H        VAL  72  10.362  -4.078   0.412
  537    HA   VAL  72           HA       VAL  72   8.841  -5.741   2.197
  538    HB   VAL  72           HB       VAL  72  11.453  -5.088   2.106
  539   HG11  VAL  72          1HG1      VAL  72  10.424  -3.395   4.375
  540   HG12  VAL  72          2HG1      VAL  72  11.007  -2.761   2.837
  541   HG13  VAL  72          3HG1      VAL  72  12.104  -3.641   3.900
  542   HG21  VAL  72          3HG2      VAL  72  10.357  -6.936   3.346
  543   HG22  VAL  72          1HG2      VAL  72  10.042  -5.813   4.667
  544   HG23  VAL  72          2HG2      VAL  72  11.700  -6.199   4.215
  545    H    HIS  73           H        HIS  73   8.323  -4.851   4.429
  546    HA   HIS  73           HA       HIS  73   6.132  -3.286   4.483
  547    HB2  HIS  73           2HB      HIS  73   7.386  -4.622   6.350
  548    HB3  HIS  73           1HB      HIS  73   8.091  -3.068   6.735
  549    HD1  HIS  73           1HD      HIS  73   5.391  -5.116   7.771
  550    HD2  HIS  73           2HD      HIS  73   5.840  -1.047   7.052
  551    HE1  HIS  73           1HE      HIS  73   3.543  -3.960   9.047
  552    H    THR  74           H        THR  74   9.430  -2.099   5.026
  553    HA   THR  74           HA       THR  74   8.473   0.619   5.273
  554    HB   THR  74           HB       THR  74  10.640   1.165   6.039
  555    HG1  THR  74           1HG      THR  74  12.284  -0.670   5.860
  556   HG21  THR  74          3HG2      THR  74   9.458  -0.103   7.683
  557   HG22  THR  74          1HG2      THR  74  11.120  -0.696   7.686
  558   HG23  THR  74          2HG2      THR  74   9.851  -1.627   6.881
  559    H    GLU  75           H        GLU  75   9.614  -1.355   2.719
  560    HA   GLU  75           HA       GLU  75  10.970   0.635   1.213
  561    HB2  GLU  75           2HB      GLU  75   9.923  -2.086   0.674
  562    HB3  GLU  75           1HB      GLU  75  10.245  -1.040  -0.697
  563    HG2  GLU  75           2HG      GLU  75  12.550  -0.706   0.172
  564    HG3  GLU  75           1HG      GLU  75  12.203  -1.919   1.401
  565    H    VAL  76           H        VAL  76   7.613  -0.538   1.216
  566    HA   VAL  76           HA       VAL  76   6.768   1.038  -0.974
  567    HB   VAL  76           HB       VAL  76   4.457   0.751  -0.010
  568   HG11  VAL  76          1HG1      VAL  76   5.429  -0.755  -1.651
  569   HG12  VAL  76          2HG1      VAL  76   4.372  -1.611  -0.530
  570   HG13  VAL  76          3HG1      VAL  76   6.122  -1.722  -0.350
  571   HG21  VAL  76          3HG2      VAL  76   6.018  -0.200   2.272
  572   HG22  VAL  76          1HG2      VAL  76   4.727  -1.299   1.781
  573   HG23  VAL  76          2HG2      VAL  76   4.344   0.376   2.206
  574    H    VAL  77           H        VAL  77   6.631   1.558   2.496
  575    HA   VAL  77           HA       VAL  77   5.491   4.059   2.604
  576    HB   VAL  77           HB       VAL  77   7.649   2.877   4.327
  577   HG11  VAL  77          1HG1      VAL  77   6.204   5.444   4.522
  578   HG12  VAL  77          2HG1      VAL  77   7.827   5.014   5.062
  579   HG13  VAL  77          3HG1      VAL  77   6.424   4.531   6.014
  580   HG21  VAL  77          3HG2      VAL  77   5.963   2.048   5.719
  581   HG22  VAL  77          1HG2      VAL  77   5.400   1.703   4.084
  582   HG23  VAL  77          2HG2      VAL  77   4.733   3.070   4.978
  583    H    GLU  78           H        GLU  78   8.922   3.217   2.323
  584    HA   GLU  78           HA       GLU  78   9.911   5.835   2.192
  585    HB2  GLU  78           2HB      GLU  78  10.966   3.183   1.328
  586    HB3  GLU  78           1HB      GLU  78  11.819   4.652   0.860
  587    HG2  GLU  78           2HG      GLU  78  11.526   5.199   3.420
  588    HG3  GLU  78           1HG      GLU  78  11.438   3.447   3.520
  589    H    LEU  79           H        LEU  79   8.952   3.597  -0.365
  590    HA   LEU  79           HA       LEU  79   9.628   5.084  -2.603
  591    HB2  LEU  79           2HB      LEU  79   8.121   2.787  -2.076
  592    HB3  LEU  79           1HB      LEU  79   7.014   3.852  -2.914
  593    HG   LEU  79           HG       LEU  79   8.019   2.441  -4.549
  594   HD11  LEU  79          1HD1      LEU  79   7.757   4.796  -5.189
  595   HD12  LEU  79          2HD1      LEU  79   9.099   4.016  -6.026
  596   HD13  LEU  79          3HD1      LEU  79   9.416   5.106  -4.678
  597   HD21  LEU  79          3HD2      LEU  79  10.425   2.235  -4.840
  598   HD22  LEU  79          1HD2      LEU  79   9.950   1.735  -3.216
  599   HD23  LEU  79          2HD2      LEU  79  10.699   3.310  -3.469
  600    H    ILE  80           H        ILE  80   6.813   5.323  -0.513
  601    HA   ILE  80           HA       ILE  80   5.458   7.291  -2.049
  602    HB   ILE  80           HB       ILE  80   5.151   6.197   0.731
  603   HG12  ILE  80          2HG1      ILE  80   3.035   6.240  -1.379
  604   HG13  ILE  80          1HG1      ILE  80   4.395   5.139  -1.582
  605   HG21  ILE  80          1HG2      ILE  80   3.822   8.575  -0.483
  606   HG22  ILE  80          2HG2      ILE  80   4.471   8.365   1.142
  607   HG23  ILE  80          3HG2      ILE  80   2.965   7.569   0.684
  608   HD11  ILE  80          3HD1      ILE  80   2.543   4.017  -0.533
  609   HD12  ILE  80          1HD1      ILE  80   2.494   5.233   0.740
  610   HD13  ILE  80          2HD1      ILE  80   3.884   4.158   0.604
  611    H    LEU  81           H        LEU  81   7.369   7.436   0.967
  612    HA   LEU  81           HA       LEU  81   7.232  10.205   1.366
  613    HB2  LEU  81           2HB      LEU  81   9.601   8.455   2.037
  614    HB3  LEU  81           1HB      LEU  81   9.147   9.964   2.806
  615    HG   LEU  81           HG       LEU  81   7.516   7.431   2.938
  616   HD11  LEU  81          1HD1      LEU  81   9.670   7.194   4.081
  617   HD12  LEU  81          2HD1      LEU  81   8.321   7.230   5.217
  618   HD13  LEU  81          3HD1      LEU  81   9.332   8.659   5.006
  619   HD21  LEU  81          3HD2      LEU  81   6.135   9.363   3.203
  620   HD22  LEU  81          1HD2      LEU  81   7.285  10.096   4.319
  621   HD23  LEU  81          2HD2      LEU  81   6.393   8.651   4.796
  622    H    LYS  82           H        LYS  82   9.352   8.251  -0.588
  623    HA   LYS  82           HA       LYS  82  11.300  10.095  -1.315
  624    HB2  LYS  82           2HB      LYS  82  11.168   7.586  -1.700
  625    HB3  LYS  82           1HB      LYS  82  10.234   8.009  -3.109
  626    HG2  LYS  82           2HG      LYS  82  12.215   9.500  -3.747
  627    HG3  LYS  82           1HG      LYS  82  13.108   8.546  -2.559
  628    HD2  LYS  82           2HD      LYS  82  11.535   7.335  -4.819
  629    HD3  LYS  82           1HD      LYS  82  13.252   7.734  -4.940
  630    HE2  LYS  82           2HE      LYS  82  13.458   6.312  -2.772
  631    HE3  LYS  82           1HE      LYS  82  11.894   5.660  -3.262
  632    HZ1  LYS  82           3HZ      LYS  82  14.370   5.636  -4.903
  633    HZ2  LYS  82           1HZ      LYS  82  12.873   5.002  -5.368
  634    HZ3  LYS  82           2HZ      LYS  82  13.720   4.310  -4.082
  635    H    SER  83           H        SER  83   8.190   9.372  -2.723
  636    HA   SER  83           HA       SER  83   8.337  10.802  -5.085
  637    HB2  SER  83           2HB      SER  83   6.498   9.283  -4.532
  638    HB3  SER  83           1HB      SER  83   5.932  10.401  -3.293
  639    HG   SER  83           HG       SER  83   4.983  11.535  -4.773
  640    H    GLY  84           H        GLY  84   7.632  11.985  -1.831
  641    HA2  GLY  84           2HA      GLY  84   8.530  14.322  -1.561
  642    HA3  GLY  84           1HA      GLY  84   7.549  14.709  -2.961
  643    H    ASN  85           H        ASN  85   5.934  15.957  -2.294
  644    HA   ASN  85           HA       ASN  85   4.719  15.452   0.309
  645    HB2  ASN  85           2HB      ASN  85   3.442  17.550  -0.171
  646    HB3  ASN  85           1HB      ASN  85   5.185  17.747  -0.090
  647   HD21  ASN  85          1HD2      ASN  85   5.047  19.664  -1.253
  648   HD22  ASN  85          2HD2      ASN  85   4.776  19.676  -2.960
  649    H    LYS  86           H        LYS  86   4.353  13.953  -2.363
  650    HA   LYS  86           HA       LYS  86   1.640  13.221  -1.883
  651    HB2  LYS  86           2HB      LYS  86   0.899  13.671  -4.171
  652    HB3  LYS  86           1HB      LYS  86   1.183  15.122  -3.265
  653    HG2  LYS  86           2HG      LYS  86   3.158  15.603  -4.467
  654    HG3  LYS  86           1HG      LYS  86   3.207  13.980  -5.159
  655    HD2  LYS  86           2HD      LYS  86   1.126  14.456  -6.381
  656    HD3  LYS  86           1HD      LYS  86   1.129  16.092  -5.718
  657    HE2  LYS  86           2HE      LYS  86   2.016  16.091  -7.972
  658    HE3  LYS  86           1HE      LYS  86   3.272  16.525  -6.816
  659    HZ1  LYS  86           3HZ      LYS  86   2.927  13.779  -7.878
  660    HZ2  LYS  86           1HZ      LYS  86   4.245  14.394  -7.013
  661    HZ3  LYS  86           2HZ      LYS  86   3.944  14.922  -8.591
  662    H    VAL  87           H        VAL  87   0.964  11.665  -3.752
  663    HA   VAL  87           HA       VAL  87   3.031  10.265  -5.129
  664    HB   VAL  87           HB       VAL  87   3.596   9.644  -2.794
  665   HG11  VAL  87          1HG1      VAL  87   0.984   8.146  -2.874
  666   HG12  VAL  87          2HG1      VAL  87   1.335   9.560  -1.880
  667   HG13  VAL  87          3HG1      VAL  87   2.197   8.050  -1.598
  668   HG21  VAL  87          3HG2      VAL  87   4.396   8.204  -4.486
  669   HG22  VAL  87          1HG2      VAL  87   2.804   7.477  -4.718
  670   HG23  VAL  87          2HG2      VAL  87   3.707   7.168  -3.235
  671    H    ALA  88           H        ALA  88   2.324   8.672  -6.471
  672    HA   ALA  88           HA       ALA  88  -0.569   8.450  -6.861
  673    HB1  ALA  88           1HB      ALA  88   0.735   9.031  -8.807
  674    HB2  ALA  88           2HB      ALA  88   0.036   7.425  -9.024
  675    HB3  ALA  88           3HB      ALA  88   1.740   7.598  -8.598
  676    H    ILE  89           H        ILE  89  -1.285   6.967  -5.366
  677    HA   ILE  89           HA       ILE  89   0.089   4.409  -5.156
  678    HB   ILE  89           HB       ILE  89  -0.627   5.350  -3.068
  679   HG12  ILE  89          2HG1      ILE  89  -2.583   3.128  -3.578
  680   HG13  ILE  89          1HG1      ILE  89  -0.846   2.838  -3.558
  681   HG21  ILE  89          1HG2      ILE  89  -2.443   6.754  -3.819
  682   HG22  ILE  89          2HG2      ILE  89  -2.990   5.697  -2.519
  683   HG23  ILE  89          3HG2      ILE  89  -3.422   5.334  -4.189
  684   HD11  ILE  89          3HD1      ILE  89  -2.220   4.210  -1.281
  685   HD12  ILE  89          1HD1      ILE  89  -0.672   3.367  -1.300
  686   HD13  ILE  89          2HD1      ILE  89  -2.174   2.450  -1.405
  687    H    SER  90           H        SER  90  -0.344   2.837  -6.577
  688    HA   SER  90           HA       SER  90  -2.858   2.868  -8.040
  689    HB2  SER  90           2HB      SER  90  -0.305   2.256  -8.764
  690    HB3  SER  90           1HB      SER  90  -0.965   0.649  -8.479
  691    HG   SER  90           HG       SER  90  -1.487   1.037 -10.538
  692    H    THR  91           H        THR  91  -4.560   1.981  -7.090
  693    HA   THR  91           HA       THR  91  -4.195  -0.464  -5.491
  694    HB   THR  91           HB       THR  91  -6.449   0.104  -4.542
  695    HG1  THR  91           1HG      THR  91  -7.517   1.761  -5.321
  696   HG21  THR  91          3HG2      THR  91  -4.387   2.291  -4.231
  697   HG22  THR  91          1HG2      THR  91  -4.327   0.727  -3.416
  698   HG23  THR  91          2HG2      THR  91  -5.642   1.850  -3.070
  699    H    THR  92           H        THR  92  -6.125  -2.006  -5.604
  700    HA   THR  92           HA       THR  92  -6.728  -2.317  -8.468
  701    HB   THR  92           HB       THR  92  -5.592  -4.234  -7.709
  702    HG1  THR  92           1HG      THR  92  -8.308  -5.033  -7.502
  703   HG21  THR  92          3HG2      THR  92  -6.281  -5.555  -5.762
  704   HG22  THR  92          1HG2      THR  92  -7.529  -4.364  -5.401
  705   HG23  THR  92          2HG2      THR  92  -5.827  -3.911  -5.306
  706    HA   PRO  93           HA       PRO  93 -10.926  -0.958  -7.351
  707    HB2  PRO  93           2HB      PRO  93 -11.267  -1.705 -10.207
  708    HB3  PRO  93           1HB      PRO  93 -11.806  -0.256  -9.351
  709    HG2  PRO  93           2HG      PRO  93  -9.690  -0.196 -10.986
  710    HG3  PRO  93           1HG      PRO  93  -9.718   0.746  -9.491
  711    HD2  PRO  93           2HD      PRO  93  -8.234  -1.721 -10.124
  712    HD3  PRO  93           1HD      PRO  93  -7.797  -0.397  -9.045
  713    H    LEU  94           H        LEU  94 -13.100  -1.937  -7.890
  714    HA   LEU  94           HA       LEU  94 -13.196  -4.593  -6.972
  715    HB2  LEU  94           2HB      LEU  94 -15.569  -3.676  -8.403
  716    HB3  LEU  94           1HB      LEU  94 -15.401  -4.188  -6.757
  717    HG   LEU  94           HG       LEU  94 -14.236  -1.791  -6.563
  718   HD11  LEU  94          1HD1      LEU  94 -14.480  -0.913  -8.639
  719   HD12  LEU  94          2HD1      LEU  94 -16.031  -0.419  -7.940
  720   HD13  LEU  94          3HD1      LEU  94 -15.935  -1.859  -8.958
  721   HD21  LEU  94          3HD2      LEU  94 -16.055  -2.628  -5.159
  722   HD22  LEU  94          1HD2      LEU  94 -17.203  -2.339  -6.467
  723   HD23  LEU  94          2HD2      LEU  94 -16.378  -0.983  -5.701
  724    H    GLU  95           H        GLU  95 -14.356  -6.352  -8.115
  725    HA   GLU  95           HA       GLU  95 -14.417  -6.390 -10.963
  726    HB2  GLU  95           2HB      GLU  95 -12.644  -7.878 -11.446
  727    HB3  GLU  95           1HB      GLU  95 -11.944  -6.625 -10.439
  728    HG2  GLU  95           2HG      GLU  95 -12.889  -9.232  -9.304
  729    HG3  GLU  95           1HG      GLU  95 -11.276  -9.040  -9.981
  730    H    ASN  96           H        ASN  96 -15.126  -8.496 -11.794
  731    HA   ASN  96           HA       ASN  96 -17.006  -9.672  -9.944
  732    HB2  ASN  96           2HB      ASN  96 -17.735 -11.016 -11.949
  733    HB3  ASN  96           1HB      ASN  96 -17.866  -9.271 -12.142
  734   HD21  ASN  96          1HD2      ASN  96 -16.575  -8.226 -13.605
  735   HD22  ASN  96          2HD2      ASN  96 -15.618  -9.062 -14.778
  736    H1   SER 101           1HT      SER 101  -0.413 -17.557   3.367
  737    H2   SER 101           2HT      SER 101  -1.353 -17.902   2.002
  738    H3   SER 101           3HT      SER 101  -2.067 -17.853   3.532
  739    HA   SER 101           HA       SER 101  -0.848 -15.556   2.131
  740    HB2  SER 101           2HB      SER 101  -3.767 -16.012   2.750
  741    HB3  SER 101           1HB      SER 101  -3.060 -14.801   1.678
  742    HG   SER 101           HG       SER 101  -3.988 -16.715   0.634
  743    H    TRP 102           H        TRP 102  -0.784 -13.642   3.282
  744    HA   TRP 102           HA       TRP 102  -0.787 -12.197   5.035
  745    HB2  TRP 102           2HB      TRP 102  -3.185 -12.931   5.277
  746    HB3  TRP 102           1HB      TRP 102  -2.641 -14.121   6.452
  747    HD1  TRP 102           HD       TRP 102  -1.763 -13.180   8.818
  748    HE1  TRP 102           1HE      TRP 102  -2.259 -10.983  10.057
  749    HE3  TRP 102           3HE      TRP 102  -3.676 -10.481   4.923
  750    HZ2  TRP 102           2HZ      TRP 102  -3.324  -8.438   9.456
  751    HZ3  TRP 102           3HZ      TRP 102  -4.415  -8.173   5.345
  752    HH2  TRP 102           HH       TRP 102  -4.243  -7.176   7.564
  753    H    GLU 103           H        GLU 103   1.108 -12.059   6.080
  754    HA   GLU 103           HA       GLU 103   1.770 -13.950   8.168
  755    HB2  GLU 103           2HB      GLU 103   2.613 -15.182   6.296
  756    HB3  GLU 103           1HB      GLU 103   3.378 -13.755   5.620
  757    HG2  GLU 103           2HG      GLU 103   4.242 -14.777   8.289
  758    HG3  GLU 103           1HG      GLU 103   4.800 -15.568   6.820
  759    H    SER 104           H        SER 104   3.015 -11.290   6.168
  760    HA   SER 104           HA       SER 104   4.885 -10.462   8.165
  761    HB2  SER 104           2HB      SER 104   4.146  -8.698   5.891
  762    HB3  SER 104           1HB      SER 104   5.736  -9.084   6.555
  763    HG   SER 104           HG       SER 104   5.267 -11.299   5.710
  764    H    HIS 105           H        HIS 105   1.906 -10.314   8.815
  765    HA   HIS 105           HA       HIS 105   1.261  -7.554   8.991
  766    HB2  HIS 105           2HB      HIS 105  -0.497  -8.262  10.571
  767    HB3  HIS 105           1HB      HIS 105  -0.493  -9.228   9.102
  768    HD2  HIS 105           2HD      HIS 105  -0.540  -9.704  12.837
  769    HE1  HIS 105           1HE      HIS 105   0.740 -13.371  11.161
  770    HE2  HIS 105           2HE      HIS 105  -0.287 -12.261  13.192
  771    H    LYS 106           H        LYS 106   3.144  -9.720  10.892
  772    HA   LYS 106           HA       LYS 106   3.572  -7.612  12.893
  773    HB2  LYS 106           2HB      LYS 106   4.729  -9.734  14.066
  774    HB3  LYS 106           1HB      LYS 106   3.039  -9.323  14.288
  775    HG2  LYS 106           2HG      LYS 106   3.179 -11.664  13.897
  776    HG3  LYS 106           1HG      LYS 106   2.477 -10.923  12.460
  777    HD2  LYS 106           2HD      LYS 106   4.068 -12.572  11.767
  778    HD3  LYS 106           1HD      LYS 106   4.733 -10.981  11.411
  779    HE2  LYS 106           2HE      LYS 106   6.070 -11.105  13.476
  780    HE3  LYS 106           1HE      LYS 106   5.430 -12.720  13.773
  781    HZ1  LYS 106           3HZ      LYS 106   7.667 -12.618  12.678
  782    HZ2  LYS 106           1HZ      LYS 106   6.900 -12.006  11.298
  783    HZ3  LYS 106           2HZ      LYS 106   6.512 -13.551  11.868
  784    H    SER 107           H        SER 107   4.967  -9.397  10.355
  785    HA   SER 107           HA       SER 107   7.705  -8.981  11.141
  786    HB2  SER 107           2HB      SER 107   6.816  -9.719   8.364
  787    HB3  SER 107           1HB      SER 107   8.283 -10.197   9.218
  788    HG   SER 107           HG       SER 107   6.505 -11.819   9.013
  789    H    GLY 108           H        GLY 108   7.897  -6.779  11.391
  790    HA2  GLY 108           2HA      GLY 108   8.986  -5.030   9.969
  791    HA3  GLY 108           1HA      GLY 108   7.567  -5.168   8.938
  792    H    GLY 109           H        GLY 109   6.165  -5.621  11.712
  793    HA2  GLY 109           2HA      GLY 109   5.422  -4.248  13.471
  794    HA3  GLY 109           1HA      GLY 109   6.183  -2.871  12.690
  795    H    GLU 110           H        GLU 110   4.493  -1.504  12.634
  796    HA   GLU 110           HA       GLU 110   2.287  -2.184  10.811
  797    HB2  GLU 110           2HB      GLU 110   1.905  -0.840  13.510
  798    HB3  GLU 110           1HB      GLU 110   0.651  -1.148  12.319
  799    HG2  GLU 110           2HG      GLU 110   0.891  -3.531  12.625
  800    HG3  GLU 110           1HG      GLU 110   2.224  -3.274  13.751
  801    H    THR 111           H        THR 111   4.463  -0.777  10.083
  802    HA   THR 111           HA       THR 111   4.378   2.002  10.540
  803    HB   THR 111           HB       THR 111   5.482   0.674   8.070
  804    HG1  THR 111           1HG      THR 111   6.656  -0.418   9.477
  805   HG21  THR 111          3HG2      THR 111   5.511   3.100   8.014
  806   HG22  THR 111          1HG2      THR 111   7.152   2.490   8.218
  807   HG23  THR 111          2HG2      THR 111   6.280   3.152   9.601
  808    H    ARG 112           H        ARG 112   3.326   3.630   9.546
  809    HA   ARG 112           HA       ARG 112   1.624   2.955   7.256
  810    HB2  ARG 112           2HB      ARG 112  -0.150   4.429   8.257
  811    HB3  ARG 112           1HB      ARG 112   0.125   2.913   9.107
  812    HG2  ARG 112           2HG      ARG 112   1.040   3.943  10.934
  813    HG3  ARG 112           1HG      ARG 112   1.583   5.345  10.010
  814    HD2  ARG 112           2HD      ARG 112  -1.297   4.704  10.633
  815    HD3  ARG 112           1HD      ARG 112  -0.300   5.841  11.540
  816    HE   ARG 112           HE       ARG 112  -0.230   6.546   8.818
  817   HH11  ARG 112          1HH1      ARG 112  -2.434   6.539  11.539
  818   HH12  ARG 112          2HH1      ARG 112  -3.369   7.874  10.943
  819   HH21  ARG 112          1HH2      ARG 112  -1.431   8.282   8.041
  820   HH22  ARG 112          2HH2      ARG 112  -2.811   8.876   8.945
  821    H    LEU 113           H        LEU 113   0.675   5.022   6.302
  822    HA   LEU 113           HA       LEU 113   2.870   6.942   5.991
  823    HB2  LEU 113           2HB      LEU 113   0.615   6.066   4.206
  824    HB3  LEU 113           1HB      LEU 113   1.467   7.562   3.909
  825    HG   LEU 113           HG       LEU 113   2.444   5.977   2.476
  826   HD11  LEU 113          1HD1      LEU 113   4.288   6.041   4.842
  827   HD12  LEU 113          2HD1      LEU 113   4.018   7.412   3.765
  828   HD13  LEU 113          3HD1      LEU 113   4.715   5.918   3.136
  829   HD21  LEU 113          3HD2      LEU 113   1.541   3.969   3.531
  830   HD22  LEU 113          1HD2      LEU 113   2.716   4.124   4.838
  831   HD23  LEU 113          2HD2      LEU 113   3.263   3.803   3.191
  Start of MODEL    2
    1    H1   GLY   1           1HT      GLY   1  -9.333 -12.247 -12.346
    2    H2   GLY   1           2HT      GLY   1  -9.091 -11.243 -13.687
    3    H3   GLY   1           3HT      GLY   1 -10.627 -11.366 -12.991
    4    HA2  GLY   1           1HA      GLY   1  -9.920 -10.275 -11.013
    5    HA3  GLY   1           2HA      GLY   1  -8.256 -10.295 -11.579
    6    H    GLY   2           H        GLY   2  -7.557  -8.437 -12.358
    7    HA2  GLY   2           2HA      GLY   2  -9.246  -6.854 -14.103
    8    HA3  GLY   2           1HA      GLY   2  -8.819  -6.089 -12.578
    9    H    SER   3           H        SER   3  -8.075  -4.919 -14.916
   10    HA   SER   3           HA       SER   3  -5.161  -5.234 -14.805
   11    HB2  SER   3           2HB      SER   3  -6.621  -4.701 -17.393
   12    HB3  SER   3           1HB      SER   3  -4.926  -5.134 -17.171
   13    HG   SER   3           HG       SER   3  -5.715  -7.057 -17.614
   14    H    MET   4           H        MET   4  -3.984  -3.327 -15.390
   15    HA   MET   4           HA       MET   4  -3.513  -1.121 -15.245
   16    HB2  MET   4           2HB      MET   4  -6.185  -1.001 -16.617
   17    HB3  MET   4           1HB      MET   4  -5.275   0.454 -16.244
   18    HG2  MET   4           2HG      MET   4  -3.402  -0.384 -17.575
   19    HG3  MET   4           1HG      MET   4  -4.336  -1.825 -17.967
   20    HE1  MET   4           3HE      MET   4  -5.701   1.877 -17.668
   21    HE2  MET   4           1HE      MET   4  -5.455   2.440 -19.320
   22    HE3  MET   4           2HE      MET   4  -4.067   2.050 -18.307
   23    H    ARG   5           H        ARG   5  -3.538  -1.303 -12.937
   24    HA   ARG   5           HA       ARG   5  -5.872  -0.616 -11.450
   25    HB2  ARG   5           2HB      ARG   5  -2.961  -0.785 -10.676
   26    HB3  ARG   5           1HB      ARG   5  -4.233  -0.373  -9.534
   27    HG2  ARG   5           2HG      ARG   5  -3.999  -2.630  -9.171
   28    HG3  ARG   5           1HG      ARG   5  -5.310  -2.601 -10.354
   29    HD2  ARG   5           2HD      ARG   5  -3.484  -2.829 -12.116
   30    HD3  ARG   5           1HD      ARG   5  -2.413  -3.258 -10.786
   31    HE   ARG   5           HE       ARG   5  -4.747  -4.848 -10.706
   32   HH11  ARG   5          1HH1      ARG   5  -1.829  -4.384 -12.579
   33   HH12  ARG   5          2HH1      ARG   5  -1.733  -6.042 -13.083
   34   HH21  ARG   5          1HH2      ARG   5  -4.631  -7.041 -11.375
   35   HH22  ARG   5          2HH2      ARG   5  -3.331  -7.547 -12.411
   36    HA   PRO   6           HA       PRO   6  -5.376   3.772 -12.055
   37    HB2  PRO   6           2HB      PRO   6  -7.553   4.247 -10.232
   38    HB3  PRO   6           1HB      PRO   6  -7.586   4.271 -11.996
   39    HG2  PRO   6           2HG      PRO   6  -8.878   2.381 -10.483
   40    HG3  PRO   6           1HG      PRO   6  -8.317   2.096 -12.133
   41    HD2  PRO   6           2HD      PRO   6  -7.021   1.395  -9.526
   42    HD3  PRO   6           1HD      PRO   6  -7.260   0.391 -10.968
   43    HA   PRO   7           HA       PRO   7  -3.071   4.623  -8.242
   44    HB2  PRO   7           2HB      PRO   7  -2.008   6.881  -9.731
   45    HB3  PRO   7           1HB      PRO   7  -1.158   5.516  -9.017
   46    HG2  PRO   7           2HG      PRO   7  -1.416   5.831 -11.683
   47    HG3  PRO   7           1HG      PRO   7  -1.355   4.234 -10.916
   48    HD2  PRO   7           2HD      PRO   7  -3.729   5.761 -11.931
   49    HD3  PRO   7           1HD      PRO   7  -3.377   4.022 -12.037
   50    H    ILE   8           H        ILE   8  -3.974   5.667  -6.657
   51    HA   ILE   8           HA       ILE   8  -5.608   8.014  -7.170
   52    HB   ILE   8           HB       ILE   8  -5.146   6.766  -4.482
   53   HG12  ILE   8          2HG1      ILE   8  -7.155   5.820  -6.523
   54   HG13  ILE   8          1HG1      ILE   8  -5.643   5.012  -6.193
   55   HG21  ILE   8          1HG2      ILE   8  -7.617   7.948  -5.702
   56   HG22  ILE   8          2HG2      ILE   8  -6.447   8.892  -4.779
   57   HG23  ILE   8          3HG2      ILE   8  -7.329   7.574  -4.007
   58   HD11  ILE   8          3HD1      ILE   8  -7.405   3.896  -5.036
   59   HD12  ILE   8          1HD1      ILE   8  -7.904   5.408  -4.279
   60   HD13  ILE   8          2HD1      ILE   8  -6.347   4.689  -3.869
   61    H    ILE   9           H        ILE   9  -4.556   9.873  -7.216
   62    HA   ILE   9           HA       ILE   9  -1.960  10.144  -6.041
   63    HB   ILE   9           HB       ILE   9  -3.485  12.484  -7.083
   64   HG12  ILE   9          2HG1      ILE   9  -3.903  10.677  -8.709
   65   HG13  ILE   9          1HG1      ILE   9  -2.863  11.930  -9.376
   66   HG21  ILE   9          1HG2      ILE   9  -1.304  12.928  -6.198
   67   HG22  ILE   9          2HG2      ILE   9  -1.207  13.053  -7.955
   68   HG23  ILE   9          3HG2      ILE   9  -0.601  11.612  -7.138
   69   HD11  ILE   9          3HD1      ILE   9  -2.073   9.758 -10.038
   70   HD12  ILE   9          1HD1      ILE   9  -1.997   9.233  -8.357
   71   HD13  ILE   9          2HD1      ILE   9  -0.910  10.495  -8.938
   72    H    ILE  10           H        ILE  10  -1.946  10.184  -3.861
   73    HA   ILE  10           HA       ILE  10  -3.828  11.762  -2.335
   74    HB   ILE  10           HB       ILE  10  -1.183  10.608  -1.378
   75   HG12  ILE  10          2HG1      ILE  10  -3.628   9.227  -0.576
   76   HG13  ILE  10          1HG1      ILE  10  -3.249   9.057  -2.270
   77   HG21  ILE  10          1HG2      ILE  10  -2.370  10.622   0.839
   78   HG22  ILE  10          2HG2      ILE  10  -3.627  11.595   0.077
   79   HG23  ILE  10          3HG2      ILE  10  -1.976  12.208   0.180
   80   HD11  ILE  10          3HD1      ILE  10  -1.060   8.203  -1.714
   81   HD12  ILE  10          1HD1      ILE  10  -2.320   7.260  -0.916
   82   HD13  ILE  10          2HD1      ILE  10  -1.399   8.455  -0.001
   83    H    HIS  11           H        HIS  11  -2.952  13.530  -0.884
   84    HA   HIS  11           HA       HIS  11  -0.587  14.863  -1.928
   85    HB2  HIS  11           2HB      HIS  11  -2.694  15.754  -3.093
   86    HB3  HIS  11           1HB      HIS  11  -3.179  16.380  -1.519
   87    HD2  HIS  11           2HD      HIS  11  -0.238  16.894  -4.084
   88    HE1  HIS  11           1HE      HIS  11  -0.682  20.355  -1.695
   89    HE2  HIS  11           2HE      HIS  11   0.694  19.244  -3.505
   90    H    ARG  12           H        ARG  12   0.629  15.111  -0.204
   91    HA   ARG  12           HA       ARG  12  -0.295  14.872   2.440
   92    HB2  ARG  12           2HB      ARG  12   2.030  14.439   1.562
   93    HB3  ARG  12           1HB      ARG  12   2.268  16.180   1.554
   94    HG2  ARG  12           2HG      ARG  12   1.971  16.281   3.932
   95    HG3  ARG  12           1HG      ARG  12   1.568  14.562   3.988
   96    HD2  ARG  12           2HD      ARG  12   3.770  13.981   3.224
   97    HD3  ARG  12           1HD      ARG  12   4.182  15.681   3.011
   98    HE   ARG  12           HE       ARG  12   3.485  14.637   5.676
   99   HH11  ARG  12          1HH1      ARG  12   5.831  16.114   3.526
  100   HH12  ARG  12          2HH1      ARG  12   6.912  16.547   4.809
  101   HH21  ARG  12          1HH2      ARG  12   4.911  15.195   7.352
  102   HH22  ARG  12          2HH2      ARG  12   6.393  16.020   6.988
  103    H    ALA  13           H        ALA  13  -1.520  16.253   3.465
  104    HA   ALA  13           HA       ALA  13  -1.601  19.050   2.758
  105    HB1  ALA  13           1HB      ALA  13  -3.405  19.137   4.462
  106    HB2  ALA  13           2HB      ALA  13  -3.113  17.431   4.801
  107    HB3  ALA  13           3HB      ALA  13  -3.678  17.929   3.206
  108    H    GLY  14           H        GLY  14   0.919  18.426   3.711
  109    HA2  GLY  14           2HA      GLY  14   2.460  19.442   5.102
  110    HA3  GLY  14           1HA      GLY  14   1.133  20.266   5.906
  111    H    LYS  15           H        LYS  15   0.436  17.036   5.844
  112    HA   LYS  15           HA       LYS  15   1.745  16.561   8.431
  113    HB2  LYS  15           2HB      LYS  15  -0.516  15.145   8.761
  114    HB3  LYS  15           1HB      LYS  15  -0.337  16.810   9.292
  115    HG2  LYS  15           2HG      LYS  15  -1.474  17.626   7.351
  116    HG3  LYS  15           1HG      LYS  15  -1.489  16.016   6.627
  117    HD2  LYS  15           2HD      LYS  15  -3.668  16.655   7.606
  118    HD3  LYS  15           1HD      LYS  15  -2.978  15.214   8.348
  119    HE2  LYS  15           2HE      LYS  15  -2.376  16.368  10.299
  120    HE3  LYS  15           1HE      LYS  15  -2.568  17.941   9.528
  121    HZ1  LYS  15           3HZ      LYS  15  -4.397  17.440  11.030
  122    HZ2  LYS  15           1HZ      LYS  15  -4.773  16.049  10.146
  123    HZ3  LYS  15           2HZ      LYS  15  -4.948  17.575   9.439
  124    H    LYS  16           H        LYS  16  -0.484  14.504   6.606
  125    HA   LYS  16           HA       LYS  16   1.624  12.805   5.641
  126    HB2  LYS  16           2HB      LYS  16   0.784  10.800   6.875
  127    HB3  LYS  16           1HB      LYS  16   1.565  11.993   7.898
  128    HG2  LYS  16           2HG      LYS  16  -0.639  12.829   8.587
  129    HG3  LYS  16           1HG      LYS  16  -1.401  11.597   7.582
  130    HD2  LYS  16           2HD      LYS  16  -0.406   9.841   8.912
  131    HD3  LYS  16           1HD      LYS  16   0.484  11.028   9.866
  132    HE2  LYS  16           2HE      LYS  16  -2.523  10.939   9.707
  133    HE3  LYS  16           1HE      LYS  16  -1.591  10.104  10.949
  134    HZ1  LYS  16           3HZ      LYS  16  -0.790  12.141  11.785
  135    HZ2  LYS  16           1HZ      LYS  16  -2.454  12.352  11.575
  136    HZ3  LYS  16           2HZ      LYS  16  -1.369  13.015  10.462
  137    H    TYR  17           H        TYR  17   0.458  10.614   4.898
  138    HA   TYR  17           HA       TYR  17  -1.680  11.478   3.117
  139    HB2  TYR  17           2HB      TYR  17  -0.281   8.801   3.116
  140    HB3  TYR  17           1HB      TYR  17  -1.176   9.551   1.792
  141    HD1  TYR  17           1HD      TYR  17   1.976   9.701   3.742
  142    HD2  TYR  17           2HD      TYR  17  -0.155  11.167   0.373
  143    HE1  TYR  17           1HE      TYR  17   4.034  10.748   2.905
  144    HE2  TYR  17           2HE      TYR  17   1.895  12.224  -0.476
  145    HH   TYR  17           HH       TYR  17   4.745  11.501   0.180
  146    H    GLY  18           H        GLY  18  -1.421  10.353   6.084
  147    HA2  GLY  18           2HA      GLY  18  -2.825   9.555   7.649
  148    HA3  GLY  18           1HA      GLY  18  -4.110   9.765   6.492
  149    H    PHE  19           H        PHE  19  -2.607   7.761   4.757
  150    HA   PHE  19           HA       PHE  19  -4.084   5.550   5.864
  151    HB2  PHE  19           2HB      PHE  19  -4.045   4.512   3.794
  152    HB3  PHE  19           1HB      PHE  19  -4.201   6.193   3.449
  153    HD1  PHE  19           2HD      PHE  19  -2.035   7.470   2.845
  154    HD2  PHE  19           1HD      PHE  19  -2.401   3.236   2.806
  155    HE1  PHE  19           2HE      PHE  19  -0.073   7.317   1.362
  156    HE2  PHE  19           1HE      PHE  19  -0.446   3.075   1.326
  157    HZ   PHE  19           HZ       PHE  19   0.720   5.116   0.602
  158    H    THR  20           H        THR  20  -3.462   3.666   6.379
  159    HA   THR  20           HA       THR  20  -0.696   3.420   7.292
  160    HB   THR  20           HB       THR  20  -3.110   1.676   7.873
  161    HG1  THR  20           1HG      THR  20  -3.107   3.917   8.668
  162   HG21  THR  20          3HG2      THR  20  -0.573   1.747   9.500
  163   HG22  THR  20          1HG2      THR  20  -0.774   0.626   8.152
  164   HG23  THR  20          2HG2      THR  20  -1.872   0.552   9.534
  165    H    LEU  21           H        LEU  21   0.755   2.394   5.960
  166    HA   LEU  21           HA       LEU  21  -0.225   0.500   3.988
  167    HB2  LEU  21           2HB      LEU  21   1.784   2.276   3.757
  168    HB3  LEU  21           1HB      LEU  21   2.704   0.922   4.348
  169    HG   LEU  21           HG       LEU  21   2.689  -0.075   2.360
  170   HD11  LEU  21          1HD1      LEU  21   0.721  -0.444   0.991
  171   HD12  LEU  21          2HD1      LEU  21  -0.207   0.672   1.990
  172   HD13  LEU  21          3HD1      LEU  21   0.383  -0.844   2.673
  173   HD21  LEU  21          3HD2      LEU  21   1.393   2.445   1.375
  174   HD22  LEU  21          1HD2      LEU  21   2.428   1.348   0.461
  175   HD23  LEU  21          2HD2      LEU  21   3.095   2.293   1.795
  176    H    ARG  22           H        ARG  22  -0.936  -1.162   5.356
  177    HA   ARG  22           HA       ARG  22   0.660  -2.384   7.350
  178    HB2  ARG  22           2HB      ARG  22  -1.946  -2.536   6.702
  179    HB3  ARG  22           1HB      ARG  22  -1.392  -3.999   5.917
  180    HG2  ARG  22           2HG      ARG  22  -2.139  -4.634   8.056
  181    HG3  ARG  22           1HG      ARG  22  -0.374  -4.668   8.113
  182    HD2  ARG  22           2HD      ARG  22  -0.251  -2.755   9.418
  183    HD3  ARG  22           1HD      ARG  22  -1.860  -2.205   8.945
  184    HE   ARG  22           HE       ARG  22  -2.488  -4.402  10.282
  185   HH11  ARG  22          1HH1      ARG  22  -0.063  -2.019  11.101
  186   HH12  ARG  22          2HH1      ARG  22  -0.348  -2.146  12.814
  187   HH21  ARG  22          1HH2      ARG  22  -2.830  -4.595  12.533
  188   HH22  ARG  22          2HH2      ARG  22  -1.916  -3.604  13.629
  189    H    ALA  23           H        ALA  23   2.099  -4.053   7.232
  190    HA   ALA  23           HA       ALA  23   2.938  -4.911   4.566
  191    HB1  ALA  23           1HB      ALA  23   4.177  -5.279   7.290
  192    HB2  ALA  23           2HB      ALA  23   4.714  -4.204   5.999
  193    HB3  ALA  23           3HB      ALA  23   4.847  -5.951   5.805
  194    H    ILE  24           H        ILE  24   2.597  -6.919   3.739
  195    HA   ILE  24           HA       ILE  24   1.695  -9.032   5.564
  196    HB   ILE  24           HB       ILE  24  -0.029  -9.740   3.959
  197   HG12  ILE  24          2HG1      ILE  24   0.239  -7.085   2.580
  198   HG13  ILE  24          1HG1      ILE  24   1.141  -8.493   2.020
  199   HG21  ILE  24          1HG2      ILE  24  -0.341  -6.917   4.955
  200   HG22  ILE  24          2HG2      ILE  24  -0.686  -8.397   5.853
  201   HG23  ILE  24          3HG2      ILE  24  -1.662  -7.969   4.446
  202   HD11  ILE  24          3HD1      ILE  24  -1.003  -8.076   0.826
  203   HD12  ILE  24          1HD1      ILE  24  -1.847  -8.437   2.331
  204   HD13  ILE  24          2HD1      ILE  24  -0.866  -9.677   1.552
  205    H    ARG  25           H        ARG  25   1.661 -11.189   4.444
  206    HA   ARG  25           HA       ARG  25   3.578 -11.403   2.247
  207    HB2  ARG  25           2HB      ARG  25   3.865 -12.640   4.971
  208    HB3  ARG  25           1HB      ARG  25   4.548 -13.427   3.556
  209    HG2  ARG  25           2HG      ARG  25   5.859 -11.397   3.089
  210    HG3  ARG  25           1HG      ARG  25   5.217 -10.670   4.564
  211    HD2  ARG  25           2HD      ARG  25   6.206 -12.458   5.888
  212    HD3  ARG  25           1HD      ARG  25   6.811 -13.225   4.422
  213    HE   ARG  25           HE       ARG  25   7.758 -10.561   4.612
  214   HH11  ARG  25          1HH1      ARG  25   8.208 -13.762   5.930
  215   HH12  ARG  25          2HH1      ARG  25   9.860 -13.493   6.381
  216   HH21  ARG  25          1HH2      ARG  25   9.940 -10.184   5.214
  217   HH22  ARG  25          2HH2      ARG  25  10.849 -11.445   5.981
  218    H    VAL  26           H        VAL  26   1.938 -12.046   0.899
  219    HA   VAL  26           HA       VAL  26   0.105 -14.146   1.630
  220    HB   VAL  26           HB       VAL  26  -0.458 -13.972  -0.898
  221   HG11  VAL  26          1HG1      VAL  26  -1.648 -11.729  -0.430
  222   HG12  VAL  26          2HG1      VAL  26  -0.949 -11.872   1.187
  223   HG13  VAL  26          3HG1      VAL  26  -2.042 -13.119   0.584
  224   HG21  VAL  26          3HG2      VAL  26   0.173 -11.926  -1.980
  225   HG22  VAL  26          1HG2      VAL  26   1.633 -12.782  -1.486
  226   HG23  VAL  26          2HG2      VAL  26   1.064 -11.395  -0.555
  227    H    TYR  27           H        TYR  27   0.452 -16.255   1.427
  228    HA   TYR  27           HA       TYR  27   2.844 -17.196   0.119
  229    HB2  TYR  27           2HB      TYR  27   0.656 -18.580   1.662
  230    HB3  TYR  27           1HB      TYR  27   1.967 -19.458   0.878
  231    HD1  TYR  27           2HD      TYR  27   1.096 -17.145   3.583
  232    HD2  TYR  27           1HD      TYR  27   4.217 -19.372   1.750
  233    HE1  TYR  27           2HE      TYR  27   2.516 -16.766   5.549
  234    HE2  TYR  27           1HE      TYR  27   5.649 -18.998   3.714
  235    HH   TYR  27           HH       TYR  27   5.786 -17.233   5.583
  236    H    MET  28           H        MET  28   2.935 -18.575  -1.650
  237    HA   MET  28           HA       MET  28   0.449 -18.722  -3.222
  238    HB2  MET  28           2HB      MET  28   3.219 -18.121  -4.242
  239    HB3  MET  28           1HB      MET  28   1.824 -18.393  -5.262
  240    HG2  MET  28           2HG      MET  28   0.776 -16.465  -4.236
  241    HG3  MET  28           1HG      MET  28   2.221 -16.178  -3.288
  242    HE1  MET  28           3HE      MET  28   0.522 -16.148  -6.732
  243    HE2  MET  28           1HE      MET  28   1.827 -17.267  -7.125
  244    HE3  MET  28           2HE      MET  28   1.801 -15.657  -7.842
  245    H    GLY  29           H        GLY  29   1.178 -20.775  -1.566
  246    HA2  GLY  29           2HA      GLY  29   0.910 -23.028  -2.954
  247    HA3  GLY  29           1HA      GLY  29   2.627 -22.727  -3.157
  248    H    ASP  30           H        ASP  30   2.691 -24.864  -2.117
  249    HA   ASP  30           HA       ASP  30   2.120 -24.988   0.721
  250    HB2  ASP  30           2HB      ASP  30   1.723 -26.982  -0.586
  251    HB3  ASP  30           1HB      ASP  30   3.370 -26.959  -1.202
  252    H    SER  31           H        SER  31   4.897 -24.627  -1.400
  253    HA   SER  31           HA       SER  31   6.880 -25.003   0.619
  254    HB2  SER  31           2HB      SER  31   7.277 -23.416  -1.913
  255    HB3  SER  31           1HB      SER  31   8.452 -24.401  -1.038
  256    HG   SER  31           HG       SER  31   6.585 -26.075  -1.628
  257    H    ASP  32           H        ASP  32   8.578 -23.004   0.721
  258    HA   ASP  32           HA       ASP  32   7.196 -20.991   2.234
  259    HB2  ASP  32           2HB      ASP  32   9.610 -22.068   2.532
  260    HB3  ASP  32           1HB      ASP  32  10.078 -20.685   1.550
  261    H    VAL  33           H        VAL  33   6.616 -21.072  -0.611
  262    HA   VAL  33           HA       VAL  33   7.845 -18.691  -1.700
  263    HB   VAL  33           HB       VAL  33   7.523 -20.341  -3.333
  264   HG11  VAL  33          1HG1      VAL  33   5.397 -21.427  -3.829
  265   HG12  VAL  33          2HG1      VAL  33   4.630 -20.535  -2.516
  266   HG13  VAL  33          3HG1      VAL  33   5.885 -21.721  -2.160
  267   HG21  VAL  33          3HG2      VAL  33   6.060 -19.285  -4.958
  268   HG22  VAL  33          1HG2      VAL  33   6.971 -18.073  -4.055
  269   HG23  VAL  33          2HG2      VAL  33   5.277 -18.366  -3.671
  270    H    TYR  34           H        TYR  34   7.114 -16.771  -1.355
  271    HA   TYR  34           HA       TYR  34   4.271 -16.254  -1.142
  272    HB2  TYR  34           2HB      TYR  34   4.522 -14.966   0.974
  273    HB3  TYR  34           1HB      TYR  34   4.803 -16.689   1.182
  274    HD1  TYR  34           1HD      TYR  34   6.374 -13.366   1.154
  275    HD2  TYR  34           2HD      TYR  34   6.983 -17.529   1.779
  276    HE1  TYR  34           1HE      TYR  34   8.542 -12.884   2.212
  277    HE2  TYR  34           2HE      TYR  34   9.148 -17.059   2.837
  278    HH   TYR  34           HH       TYR  34  10.848 -15.309   2.849
  279    H    THR  35           H        THR  35   3.709 -14.100  -1.529
  280    HA   THR  35           HA       THR  35   5.887 -12.524  -2.724
  281    HB   THR  35           HB       THR  35   3.462 -11.311  -3.385
  282    HG1  THR  35           1HG      THR  35   2.981 -13.839  -4.310
  283   HG21  THR  35          3HG2      THR  35   3.979 -12.042  -5.635
  284   HG22  THR  35          1HG2      THR  35   5.050 -13.297  -5.012
  285   HG23  THR  35          2HG2      THR  35   5.469 -11.597  -4.804
  286    H    VAL  36           H        VAL  36   6.489 -10.667  -1.785
  287    HA   VAL  36           HA       VAL  36   5.186  -9.876   0.663
  288    HB   VAL  36           HB       VAL  36   7.457  -8.422  -0.692
  289   HG11  VAL  36          1HG1      VAL  36   7.963  -7.659   1.564
  290   HG12  VAL  36          2HG1      VAL  36   6.610  -8.594   2.200
  291   HG13  VAL  36          3HG1      VAL  36   6.311  -7.231   1.123
  292   HG21  VAL  36          3HG2      VAL  36   8.043 -10.788  -0.425
  293   HG22  VAL  36          1HG2      VAL  36   7.630 -10.693   1.286
  294   HG23  VAL  36          2HG2      VAL  36   8.984  -9.758   0.653
  295    H    HIS  37           H        HIS  37   3.210  -9.041   0.178
  296    HA   HIS  37           HA       HIS  37   3.122  -6.692  -1.590
  297    HB2  HIS  37           2HB      HIS  37   0.899  -8.522  -0.652
  298    HB3  HIS  37           1HB      HIS  37   0.648  -7.066  -1.605
  299    HD2  HIS  37           2HD      HIS  37  -0.162 -10.055  -2.704
  300    HE1  HIS  37           1HE      HIS  37   3.079  -9.395  -5.338
  301    HE2  HIS  37           2HE      HIS  37   1.100 -10.884  -4.810
  302    H    HIS  38           H        HIS  38   0.960  -5.381  -0.729
  303    HA   HIS  38           HA       HIS  38   1.035  -5.038   2.151
  304    HB2  HIS  38           2HB      HIS  38   1.822  -2.793   0.269
  305    HB3  HIS  38           1HB      HIS  38   1.511  -2.602   1.988
  306    HD2  HIS  38           2HD      HIS  38   4.353  -3.301  -0.380
  307    HE1  HIS  38           1HE      HIS  38   5.684  -4.456   3.463
  308    HE2  HIS  38           2HE      HIS  38   6.307  -4.295   1.013
  309    H    MET  39           H        MET  39  -0.646  -3.457   2.844
  310    HA   MET  39           HA       MET  39  -2.709  -2.861   0.865
  311    HB2  MET  39           2HB      MET  39  -3.143  -4.739   3.192
  312    HB3  MET  39           1HB      MET  39  -4.459  -3.920   2.373
  313    HG2  MET  39           2HG      MET  39  -3.639  -5.010   0.251
  314    HG3  MET  39           1HG      MET  39  -2.608  -6.002   1.273
  315    HE1  MET  39           3HE      MET  39  -5.214  -7.970   3.419
  316    HE2  MET  39           1HE      MET  39  -4.541  -6.402   3.863
  317    HE3  MET  39           2HE      MET  39  -3.509  -7.629   3.130
  318    H    VAL  40           H        VAL  40  -4.086  -1.203   1.510
  319    HA   VAL  40           HA       VAL  40  -3.104   0.404   3.663
  320    HB   VAL  40           HB       VAL  40  -3.881   1.612   1.770
  321   HG11  VAL  40          1HG1      VAL  40  -6.523   0.217   2.134
  322   HG12  VAL  40          2HG1      VAL  40  -5.386  -0.006   0.803
  323   HG13  VAL  40          3HG1      VAL  40  -6.218   1.535   1.005
  324   HG21  VAL  40          3HG2      VAL  40  -4.391   2.486   4.090
  325   HG22  VAL  40          1HG2      VAL  40  -6.055   1.977   3.813
  326   HG23  VAL  40          2HG2      VAL  40  -5.321   3.193   2.765
  327    H    TRP  41           H        TRP  41  -3.428  -0.248   5.608
  328    HA   TRP  41           HA       TRP  41  -5.574  -1.882   6.489
  329    HB2  TRP  41           2HB      TRP  41  -3.154  -1.463   7.426
  330    HB3  TRP  41           1HB      TRP  41  -3.963  -0.230   8.371
  331    HD1  TRP  41           HD       TRP  41  -4.416  -1.110  10.688
  332    HE1  TRP  41           1HE      TRP  41  -5.222  -3.324  11.696
  333    HE3  TRP  41           3HE      TRP  41  -4.779  -3.864   6.397
  334    HZ2  TRP  41           2HZ      TRP  41  -5.951  -5.906  10.789
  335    HZ3  TRP  41           3HZ      TRP  41  -5.547  -6.196   6.552
  336    HH2  TRP  41           HH       TRP  41  -6.117  -7.194   8.703
  337    H    HIS  42           H        HIS  42  -4.838   1.522   6.751
  338    HA   HIS  42           HA       HIS  42  -7.610   2.154   7.270
  339    HB2  HIS  42           2HB      HIS  42  -6.184   1.584   9.463
  340    HB3  HIS  42           1HB      HIS  42  -5.750   3.272   9.290
  341    HD2  HIS  42           2HD      HIS  42  -7.952   5.080   9.447
  342    HE1  HIS  42           1HE      HIS  42 -10.426   2.252  11.382
  343    HE2  HIS  42           2HE      HIS  42 -10.226   4.658  10.614
  344    H    VAL  43           H        VAL  43  -8.047   3.996   6.290
  345    HA   VAL  43           HA       VAL  43  -5.832   5.865   5.835
  346    HB   VAL  43           HB       VAL  43  -6.273   4.922   3.721
  347   HG11  VAL  43          1HG1      VAL  43  -8.357   3.848   4.127
  348   HG12  VAL  43          2HG1      VAL  43  -8.532   4.907   2.727
  349   HG13  VAL  43          3HG1      VAL  43  -9.171   5.401   4.295
  350   HG21  VAL  43          3HG2      VAL  43  -5.984   7.282   3.556
  351   HG22  VAL  43          1HG2      VAL  43  -7.673   7.564   3.977
  352   HG23  VAL  43          2HG2      VAL  43  -7.268   6.811   2.436
  353    H    GLU  44           H        GLU  44  -6.104   7.845   6.478
  354    HA   GLU  44           HA       GLU  44  -8.252   8.574   8.118
  355    HB2  GLU  44           2HB      GLU  44  -5.981  10.116   6.896
  356    HB3  GLU  44           1HB      GLU  44  -7.153  10.847   7.961
  357    HG2  GLU  44           2HG      GLU  44  -6.550   8.955   9.590
  358    HG3  GLU  44           1HG      GLU  44  -5.118   8.764   8.581
  359    H    ASP  45           H        ASP  45 -10.204   9.036   7.502
  360    HA   ASP  45           HA       ASP  45 -10.796   9.991   4.840
  361    HB2  ASP  45           2HB      ASP  45 -13.138   9.682   5.488
  362    HB3  ASP  45           1HB      ASP  45 -12.191   8.245   5.863
  363    H    GLY  46           H        GLY  46  -9.325  11.801   6.518
  364    HA2  GLY  46           2HA      GLY  46 -11.349  13.932   6.784
  365    HA3  GLY  46           1HA      GLY  46 -10.027  13.749   7.921
  366    H    GLY  47           H        GLY  47  -9.201  13.176   4.602
  367    HA2  GLY  47           2HA      GLY  47  -8.857  15.630   3.527
  368    HA3  GLY  47           1HA      GLY  47  -7.557  15.552   4.695
  369    HA   PRO  48           HA       PRO  48  -4.829  13.466   1.974
  370    HB2  PRO  48           2HB      PRO  48  -4.761  11.037   3.673
  371    HB3  PRO  48           1HB      PRO  48  -3.448  12.072   3.122
  372    HG2  PRO  48           2HG      PRO  48  -4.237  12.233   5.616
  373    HG3  PRO  48           1HG      PRO  48  -3.933  13.728   4.698
  374    HD2  PRO  48           2HD      PRO  48  -6.552  12.378   5.281
  375    HD3  PRO  48           1HD      PRO  48  -6.087  14.077   5.472
  376    H    ALA  49           H        ALA  49  -4.587  10.417   2.122
  377    HA   ALA  49           HA       ALA  49  -5.363   9.720  -0.351
  378    HB1  ALA  49           1HB      ALA  49  -4.536   7.712   0.148
  379    HB2  ALA  49           2HB      ALA  49  -5.582   7.495   1.556
  380    HB3  ALA  49           3HB      ALA  49  -4.111   8.459   1.692
  381    H    SER  50           H        SER  50  -7.555   9.620   2.445
  382    HA   SER  50           HA       SER  50  -9.504   7.994   1.228
  383    HB2  SER  50           2HB      SER  50  -9.416   9.860   3.530
  384    HB3  SER  50           1HB      SER  50 -10.998   9.427   2.897
  385    HG   SER  50           HG       SER  50 -10.534   7.268   3.271
  386    H    GLU  51           H        GLU  51  -9.325  11.544   1.505
  387    HA   GLU  51           HA       GLU  51 -11.657  12.037  -0.010
  388    HB2  GLU  51           2HB      GLU  51  -9.267  13.814   0.494
  389    HB3  GLU  51           1HB      GLU  51 -10.794  14.348  -0.196
  390    HG2  GLU  51           2HG      GLU  51 -11.294  12.964   2.242
  391    HG3  GLU  51           1HG      GLU  51 -10.068  14.203   2.510
  392    H    ALA  52           H        ALA  52  -8.351  11.484  -0.785
  393    HA   ALA  52           HA       ALA  52  -8.365  12.347  -3.460
  394    HB1  ALA  52           1HB      ALA  52  -6.699  10.321  -1.990
  395    HB2  ALA  52           2HB      ALA  52  -6.271  11.976  -2.422
  396    HB3  ALA  52           3HB      ALA  52  -6.418  10.748  -3.680
  397    H    GLY  53           H        GLY  53  -9.453   9.409  -1.887
  398    HA2  GLY  53           2HA      GLY  53 -11.318   8.382  -3.259
  399    HA3  GLY  53           1HA      GLY  53 -10.117   8.289  -4.530
  400    H    LEU  54           H        LEU  54  -8.355   7.697  -1.867
  401    HA   LEU  54           HA       LEU  54  -8.143   4.928  -2.433
  402    HB2  LEU  54           2HB      LEU  54  -6.471   6.656  -1.306
  403    HB3  LEU  54           1HB      LEU  54  -7.141   5.974   0.155
  404    HG   LEU  54           HG       LEU  54  -5.735   4.460  -2.038
  405   HD11  LEU  54          1HD1      LEU  54  -4.147   5.684  -0.741
  406   HD12  LEU  54          2HD1      LEU  54  -4.087   3.999  -0.219
  407   HD13  LEU  54          3HD1      LEU  54  -4.925   5.198   0.765
  408   HD21  LEU  54          3HD2      LEU  54  -5.935   2.518  -0.638
  409   HD22  LEU  54          1HD2      LEU  54  -7.528   3.165  -1.032
  410   HD23  LEU  54          2HD2      LEU  54  -6.831   3.454   0.561
  411    H    ARG  55           H        ARG  55  -9.444   3.402  -1.875
  412    HA   ARG  55           HA       ARG  55 -11.244   3.773   0.383
  413    HB2  ARG  55           2HB      ARG  55 -12.350   1.699  -0.431
  414    HB3  ARG  55           1HB      ARG  55 -12.322   2.990  -1.618
  415    HG2  ARG  55           2HG      ARG  55 -11.681   1.344  -3.000
  416    HG3  ARG  55           1HG      ARG  55 -10.087   1.660  -2.318
  417    HD2  ARG  55           2HD      ARG  55 -10.480  -0.708  -2.282
  418    HD3  ARG  55           1HD      ARG  55 -10.514  -0.106  -0.627
  419    HE   ARG  55           HE       ARG  55 -13.126  -0.169  -1.732
  420   HH11  ARG  55          1HH1      ARG  55 -10.633  -2.251  -0.419
  421   HH12  ARG  55          2HH1      ARG  55 -11.746  -3.471   0.102
  422   HH21  ARG  55          1HH2      ARG  55 -14.590  -1.786  -1.052
  423   HH22  ARG  55          2HH2      ARG  55 -13.992  -3.217  -0.276
  424    H    GLN  56           H        GLN  56 -10.755   3.024   2.314
  425    HA   GLN  56           HA       GLN  56  -8.517   1.600   3.031
  426    HB2  GLN  56           2HB      GLN  56 -10.058   2.787   4.573
  427    HB3  GLN  56           1HB      GLN  56 -11.187   1.473   4.426
  428    HG2  GLN  56           2HG      GLN  56  -9.635   0.013   5.442
  429    HG3  GLN  56           1HG      GLN  56  -8.396   1.242   5.477
  430   HE21  GLN  56          1HE2      GLN  56  -9.663  -0.313   7.637
  431   HE22  GLN  56          2HE2      GLN  56 -10.270   0.866   8.748
  432    H    GLY  57           H        GLY  57  -7.965  -0.543   3.245
  433    HA2  GLY  57           2HA      GLY  57  -8.303  -2.863   3.273
  434    HA3  GLY  57           1HA      GLY  57  -9.966  -2.608   2.763
  435    H    ASP  58           H        ASP  58  -7.658  -0.892   0.959
  436    HA   ASP  58           HA       ASP  58  -8.074  -2.638  -1.350
  437    HB2  ASP  58           2HB      ASP  58  -8.197   0.043  -1.167
  438    HB3  ASP  58           1HB      ASP  58  -6.499  -0.141  -1.596
  439    H    LEU  59           H        LEU  59  -6.333  -3.295  -2.679
  440    HA   LEU  59           HA       LEU  59  -3.869  -3.748  -1.154
  441    HB2  LEU  59           2HB      LEU  59  -4.753  -5.821  -1.855
  442    HB3  LEU  59           1HB      LEU  59  -5.155  -5.211  -3.446
  443    HG   LEU  59           HG       LEU  59  -2.526  -4.927  -3.621
  444   HD11  LEU  59          1HD1      LEU  59  -2.073  -5.624  -1.332
  445   HD12  LEU  59          2HD1      LEU  59  -1.358  -6.747  -2.490
  446   HD13  LEU  59          3HD1      LEU  59  -2.843  -7.180  -1.643
  447   HD21  LEU  59          3HD2      LEU  59  -4.031  -7.516  -3.948
  448   HD22  LEU  59          1HD2      LEU  59  -2.440  -7.183  -4.630
  449   HD23  LEU  59          2HD2      LEU  59  -3.836  -6.239  -5.147
  450    H    ILE  60           H        ILE  60  -2.036  -2.802  -1.744
  451    HA   ILE  60           HA       ILE  60  -2.107  -0.991  -4.004
  452    HB   ILE  60           HB       ILE  60   0.052  -1.464  -1.935
  453   HG12  ILE  60          2HG1      ILE  60  -0.659   0.948  -1.327
  454   HG13  ILE  60          1HG1      ILE  60  -2.118   0.603  -2.245
  455   HG21  ILE  60          1HG2      ILE  60   1.037  -0.700  -4.014
  456   HG22  ILE  60          2HG2      ILE  60   1.078   0.593  -2.815
  457   HG23  ILE  60          3HG2      ILE  60  -0.124   0.628  -4.107
  458   HD11  ILE  60          3HD1      ILE  60  -1.169  -0.968   0.138
  459   HD12  ILE  60          1HD1      ILE  60  -2.681  -1.194  -0.742
  460   HD13  ILE  60          2HD1      ILE  60  -2.404   0.292   0.168
  461    H    THR  61           H        THR  61  -1.353  -1.474  -5.936
  462    HA   THR  61           HA       THR  61   0.290  -3.886  -6.240
  463    HB   THR  61           HB       THR  61  -0.389  -3.871  -8.584
  464    HG1  THR  61           1HG      THR  61  -0.661  -1.796  -9.195
  465   HG21  THR  61          3HG2      THR  61  -2.794  -3.361  -6.828
  466   HG22  THR  61          1HG2      THR  61  -1.903  -4.884  -6.889
  467   HG23  THR  61          2HG2      THR  61  -2.752  -4.301  -8.322
  468    H    HIS  62           H        HIS  62   0.137  -0.464  -7.050
  469    HA   HIS  62           HA       HIS  62   3.024  -0.473  -7.565
  470    HB2  HIS  62           2HB      HIS  62   0.980   0.881  -9.338
  471    HB3  HIS  62           1HB      HIS  62   2.720   0.983  -9.519
  472    HD2  HIS  62           2HD      HIS  62   3.947  -1.470 -10.374
  473    HE1  HIS  62           1HE      HIS  62   0.293  -3.023 -11.831
  474    HE2  HIS  62           2HE      HIS  62   2.815  -3.188 -11.954
  475    H    VAL  63           H        VAL  63   4.006   1.600  -7.333
  476    HA   VAL  63           HA       VAL  63   2.363   3.706  -6.170
  477    HB   VAL  63           HB       VAL  63   3.242   2.491  -4.250
  478   HG11  VAL  63          1HG1      VAL  63   5.217   1.495  -5.283
  479   HG12  VAL  63          2HG1      VAL  63   5.616   2.330  -3.781
  480   HG13  VAL  63          3HG1      VAL  63   5.986   3.082  -5.332
  481   HG21  VAL  63          3HG2      VAL  63   4.430   4.366  -3.141
  482   HG22  VAL  63          1HG2      VAL  63   2.968   4.863  -3.993
  483   HG23  VAL  63          2HG2      VAL  63   4.550   5.166  -4.709
  484    H    ASN  64           H        ASN  64   2.640   5.328  -7.525
  485    HA   ASN  64           HA       ASN  64   3.608   6.921  -8.842
  486    HB2  ASN  64           2HB      ASN  64   5.539   6.382  -6.758
  487    HB3  ASN  64           1HB      ASN  64   6.342   6.828  -8.259
  488   HD21  ASN  64          1HD2      ASN  64   7.036   8.782  -7.512
  489   HD22  ASN  64          2HD2      ASN  64   5.972  10.106  -7.184
  490    H    GLY  65           H        GLY  65   3.456   4.157  -9.734
  491    HA2  GLY  65           2HA      GLY  65   4.025   3.060 -11.689
  492    HA3  GLY  65           1HA      GLY  65   5.122   4.386 -12.052
  493    H    GLU  66           H        GLU  66   5.003   2.288  -9.256
  494    HA   GLU  66           HA       GLU  66   7.437   0.932  -9.993
  495    HB2  GLU  66           2HB      GLU  66   7.677   3.163  -8.600
  496    HB3  GLU  66           1HB      GLU  66   7.242   2.112  -7.267
  497    HG2  GLU  66           2HG      GLU  66   9.688   2.407  -7.580
  498    HG3  GLU  66           1HG      GLU  66   9.139   0.734  -7.607
  499    HA   PRO  67           HA       PRO  67   4.524  -2.180  -8.395
  500    HB2  PRO  67           2HB      PRO  67   6.550  -4.129  -8.659
  501    HB3  PRO  67           1HB      PRO  67   5.236  -3.808  -9.794
  502    HG2  PRO  67           2HG      PRO  67   8.064  -2.914  -9.867
  503    HG3  PRO  67           1HG      PRO  67   6.948  -3.242 -11.204
  504    HD2  PRO  67           2HD      PRO  67   7.597  -0.742 -10.477
  505    HD3  PRO  67           1HD      PRO  67   5.991  -1.134 -11.091
  506    H    VAL  68           H        VAL  68   4.235  -2.600  -6.401
  507    HA   VAL  68           HA       VAL  68   6.344  -2.180  -4.442
  508    HB   VAL  68           HB       VAL  68   4.584  -2.290  -2.749
  509   HG11  VAL  68          1HG1      VAL  68   3.928  -0.499  -5.084
  510   HG12  VAL  68          2HG1      VAL  68   4.989  -0.131  -3.723
  511   HG13  VAL  68          3HG1      VAL  68   3.255  -0.319  -3.463
  512   HG21  VAL  68          3HG2      VAL  68   3.161  -3.956  -3.796
  513   HG22  VAL  68          1HG2      VAL  68   2.717  -2.802  -5.054
  514   HG23  VAL  68          2HG2      VAL  68   2.237  -2.512  -3.380
  515    H    HIS  69           H        HIS  69   4.979  -4.549  -6.156
  516    HA   HIS  69           HA       HIS  69   4.694  -6.745  -4.553
  517    HB2  HIS  69           2HB      HIS  69   5.337  -6.205  -7.419
  518    HB3  HIS  69           1HB      HIS  69   5.296  -7.833  -6.824
  519    HD2  HIS  69           2HD      HIS  69   2.662  -5.359  -5.477
  520    HE1  HIS  69           1HE      HIS  69   0.770  -8.017  -8.175
  521    HE2  HIS  69           2HE      HIS  69   0.407  -6.335  -6.318
  522    H    GLY  70           H        GLY  70   6.330  -6.975  -3.015
  523    HA2  GLY  70           2HA      GLY  70   8.240  -8.480  -2.714
  524    HA3  GLY  70           1HA      GLY  70   8.959  -7.738  -4.135
  525    H    LEU  71           H        LEU  71   7.663  -5.161  -2.769
  526    HA   LEU  71           HA       LEU  71  10.159  -4.291  -1.639
  527    HB2  LEU  71           2HB      LEU  71   7.454  -2.951  -1.728
  528    HB3  LEU  71           1HB      LEU  71   8.906  -2.191  -1.119
  529    HG   LEU  71           HG       LEU  71   8.252  -2.929  -3.957
  530   HD11  LEU  71          1HD1      LEU  71   8.362  -0.637  -4.379
  531   HD12  LEU  71          2HD1      LEU  71   9.233  -0.308  -2.882
  532   HD13  LEU  71          3HD1      LEU  71   7.523  -0.737  -2.827
  533   HD21  LEU  71          3HD2      LEU  71  10.921  -2.126  -2.809
  534   HD22  LEU  71          1HD2      LEU  71  10.523  -2.112  -4.526
  535   HD23  LEU  71          2HD2      LEU  71  10.529  -3.634  -3.637
  536    H    VAL  72           H        VAL  72  10.611  -3.816   0.498
  537    HA   VAL  72           HA       VAL  72   9.119  -5.333   2.435
  538    HB   VAL  72           HB       VAL  72  11.714  -4.776   2.302
  539   HG11  VAL  72          1HG1      VAL  72  10.848  -2.701   4.291
  540   HG12  VAL  72          2HG1      VAL  72  11.233  -2.313   2.616
  541   HG13  VAL  72          3HG1      VAL  72  12.467  -3.015   3.661
  542   HG21  VAL  72          3HG2      VAL  72  11.960  -5.528   4.517
  543   HG22  VAL  72          1HG2      VAL  72  10.475  -6.263   3.914
  544   HG23  VAL  72          2HG2      VAL  72  10.396  -4.872   4.995
  545    H    HIS  73           H        HIS  73   8.458  -4.245   4.545
  546    HA   HIS  73           HA       HIS  73   6.369  -2.526   4.234
  547    HB2  HIS  73           2HB      HIS  73   6.880  -3.705   6.346
  548    HB3  HIS  73           1HB      HIS  73   8.215  -2.614   6.627
  549    HD1  HIS  73           1HD      HIS  73   4.418  -2.589   6.504
  550    HD2  HIS  73           2HD      HIS  73   7.604  -0.219   7.726
  551    HE1  HIS  73           1HE      HIS  73   3.415  -0.643   7.754
  552    H    THR  74           H        THR  74   9.618  -1.596   5.189
  553    HA   THR  74           HA       THR  74   9.007   1.166   5.298
  554    HB   THR  74           HB       THR  74  11.285   1.441   5.925
  555    HG1  THR  74           1HG      THR  74  12.755  -0.394   5.637
  556   HG21  THR  74          3HG2      THR  74  10.192   0.417   7.716
  557   HG22  THR  74          1HG2      THR  74  11.582  -0.638   7.469
  558   HG23  THR  74          2HG2      THR  74   9.990  -1.116   6.854
  559    H    GLU  75           H        GLU  75   9.911  -0.914   2.704
  560    HA   GLU  75           HA       GLU  75  11.202   1.052   1.106
  561    HB2  GLU  75           2HB      GLU  75  10.151  -1.689   0.651
  562    HB3  GLU  75           1HB      GLU  75  10.435  -0.663  -0.743
  563    HG2  GLU  75           2HG      GLU  75  12.761  -0.312   0.057
  564    HG3  GLU  75           1HG      GLU  75  12.449  -1.497   1.321
  565    H    VAL  76           H        VAL  76   7.851  -0.164   1.279
  566    HA   VAL  76           HA       VAL  76   6.930   1.396  -0.898
  567    HB   VAL  76           HB       VAL  76   4.649   1.140   0.077
  568   HG11  VAL  76          1HG1      VAL  76   6.256  -1.388  -0.166
  569   HG12  VAL  76          2HG1      VAL  76   5.567  -0.462  -1.499
  570   HG13  VAL  76          3HG1      VAL  76   4.505  -1.251  -0.334
  571   HG21  VAL  76          3HG2      VAL  76   6.153   0.250   2.404
  572   HG22  VAL  76          1HG2      VAL  76   4.858  -0.850   1.933
  573   HG23  VAL  76          2HG2      VAL  76   4.488   0.845   2.285
  574    H    VAL  77           H        VAL  77   6.869   1.932   2.591
  575    HA   VAL  77           HA       VAL  77   5.733   4.436   2.708
  576    HB   VAL  77           HB       VAL  77   8.001   3.434   4.402
  577   HG11  VAL  77          1HG1      VAL  77   7.481   5.018   5.993
  578   HG12  VAL  77          2HG1      VAL  77   5.847   5.246   5.370
  579   HG13  VAL  77          3HG1      VAL  77   7.222   5.910   4.490
  580   HG21  VAL  77          3HG2      VAL  77   6.353   1.760   4.513
  581   HG22  VAL  77          1HG2      VAL  77   5.042   2.938   4.564
  582   HG23  VAL  77          2HG2      VAL  77   6.110   2.744   5.955
  583    H    GLU  78           H        GLU  78   9.142   3.575   2.234
  584    HA   GLU  78           HA       GLU  78  10.132   6.198   2.087
  585    HB2  GLU  78           2HB      GLU  78  11.136   3.551   1.124
  586    HB3  GLU  78           1HB      GLU  78  11.965   5.029   0.648
  587    HG2  GLU  78           2HG      GLU  78  11.951   5.568   3.161
  588    HG3  GLU  78           1HG      GLU  78  11.626   3.849   3.358
  589    H    LEU  79           H        LEU  79   9.026   3.956  -0.415
  590    HA   LEU  79           HA       LEU  79   9.589   5.459  -2.681
  591    HB2  LEU  79           2HB      LEU  79   8.129   3.135  -2.078
  592    HB3  LEU  79           1HB      LEU  79   7.010   4.182  -2.924
  593    HG   LEU  79           HG       LEU  79   7.999   2.778  -4.559
  594   HD11  LEU  79          1HD1      LEU  79   9.518   5.372  -4.730
  595   HD12  LEU  79          2HD1      LEU  79   7.813   5.191  -5.143
  596   HD13  LEU  79          3HD1      LEU  79   9.040   4.316  -6.058
  597   HD21  LEU  79          3HD2      LEU  79   9.911   2.039  -3.203
  598   HD22  LEU  79          1HD2      LEU  79  10.701   3.588  -3.495
  599   HD23  LEU  79          2HD2      LEU  79  10.388   2.489  -4.840
  600    H    ILE  80           H        ILE  80   6.819   5.609  -0.512
  601    HA   ILE  80           HA       ILE  80   5.356   7.518  -1.994
  602    HB   ILE  80           HB       ILE  80   5.223   6.553   0.854
  603   HG12  ILE  80          2HG1      ILE  80   3.061   6.301  -1.188
  604   HG13  ILE  80          1HG1      ILE  80   4.493   5.293  -1.361
  605   HG21  ILE  80          1HG2      ILE  80   4.411   8.723   1.093
  606   HG22  ILE  80          2HG2      ILE  80   2.960   7.757   0.820
  607   HG23  ILE  80          3HG2      ILE  80   3.647   8.712  -0.494
  608   HD11  ILE  80          3HD1      ILE  80   2.738   4.123  -0.187
  609   HD12  ILE  80          1HD1      ILE  80   2.673   5.402   1.024
  610   HD13  ILE  80          2HD1      ILE  80   4.115   4.400   0.879
  611    H    LEU  81           H        LEU  81   7.366   7.822   0.945
  612    HA   LEU  81           HA       LEU  81   7.160  10.607   1.209
  613    HB2  LEU  81           2HB      LEU  81   9.538   8.910   1.973
  614    HB3  LEU  81           1HB      LEU  81   9.108  10.477   2.633
  615    HG   LEU  81           HG       LEU  81   7.506   7.946   2.976
  616   HD11  LEU  81          1HD1      LEU  81   9.610   7.877   4.192
  617   HD12  LEU  81          2HD1      LEU  81   8.248   8.056   5.300
  618   HD13  LEU  81          3HD1      LEU  81   9.257   9.448   4.910
  619   HD21  LEU  81          3HD2      LEU  81   7.117  10.766   3.927
  620   HD22  LEU  81          1HD2      LEU  81   6.370   9.388   4.739
  621   HD23  LEU  81          2HD2      LEU  81   5.985   9.735   3.054
  622    H    LYS  82           H        LYS  82   9.299   8.590  -0.665
  623    HA   LYS  82           HA       LYS  82  11.210  10.411  -1.513
  624    HB2  LYS  82           2HB      LYS  82  11.032   7.876  -1.792
  625    HB3  LYS  82           1HB      LYS  82  10.118   8.268  -3.221
  626    HG2  LYS  82           2HG      LYS  82  12.109   9.658  -3.948
  627    HG3  LYS  82           1HG      LYS  82  12.992   8.823  -2.667
  628    HD2  LYS  82           2HD      LYS  82  11.493   7.461  -4.897
  629    HD3  LYS  82           1HD      LYS  82  13.237   7.745  -4.885
  630    HE2  LYS  82           2HE      LYS  82  13.147   6.498  -2.600
  631    HE3  LYS  82           1HE      LYS  82  11.600   5.898  -3.193
  632    HZ1  LYS  82           3HZ      LYS  82  14.286   5.481  -4.361
  633    HZ2  LYS  82           1HZ      LYS  82  12.869   5.182  -5.236
  634    HZ3  LYS  82           2HZ      LYS  82  13.187   4.314  -3.822
  635    H    SER  83           H        SER  83   8.088   9.591  -2.892
  636    HA   SER  83           HA       SER  83   8.203  11.006  -5.257
  637    HB2  SER  83           2HB      SER  83   6.389   9.457  -4.687
  638    HB3  SER  83           1HB      SER  83   5.792  10.592  -3.479
  639    HG   SER  83           HG       SER  83   4.745  11.536  -5.011
  640    H    GLY  84           H        GLY  84   7.471  12.235  -2.013
  641    HA2  GLY  84           2HA      GLY  84   8.332  14.584  -1.785
  642    HA3  GLY  84           1HA      GLY  84   7.379  14.934  -3.208
  643    H    ASN  85           H        ASN  85   5.597  15.974  -2.791
  644    HA   ASN  85           HA       ASN  85   4.418  15.778  -0.116
  645    HB2  ASN  85           2HB      ASN  85   3.179  17.824  -0.748
  646    HB3  ASN  85           1HB      ASN  85   4.921  18.031  -0.824
  647   HD21  ASN  85          1HD2      ASN  85   5.908  18.324  -2.820
  648   HD22  ASN  85          2HD2      ASN  85   5.004  18.699  -4.246
  649    H    LYS  86           H        LYS  86   4.109  14.143  -2.775
  650    HA   LYS  86           HA       LYS  86   1.424  13.340  -2.223
  651    HB2  LYS  86           2HB      LYS  86   0.656  13.653  -4.531
  652    HB3  LYS  86           1HB      LYS  86   0.874  15.150  -3.681
  653    HG2  LYS  86           2HG      LYS  86   2.697  15.762  -4.969
  654    HG3  LYS  86           1HG      LYS  86   3.045  14.095  -5.435
  655    HD2  LYS  86           2HD      LYS  86   1.073  14.042  -6.846
  656    HD3  LYS  86           1HD      LYS  86   0.628  15.667  -6.325
  657    HE2  LYS  86           2HE      LYS  86   1.638  15.872  -8.463
  658    HE3  LYS  86           1HE      LYS  86   2.804  16.466  -7.284
  659    HZ1  LYS  86           3HZ      LYS  86   2.870  13.689  -8.309
  660    HZ2  LYS  86           1HZ      LYS  86   4.089  14.535  -7.495
  661    HZ3  LYS  86           2HZ      LYS  86   3.683  14.959  -9.079
  662    H    VAL  87           H        VAL  87   0.776  11.674  -3.962
  663    HA   VAL  87           HA       VAL  87   2.881  10.292  -5.302
  664    HB   VAL  87           HB       VAL  87   3.471   9.777  -2.945
  665   HG11  VAL  87          1HG1      VAL  87   1.266   9.675  -1.958
  666   HG12  VAL  87          2HG1      VAL  87   2.106   8.144  -1.709
  667   HG13  VAL  87          3HG1      VAL  87   0.861   8.274  -2.951
  668   HG21  VAL  87          3HG2      VAL  87   2.727   7.515  -4.774
  669   HG22  VAL  87          1HG2      VAL  87   3.630   7.283  -3.276
  670   HG23  VAL  87          2HG2      VAL  87   4.303   8.282  -4.562
  671    H    ALA  88           H        ALA  88   2.221   8.608  -6.563
  672    HA   ALA  88           HA       ALA  88  -0.671   8.358  -6.952
  673    HB1  ALA  88           1HB      ALA  88   0.685   8.876  -8.909
  674    HB2  ALA  88           2HB      ALA  88  -0.093   7.300  -9.082
  675    HB3  ALA  88           3HB      ALA  88   1.616   7.402  -8.660
  676    H    ILE  89           H        ILE  89  -1.337   6.944  -5.351
  677    HA   ILE  89           HA       ILE  89   0.051   4.405  -5.075
  678    HB   ILE  89           HB       ILE  89  -0.652   5.384  -3.011
  679   HG12  ILE  89          2HG1      ILE  89  -2.649   3.192  -3.460
  680   HG13  ILE  89          1HG1      ILE  89  -0.921   2.864  -3.459
  681   HG21  ILE  89          1HG2      ILE  89  -2.452   6.801  -3.762
  682   HG22  ILE  89          2HG2      ILE  89  -3.022   5.757  -2.460
  683   HG23  ILE  89          3HG2      ILE  89  -3.446   5.393  -4.132
  684   HD11  ILE  89          3HD1      ILE  89  -2.171   2.512  -1.287
  685   HD12  ILE  89          1HD1      ILE  89  -2.280   4.269  -1.191
  686   HD13  ILE  89          2HD1      ILE  89  -0.701   3.485  -1.210
  687    H    SER  90           H        SER  90  -0.357   2.840  -6.496
  688    HA   SER  90           HA       SER  90  -2.918   2.783  -7.876
  689    HB2  SER  90           2HB      SER  90  -0.406   2.355  -8.757
  690    HB3  SER  90           1HB      SER  90  -0.876   0.698  -8.386
  691    HG   SER  90           HG       SER  90  -2.833   2.025  -9.723
  692    H    THR  91           H        THR  91  -4.517   1.857  -6.764
  693    HA   THR  91           HA       THR  91  -3.940  -0.598  -5.266
  694    HB   THR  91           HB       THR  91  -6.079  -0.233  -4.127
  695    HG1  THR  91           1HG      THR  91  -7.468   1.193  -4.809
  696   HG21  THR  91          3HG2      THR  91  -4.299   2.203  -4.108
  697   HG22  THR  91          1HG2      THR  91  -4.053   0.728  -3.174
  698   HG23  THR  91          2HG2      THR  91  -5.450   1.753  -2.849
  699    H    THR  92           H        THR  92  -5.928  -2.171  -5.272
  700    HA   THR  92           HA       THR  92  -6.481  -2.589  -8.135
  701    HB   THR  92           HB       THR  92  -5.252  -4.410  -7.158
  702    HG1  THR  92           1HG      THR  92  -7.789  -5.575  -7.298
  703   HG21  THR  92          3HG2      THR  92  -7.534  -4.767  -5.219
  704   HG22  THR  92          1HG2      THR  92  -5.955  -4.093  -4.816
  705   HG23  THR  92          2HG2      THR  92  -6.091  -5.771  -5.343
  706    HA   PRO  93           HA       PRO  93 -10.749  -1.328  -7.218
  707    HB2  PRO  93           2HB      PRO  93 -10.933  -2.237 -10.051
  708    HB3  PRO  93           1HB      PRO  93 -11.592  -0.784  -9.290
  709    HG2  PRO  93           2HG      PRO  93  -9.416  -0.653 -10.816
  710    HG3  PRO  93           1HG      PRO  93  -9.551   0.317  -9.344
  711    HD2  PRO  93           2HD      PRO  93  -7.940  -2.106  -9.858
  712    HD3  PRO  93           1HD      PRO  93  -7.589  -0.728  -8.812
  713    H    LEU  94           H        LEU  94 -12.868  -2.417  -7.710
  714    HA   LEU  94           HA       LEU  94 -12.869  -5.046  -6.692
  715    HB2  LEU  94           2HB      LEU  94 -15.333  -4.537  -7.999
  716    HB3  LEU  94           1HB      LEU  94 -14.995  -4.521  -6.295
  717    HG   LEU  94           HG       LEU  94 -14.193  -2.094  -6.700
  718   HD11  LEU  94          1HD1      LEU  94 -14.160  -1.800  -8.968
  719   HD12  LEU  94          2HD1      LEU  94 -15.773  -1.186  -8.584
  720   HD13  LEU  94          3HD1      LEU  94 -15.576  -2.819  -9.219
  721   HD21  LEU  94          3HD2      LEU  94 -16.164  -2.750  -5.395
  722   HD22  LEU  94          1HD2      LEU  94 -17.113  -2.813  -6.878
  723   HD23  LEU  94          2HD2      LEU  94 -16.447  -1.278  -6.325
  724    H    GLU  95           H        GLU  95 -14.070  -6.862  -7.771
  725    HA   GLU  95           HA       GLU  95 -13.973  -6.987 -10.648
  726    HB2  GLU  95           2HB      GLU  95 -12.393  -8.782 -10.836
  727    HB3  GLU  95           1HB      GLU  95 -11.617  -7.483  -9.946
  728    HG2  GLU  95           2HG      GLU  95 -12.906  -9.834  -8.598
  729    HG3  GLU  95           1HG      GLU  95 -11.226  -9.835  -9.122
  730    H    ASN  96           H        ASN  96 -14.826  -9.080 -11.432
  731    HA   ASN  96           HA       ASN  96 -17.091  -9.849  -9.861
  732    HB2  ASN  96           2HB      ASN  96 -17.737 -11.211 -11.753
  733    HB3  ASN  96           1HB      ASN  96 -17.185  -9.648 -12.339
  734   HD21  ASN  96          1HD2      ASN  96 -15.203  -9.512 -13.427
  735   HD22  ASN  96          2HD2      ASN  96 -14.436 -10.912 -14.093
  736    H1   SER 101           1HT      SER 101  -4.467 -15.565   0.659
  737    H2   SER 101           2HT      SER 101  -4.581 -16.922  -0.341
  738    H3   SER 101           3HT      SER 101  -3.152 -16.027  -0.296
  739    HA   SER 101           HA       SER 101  -4.293 -17.528   1.975
  740    HB2  SER 101           2HB      SER 101  -1.826 -18.229   0.377
  741    HB3  SER 101           1HB      SER 101  -2.664 -19.220   1.573
  742    HG   SER 101           HG       SER 101  -3.811 -19.962  -0.014
  743    H    TRP 102           H        TRP 102  -3.957 -15.815   3.397
  744    HA   TRP 102           HA       TRP 102  -1.147 -15.403   4.094
  745    HB2  TRP 102           2HB      TRP 102  -1.604 -13.390   2.913
  746    HB3  TRP 102           1HB      TRP 102  -3.203 -13.241   3.628
  747    HD1  TRP 102           HD       TRP 102   0.408 -13.394   5.083
  748    HE1  TRP 102           1HE      TRP 102   0.595 -11.583   6.902
  749    HE3  TRP 102           3HE      TRP 102  -4.318 -11.458   4.792
  750    HZ2  TRP 102           2HZ      TRP 102  -1.039  -9.589   8.052
  751    HZ3  TRP 102           3HZ      TRP 102  -4.920  -9.595   6.283
  752    HH2  TRP 102           HH       TRP 102  -3.315  -8.682   7.877
  753    H    GLU 103           H        GLU 103  -0.800 -15.762   6.176
  754    HA   GLU 103           HA       GLU 103  -3.022 -16.302   7.920
  755    HB2  GLU 103           2HB      GLU 103  -0.033 -16.419   8.309
  756    HB3  GLU 103           1HB      GLU 103  -1.165 -16.717   9.620
  757    HG2  GLU 103           2HG      GLU 103  -0.670 -18.837   8.871
  758    HG3  GLU 103           1HG      GLU 103  -2.182 -18.475   8.044
  759    H    SER 104           H        SER 104  -0.153 -14.594   8.990
  760    HA   SER 104           HA       SER 104  -1.688 -12.184   9.528
  761    HB2  SER 104           2HB      SER 104  -0.129 -13.536  11.734
  762    HB3  SER 104           1HB      SER 104  -1.197 -12.139  11.865
  763    HG   SER 104           HG       SER 104  -2.184 -14.101  12.574
  764    H    HIS 105           H        HIS 105   0.184 -10.892  11.114
  765    HA   HIS 105           HA       HIS 105   1.997  -9.966   9.191
  766    HB2  HIS 105           2HB      HIS 105   1.554  -9.491  12.085
  767    HB3  HIS 105           1HB      HIS 105   3.123  -9.037  11.431
  768    HD2  HIS 105           2HD      HIS 105   3.116  -6.969   9.578
  769    HE1  HIS 105           1HE      HIS 105  -0.916  -5.902  10.278
  770    HE2  HIS 105           2HE      HIS 105   1.316  -5.117   9.350
  771    H    LYS 106           H        LYS 106   3.812 -10.783   8.483
  772    HA   LYS 106           HA       LYS 106   5.471 -12.385  10.307
  773    HB2  LYS 106           2HB      LYS 106   4.861 -13.017   7.410
  774    HB3  LYS 106           1HB      LYS 106   6.054 -13.858   8.389
  775    HG2  LYS 106           2HG      LYS 106   4.219 -14.520   9.937
  776    HG3  LYS 106           1HG      LYS 106   3.074 -13.817   8.793
  777    HD2  LYS 106           2HD      LYS 106   3.865 -15.351   7.059
  778    HD3  LYS 106           1HD      LYS 106   5.012 -16.052   8.202
  779    HE2  LYS 106           2HE      LYS 106   3.078 -16.658   9.654
  780    HE3  LYS 106           1HE      LYS 106   2.007 -16.116   8.364
  781    HZ1  LYS 106           3HZ      LYS 106   3.278 -18.602   8.649
  782    HZ2  LYS 106           1HZ      LYS 106   3.865 -17.865   7.241
  783    HZ3  LYS 106           2HZ      LYS 106   2.194 -18.103   7.443
  784    H    SER 107           H        SER 107   5.251  -9.620   8.889
  785    HA   SER 107           HA       SER 107   8.009  -9.519   7.885
  786    HB2  SER 107           2HB      SER 107   6.121  -7.311   7.272
  787    HB3  SER 107           1HB      SER 107   7.357  -8.047   6.255
  788    HG   SER 107           HG       SER 107   5.127  -8.479   5.630
  789    H    GLY 108           H        GLY 108   9.291  -7.708   8.525
  790    HA2  GLY 108           2HA      GLY 108   8.623  -6.777  11.198
  791    HA3  GLY 108           1HA      GLY 108  10.165  -6.584  10.382
  792    H    GLY 109           H        GLY 109   8.105  -4.769  11.796
  793    HA2  GLY 109           2HA      GLY 109   8.153  -2.400  11.583
  794    HA3  GLY 109           1HA      GLY 109   8.392  -2.590   9.853
  795    H    GLU 110           H        GLU 110   6.340  -1.232  11.730
  796    HA   GLU 110           HA       GLU 110   4.101  -1.666   9.961
  797    HB2  GLU 110           2HB      GLU 110   4.130  -2.795  12.649
  798    HB3  GLU 110           1HB      GLU 110   2.775  -1.716  12.380
  799    HG2  GLU 110           2HG      GLU 110   3.503  -4.150  10.776
  800    HG3  GLU 110           1HG      GLU 110   2.106  -3.945  11.833
  801    H    THR 111           H        THR 111   4.892   0.505   9.536
  802    HA   THR 111           HA       THR 111   3.939   2.458  11.513
  803    HB   THR 111           HB       THR 111   6.375   2.586  10.720
  804    HG1  THR 111           1HG      THR 111   5.816   4.437  11.639
  805   HG21  THR 111          3HG2      THR 111   6.755   3.759   8.586
  806   HG22  THR 111          1HG2      THR 111   5.035   3.619   8.217
  807   HG23  THR 111          2HG2      THR 111   6.031   2.169   8.344
  808    H    ARG 112           H        ARG 112   3.247   4.565  10.181
  809    HA   ARG 112           HA       ARG 112   1.569   3.706   7.943
  810    HB2  ARG 112           2HB      ARG 112  -0.050   3.687   9.570
  811    HB3  ARG 112           1HB      ARG 112   0.725   4.946  10.520
  812    HG2  ARG 112           2HG      ARG 112  -0.107   6.076   8.040
  813    HG3  ARG 112           1HG      ARG 112  -1.455   5.179   8.738
  814    HD2  ARG 112           2HD      ARG 112  -1.591   7.396   9.571
  815    HD3  ARG 112           1HD      ARG 112  -1.015   6.380  10.892
  816    HE   ARG 112           HE       ARG 112   0.795   8.046   9.245
  817   HH11  ARG 112          1HH1      ARG 112  -0.317   6.874  12.375
  818   HH12  ARG 112          2HH1      ARG 112   0.938   7.682  13.255
  819   HH21  ARG 112          1HH2      ARG 112   2.426   9.117  10.426
  820   HH22  ARG 112          2HH2      ARG 112   2.500   8.950  12.151
  821    H    LEU 113           H        LEU 113   1.012   5.368   6.468
  822    HA   LEU 113           HA       LEU 113   3.098   7.332   6.184
  823    HB2  LEU 113           2HB      LEU 113   0.781   6.416   4.519
  824    HB3  LEU 113           1HB      LEU 113   1.583   7.916   4.124
  825    HG   LEU 113           HG       LEU 113   2.499   6.236   2.722
  826   HD11  LEU 113          1HD1      LEU 113   4.835   6.274   3.288
  827   HD12  LEU 113          2HD1      LEU 113   4.454   6.705   4.954
  828   HD13  LEU 113          3HD1      LEU 113   4.101   7.835   3.649
  829   HD21  LEU 113          3HD2      LEU 113   3.476   4.179   3.538
  830   HD22  LEU 113          1HD2      LEU 113   1.790   4.296   4.038
  831   HD23  LEU 113          2HD2      LEU 113   3.077   4.623   5.199
  Start of MODEL    3
    1    H1   GLY   1           1HT      GLY   1  -9.810 -12.261 -13.048
    2    H2   GLY   1           2HT      GLY   1  -8.980 -11.219 -14.084
    3    H3   GLY   1           3HT      GLY   1 -10.669 -11.175 -14.015
    4    HA2  GLY   1           1HA      GLY   1 -10.546 -10.454 -11.690
    5    HA3  GLY   1           2HA      GLY   1  -8.798 -10.399 -11.855
    6    H    GLY   2           H        GLY   2  -7.855  -8.821 -13.229
    7    HA2  GLY   2           2HA      GLY   2  -9.375  -6.911 -14.662
    8    HA3  GLY   2           1HA      GLY   2  -8.979  -6.289 -13.065
    9    H    SER   3           H        SER   3  -7.952  -4.766 -14.833
   10    HA   SER   3           HA       SER   3  -5.111  -5.260 -14.691
   11    HB2  SER   3           2HB      SER   3  -6.503  -5.017 -17.370
   12    HB3  SER   3           1HB      SER   3  -4.761  -4.876 -17.140
   13    HG   SER   3           HG       SER   3  -5.764  -7.125 -15.975
   14    H    MET   4           H        MET   4  -3.862  -3.387 -15.173
   15    HA   MET   4           HA       MET   4  -3.367  -1.190 -15.047
   16    HB2  MET   4           2HB      MET   4  -5.941  -0.979 -16.595
   17    HB3  MET   4           1HB      MET   4  -4.907   0.403 -16.255
   18    HG2  MET   4           2HG      MET   4  -3.071  -0.666 -17.446
   19    HG3  MET   4           1HG      MET   4  -4.097  -2.060 -17.774
   20    HE1  MET   4           3HE      MET   4  -5.211   1.769 -17.878
   21    HE2  MET   4           1HE      MET   4  -4.757   2.150 -19.538
   22    HE3  MET   4           2HE      MET   4  -3.515   1.732 -18.359
   23    H    ARG   5           H        ARG   5  -3.592  -1.369 -12.754
   24    HA   ARG   5           HA       ARG   5  -6.002  -0.588 -11.453
   25    HB2  ARG   5           2HB      ARG   5  -3.156  -0.779 -10.455
   26    HB3  ARG   5           1HB      ARG   5  -4.520  -0.378  -9.424
   27    HG2  ARG   5           2HG      ARG   5  -4.298  -2.625  -9.036
   28    HG3  ARG   5           1HG      ARG   5  -5.503  -2.623 -10.328
   29    HD2  ARG   5           2HD      ARG   5  -3.601  -2.909 -11.942
   30    HD3  ARG   5           1HD      ARG   5  -2.546  -3.160 -10.553
   31    HE   ARG   5           HE       ARG   5  -4.435  -4.992 -10.117
   32   HH11  ARG   5          1HH1      ARG   5  -2.660  -4.169 -13.018
   33   HH12  ARG   5          2HH1      ARG   5  -2.736  -5.774 -13.670
   34   HH21  ARG   5          1HH2      ARG   5  -4.519  -7.110 -10.968
   35   HH22  ARG   5          2HH2      ARG   5  -3.786  -7.447 -12.506
   36    HA   PRO   6           HA       PRO   6  -5.333   3.773 -12.022
   37    HB2  PRO   6           2HB      PRO   6  -7.508   4.358 -10.238
   38    HB3  PRO   6           1HB      PRO   6  -7.528   4.341 -12.001
   39    HG2  PRO   6           2HG      PRO   6  -8.897   2.535 -10.453
   40    HG3  PRO   6           1HG      PRO   6  -8.336   2.193 -12.095
   41    HD2  PRO   6           2HD      PRO   6  -7.075   1.507  -9.463
   42    HD3  PRO   6           1HD      PRO   6  -7.348   0.482 -10.886
   43    HA   PRO   7           HA       PRO   7  -2.999   4.557  -8.198
   44    HB2  PRO   7           2HB      PRO   7  -1.891   6.770  -9.742
   45    HB3  PRO   7           1HB      PRO   7  -1.062   5.430  -8.956
   46    HG2  PRO   7           2HG      PRO   7  -1.258   5.611 -11.627
   47    HG3  PRO   7           1HG      PRO   7  -1.288   4.049 -10.788
   48    HD2  PRO   7           2HD      PRO   7  -3.570   5.634 -11.922
   49    HD3  PRO   7           1HD      PRO   7  -3.288   3.878 -11.958
   50    H    ILE   8           H        ILE   8  -3.849   5.661  -6.605
   51    HA   ILE   8           HA       ILE   8  -5.412   8.053  -7.143
   52    HB   ILE   8           HB       ILE   8  -4.985   6.799  -4.450
   53   HG12  ILE   8          2HG1      ILE   8  -7.032   5.931  -6.485
   54   HG13  ILE   8          1HG1      ILE   8  -5.550   5.069  -6.160
   55   HG21  ILE   8          1HG2      ILE   8  -7.208   7.637  -4.036
   56   HG22  ILE   8          2HG2      ILE   8  -7.342   8.168  -5.709
   57   HG23  ILE   8          3HG2      ILE   8  -6.180   8.942  -4.630
   58   HD11  ILE   8          3HD1      ILE   8  -7.271   3.973  -4.983
   59   HD12  ILE   8          1HD1      ILE   8  -7.846   5.495  -4.301
   60   HD13  ILE   8          2HD1      ILE   8  -6.290   4.836  -3.803
   61    H    ILE   9           H        ILE   9  -4.400   9.927  -7.092
   62    HA   ILE   9           HA       ILE   9  -1.762  10.161  -5.985
   63    HB   ILE   9           HB       ILE   9  -3.340  12.522  -6.919
   64   HG12  ILE   9          2HG1      ILE   9  -3.690  10.700  -8.590
   65   HG13  ILE   9          1HG1      ILE   9  -2.797  12.073  -9.230
   66   HG21  ILE   9          1HG2      ILE   9  -1.130  12.888  -5.977
   67   HG22  ILE   9          2HG2      ILE   9  -1.135  13.272  -7.698
   68   HG23  ILE   9          3HG2      ILE   9  -0.425  11.755  -7.132
   69   HD11  ILE   9          3HD1      ILE   9  -1.836  10.015 -10.016
   70   HD12  ILE   9          1HD1      ILE   9  -1.643   9.439  -8.361
   71   HD13  ILE   9          2HD1      ILE   9  -0.706  10.821  -8.927
   72    H    ILE  10           H        ILE  10  -1.646  10.189  -3.799
   73    HA   ILE  10           HA       ILE  10  -3.529  11.732  -2.222
   74    HB   ILE  10           HB       ILE  10  -0.864  10.602  -1.288
   75   HG12  ILE  10          2HG1      ILE  10  -3.295   9.226  -0.426
   76   HG13  ILE  10          1HG1      ILE  10  -2.939   9.035  -2.113
   77   HG21  ILE  10          1HG2      ILE  10  -2.218  10.595   0.917
   78   HG22  ILE  10          2HG2      ILE  10  -3.250  11.760   0.091
   79   HG23  ILE  10          3HG2      ILE  10  -1.539  12.113   0.330
   80   HD11  ILE  10          3HD1      ILE  10  -0.628   8.348  -1.442
   81   HD12  ILE  10          1HD1      ILE  10  -1.934   7.236  -1.030
   82   HD13  ILE  10          2HD1      ILE  10  -1.254   8.287   0.207
   83    H    HIS  11           H        HIS  11  -2.729  13.560  -0.863
   84    HA   HIS  11           HA       HIS  11  -0.325  14.851  -1.867
   85    HB2  HIS  11           2HB      HIS  11  -2.204  15.785  -3.198
   86    HB3  HIS  11           1HB      HIS  11  -3.017  16.255  -1.710
   87    HD2  HIS  11           2HD      HIS  11   0.463  17.092  -3.400
   88    HE1  HIS  11           1HE      HIS  11  -1.040  20.480  -1.357
   89    HE2  HIS  11           2HE      HIS  11   0.941  19.519  -2.613
   90    H    ARG  12           H        ARG  12   0.850  15.156  -0.137
   91    HA   ARG  12           HA       ARG  12  -0.101  15.013   2.510
   92    HB2  ARG  12           2HB      ARG  12   2.218  14.522   1.697
   93    HB3  ARG  12           1HB      ARG  12   2.472  16.251   1.531
   94    HG2  ARG  12           2HG      ARG  12   2.238  16.576   3.890
   95    HG3  ARG  12           1HG      ARG  12   1.780  14.885   4.118
   96    HD2  ARG  12           2HD      ARG  12   3.953  14.162   3.349
   97    HD3  ARG  12           1HD      ARG  12   4.416  15.828   3.018
   98    HE   ARG  12           HE       ARG  12   3.673  15.171   5.763
   99   HH11  ARG  12          1HH1      ARG  12   6.233  15.765   3.438
  100   HH12  ARG  12          2HH1      ARG  12   7.436  16.056   4.653
  101   HH21  ARG  12          1HH2      ARG  12   5.267  15.551   7.355
  102   HH22  ARG  12          2HH2      ARG  12   6.886  15.942   6.872
  103    H    ALA  13           H        ALA  13  -1.655  16.473   3.015
  104    HA   ALA  13           HA       ALA  13  -1.428  19.269   2.396
  105    HB1  ALA  13           1HB      ALA  13  -3.524  19.460   3.709
  106    HB2  ALA  13           2HB      ALA  13  -3.394  17.744   4.099
  107    HB3  ALA  13           3HB      ALA  13  -3.609  18.254   2.425
  108    H    GLY  14           H        GLY  14   0.828  18.901   3.662
  109    HA2  GLY  14           2HA      GLY  14   2.078  19.869   5.338
  110    HA3  GLY  14           1HA      GLY  14   0.596  20.542   5.996
  111    H    LYS  15           H        LYS  15   0.283  17.233   5.592
  112    HA   LYS  15           HA       LYS  15   1.264  16.688   8.297
  113    HB2  LYS  15           2HB      LYS  15  -0.878  15.159   8.441
  114    HB3  LYS  15           1HB      LYS  15  -0.943  16.857   8.882
  115    HG2  LYS  15           2HG      LYS  15  -1.986  17.436   6.824
  116    HG3  LYS  15           1HG      LYS  15  -1.696  15.831   6.154
  117    HD2  LYS  15           2HD      LYS  15  -3.975  15.866   6.795
  118    HD3  LYS  15           1HD      LYS  15  -3.139  14.931   8.034
  119    HE2  LYS  15           2HE      LYS  15  -3.047  16.970   9.444
  120    HE3  LYS  15           1HE      LYS  15  -3.993  17.818   8.223
  121    HZ1  LYS  15           3HZ      LYS  15  -5.459  17.072   9.918
  122    HZ2  LYS  15           1HZ      LYS  15  -4.854  15.495   9.858
  123    HZ3  LYS  15           2HZ      LYS  15  -5.744  16.111   8.559
  124    H    LYS  16           H        LYS  16  -0.639  14.529   6.257
  125    HA   LYS  16           HA       LYS  16   1.690  13.059   5.379
  126    HB2  LYS  16           2HB      LYS  16   0.773  10.927   6.451
  127    HB3  LYS  16           1HB      LYS  16   1.572  12.067   7.519
  128    HG2  LYS  16           2HG      LYS  16  -0.731  12.969   8.061
  129    HG3  LYS  16           1HG      LYS  16  -1.365  11.544   7.234
  130    HD2  LYS  16           2HD      LYS  16  -0.363  10.078   8.795
  131    HD3  LYS  16           1HD      LYS  16   0.632  11.367   9.473
  132    HE2  LYS  16           2HE      LYS  16  -1.393  12.475  10.302
  133    HE3  LYS  16           1HE      LYS  16  -2.370  11.159   9.654
  134    HZ1  LYS  16           3HZ      LYS  16  -0.237  10.805  11.689
  135    HZ2  LYS  16           1HZ      LYS  16  -1.340   9.637  11.160
  136    HZ3  LYS  16           2HZ      LYS  16  -1.876  10.964  12.058
  137    H    TYR  17           H        TYR  17   0.610  10.721   4.593
  138    HA   TYR  17           HA       TYR  17  -1.270  11.591   2.556
  139    HB2  TYR  17           2HB      TYR  17   0.010   8.864   2.756
  140    HB3  TYR  17           1HB      TYR  17  -0.721   9.621   1.324
  141    HD1  TYR  17           2HD      TYR  17   0.392  11.453   0.194
  142    HD2  TYR  17           1HD      TYR  17   2.276   9.475   3.441
  143    HE1  TYR  17           2HE      TYR  17   2.532  12.494  -0.429
  144    HE2  TYR  17           1HE      TYR  17   4.421  10.502   2.837
  145    HH   TYR  17           HH       TYR  17   5.283  11.558   0.225
  146    H    GLY  18           H        GLY  18  -1.496  10.588   5.564
  147    HA2  GLY  18           2HA      GLY  18  -3.143   9.770   6.879
  148    HA3  GLY  18           1HA      GLY  18  -4.210  10.315   5.620
  149    H    PHE  19           H        PHE  19  -1.928   7.621   5.676
  150    HA   PHE  19           HA       PHE  19  -4.021   5.720   6.086
  151    HB2  PHE  19           2HB      PHE  19  -4.127   4.635   4.017
  152    HB3  PHE  19           1HB      PHE  19  -4.240   6.319   3.644
  153    HD1  PHE  19           2HD      PHE  19  -1.967   7.486   3.013
  154    HD2  PHE  19           1HD      PHE  19  -2.659   3.293   2.906
  155    HE1  PHE  19           2HE      PHE  19  -0.062   7.207   1.468
  156    HE2  PHE  19           1HE      PHE  19  -0.758   3.007   1.375
  157    HZ   PHE  19           HZ       PHE  19   0.542   4.966   0.652
  158    H    THR  20           H        THR  20  -3.432   3.688   6.379
  159    HA   THR  20           HA       THR  20  -0.641   3.307   7.214
  160    HB   THR  20           HB       THR  20  -3.090   1.616   7.758
  161    HG1  THR  20           1HG      THR  20  -2.442   3.988   8.692
  162   HG21  THR  20          3HG2      THR  20  -0.484   1.607   9.268
  163   HG22  THR  20          1HG2      THR  20  -0.836   0.479   7.958
  164   HG23  THR  20          2HG2      THR  20  -1.834   0.480   9.415
  165    H    LEU  21           H        LEU  21   0.737   2.349   5.785
  166    HA   LEU  21           HA       LEU  21  -0.310   0.501   3.800
  167    HB2  LEU  21           2HB      LEU  21   1.667   2.303   3.519
  168    HB3  LEU  21           1HB      LEU  21   2.626   0.948   4.043
  169    HG   LEU  21           HG       LEU  21   2.496  -0.056   2.054
  170   HD11  LEU  21          1HD1      LEU  21   0.194  -0.767   2.388
  171   HD12  LEU  21          2HD1      LEU  21   0.454  -0.268   0.717
  172   HD13  LEU  21          3HD1      LEU  21  -0.385   0.805   1.835
  173   HD21  LEU  21          3HD2      LEU  21   1.268   2.525   1.132
  174   HD22  LEU  21          1HD2      LEU  21   2.258   1.411   0.190
  175   HD23  LEU  21          2HD2      LEU  21   2.973   2.319   1.524
  176    H    ARG  22           H        ARG  22  -0.949  -1.164   5.212
  177    HA   ARG  22           HA       ARG  22   0.817  -2.451   7.033
  178    HB2  ARG  22           2HB      ARG  22  -1.860  -2.535   6.596
  179    HB3  ARG  22           1HB      ARG  22  -1.374  -4.039   5.833
  180    HG2  ARG  22           2HG      ARG  22  -1.926  -4.596   8.037
  181    HG3  ARG  22           1HG      ARG  22  -0.163  -4.583   7.983
  182    HD2  ARG  22           2HD      ARG  22  -0.081  -2.439   9.043
  183    HD3  ARG  22           1HD      ARG  22  -1.832  -2.251   8.914
  184    HE   ARG  22           HE       ARG  22  -1.569  -4.521  10.352
  185   HH11  ARG  22          1HH1      ARG  22  -0.281  -1.285  10.743
  186   HH12  ARG  22          2HH1      ARG  22  -0.136  -1.419  12.465
  187   HH21  ARG  22          1HH2      ARG  22  -1.376  -4.694  12.605
  188   HH22  ARG  22          2HH2      ARG  22  -0.722  -3.369  13.524
  189    H    ALA  23           H        ALA  23   2.336  -3.983   6.654
  190    HA   ALA  23           HA       ALA  23   2.705  -4.924   3.913
  191    HB1  ALA  23           1HB      ALA  23   4.504  -5.128   6.329
  192    HB2  ALA  23           2HB      ALA  23   4.657  -3.978   4.998
  193    HB3  ALA  23           3HB      ALA  23   4.908  -5.698   4.708
  194    H    ILE  24           H        ILE  24   2.469  -7.032   3.302
  195    HA   ILE  24           HA       ILE  24   2.281  -9.097   5.341
  196    HB   ILE  24           HB       ILE  24   0.171  -9.967   4.080
  197   HG12  ILE  24          2HG1      ILE  24  -0.256  -6.996   3.749
  198   HG13  ILE  24          1HG1      ILE  24   0.270  -8.041   2.431
  199   HG21  ILE  24          1HG2      ILE  24   0.083  -7.764   6.128
  200   HG22  ILE  24          2HG2      ILE  24   0.210  -9.497   6.436
  201   HG23  ILE  24          3HG2      ILE  24  -1.266  -8.831   5.737
  202   HD11  ILE  24          3HD1      ILE  24  -1.792  -9.394   2.797
  203   HD12  ILE  24          1HD1      ILE  24  -2.077  -7.746   2.246
  204   HD13  ILE  24          2HD1      ILE  24  -2.326  -8.163   3.941
  205    H    ARG  25           H        ARG  25   3.398 -10.782   4.682
  206    HA   ARG  25           HA       ARG  25   3.947 -11.098   1.830
  207    HB2  ARG  25           2HB      ARG  25   5.193 -12.508   4.199
  208    HB3  ARG  25           1HB      ARG  25   5.722 -12.637   2.531
  209    HG2  ARG  25           2HG      ARG  25   6.230 -10.220   2.551
  210    HG3  ARG  25           1HG      ARG  25   5.839 -10.202   4.273
  211    HD2  ARG  25           2HD      ARG  25   7.944 -11.931   2.990
  212    HD3  ARG  25           1HD      ARG  25   8.252 -10.425   3.841
  213    HE   ARG  25           HE       ARG  25   6.829 -12.043   5.584
  214   HH11  ARG  25          1HH1      ARG  25   9.929 -12.052   3.967
  215   HH12  ARG  25          2HH1      ARG  25  10.700 -13.038   5.169
  216   HH21  ARG  25          1HH2      ARG  25   7.858 -13.353   7.184
  217   HH22  ARG  25          2HH2      ARG  25   9.529 -13.769   6.992
  218    H    VAL  26           H        VAL  26   2.258 -12.131   0.938
  219    HA   VAL  26           HA       VAL  26   0.842 -14.217   2.298
  220    HB   VAL  26           HB       VAL  26  -0.197 -14.525  -0.057
  221   HG11  VAL  26          1HG1      VAL  26  -1.357 -12.144   0.351
  222   HG12  VAL  26          2HG1      VAL  26  -0.535 -12.332   1.901
  223   HG13  VAL  26          3HG1      VAL  26  -1.683 -13.555   1.359
  224   HG21  VAL  26          3HG2      VAL  26   1.619 -13.285  -1.215
  225   HG22  VAL  26          1HG2      VAL  26   1.053 -11.812  -0.433
  226   HG23  VAL  26          2HG2      VAL  26   0.003 -12.669  -1.560
  227    H    TYR  27           H        TYR  27   1.720 -16.129   2.593
  228    HA   TYR  27           HA       TYR  27   3.669 -17.226   0.781
  229    HB2  TYR  27           2HB      TYR  27   2.373 -18.234   3.306
  230    HB3  TYR  27           1HB      TYR  27   3.430 -19.256   2.341
  231    HD1  TYR  27           2HD      TYR  27   3.318 -16.047   4.213
  232    HD2  TYR  27           1HD      TYR  27   5.762 -19.128   2.593
  233    HE1  TYR  27           2HE      TYR  27   5.268 -15.097   5.367
  234    HE2  TYR  27           1HE      TYR  27   7.720 -18.189   3.750
  235    HH   TYR  27           HH       TYR  27   8.504 -16.241   4.780
  236    H    MET  28           H        MET  28   2.816 -17.720  -1.149
  237    HA   MET  28           HA       MET  28   0.605 -19.657  -1.177
  238    HB2  MET  28           2HB      MET  28   1.019 -17.331  -3.045
  239    HB3  MET  28           1HB      MET  28  -0.128 -18.618  -3.337
  240    HG2  MET  28           2HG      MET  28  -1.213 -18.010  -1.240
  241    HG3  MET  28           1HG      MET  28  -0.129 -16.641  -1.094
  242    HE1  MET  28           3HE      MET  28   0.076 -15.737  -4.229
  243    HE2  MET  28           1HE      MET  28  -0.020 -14.678  -2.822
  244    HE3  MET  28           2HE      MET  28  -1.137 -14.458  -4.168
  245    H    GLY  29           H        GLY  29   1.075 -21.488  -2.189
  246    HA2  GLY  29           2HA      GLY  29   1.986 -22.339  -4.401
  247    HA3  GLY  29           1HA      GLY  29   3.476 -21.545  -3.901
  248    H    ASP  30           H        ASP  30   3.568 -24.208  -4.468
  249    HA   ASP  30           HA       ASP  30   3.120 -25.844  -2.188
  250    HB2  ASP  30           2HB      ASP  30   4.342 -27.575  -3.363
  251    HB3  ASP  30           1HB      ASP  30   3.259 -26.767  -4.481
  252    H    SER  31           H        SER  31   6.017 -24.291  -3.507
  253    HA   SER  31           HA       SER  31   7.708 -25.201  -1.380
  254    HB2  SER  31           2HB      SER  31   8.494 -22.866  -3.041
  255    HB3  SER  31           1HB      SER  31   9.412 -24.314  -2.625
  256    HG   SER  31           HG       SER  31   7.746 -25.388  -4.083
  257    H    ASP  32           H        ASP  32   9.136 -23.213  -0.414
  258    HA   ASP  32           HA       ASP  32   7.323 -21.817   1.333
  259    HB2  ASP  32           2HB      ASP  32   9.897 -22.757   1.578
  260    HB3  ASP  32           1HB      ASP  32  10.152 -21.024   1.422
  261    H    VAL  33           H        VAL  33   7.137 -21.087  -1.439
  262    HA   VAL  33           HA       VAL  33   8.401 -18.533  -1.779
  263    HB   VAL  33           HB       VAL  33   8.133 -19.864  -3.755
  264   HG11  VAL  33          1HG1      VAL  33   6.288 -21.275  -3.112
  265   HG12  VAL  33          2HG1      VAL  33   5.898 -20.478  -4.637
  266   HG13  VAL  33          3HG1      VAL  33   5.183 -19.903  -3.130
  267   HG21  VAL  33          3HG2      VAL  33   6.847 -18.340  -5.212
  268   HG22  VAL  33          1HG2      VAL  33   7.934 -17.485  -4.117
  269   HG23  VAL  33          2HG2      VAL  33   6.205 -17.546  -3.774
  270    H    TYR  34           H        TYR  34   7.486 -16.589  -1.592
  271    HA   TYR  34           HA       TYR  34   4.656 -16.345  -0.928
  272    HB2  TYR  34           2HB      TYR  34   5.207 -14.913   1.045
  273    HB3  TYR  34           1HB      TYR  34   5.680 -16.598   1.251
  274    HD1  TYR  34           2HD      TYR  34   8.041 -17.238   1.248
  275    HD2  TYR  34           1HD      TYR  34   6.873 -13.163   0.886
  276    HE1  TYR  34           2HE      TYR  34  10.335 -16.538   1.781
  277    HE2  TYR  34           1HE      TYR  34   9.169 -12.453   1.412
  278    HH   TYR  34           HH       TYR  34  11.741 -14.233   1.157
  279    H    THR  35           H        THR  35   3.833 -14.196  -1.218
  280    HA   THR  35           HA       THR  35   5.668 -12.512  -2.793
  281    HB   THR  35           HB       THR  35   3.015 -11.608  -3.148
  282    HG1  THR  35           1HG      THR  35   3.327 -14.435  -3.386
  283   HG21  THR  35          3HG2      THR  35   3.434 -12.205  -5.485
  284   HG22  THR  35          1HG2      THR  35   4.824 -13.170  -4.992
  285   HG23  THR  35          2HG2      THR  35   4.840 -11.422  -4.764
  286    H    VAL  36           H        VAL  36   6.235 -10.630  -1.975
  287    HA   VAL  36           HA       VAL  36   5.119  -9.771   0.549
  288    HB   VAL  36           HB       VAL  36   7.196  -8.296  -1.069
  289   HG11  VAL  36          1HG1      VAL  36   7.918  -7.649   1.290
  290   HG12  VAL  36          2HG1      VAL  36   6.360  -8.288   1.818
  291   HG13  VAL  36          3HG1      VAL  36   6.422  -6.940   0.684
  292   HG21  VAL  36          3HG2      VAL  36   7.967 -10.587  -0.812
  293   HG22  VAL  36          1HG2      VAL  36   7.638 -10.524   0.920
  294   HG23  VAL  36          2HG2      VAL  36   8.903  -9.510   0.223
  295    H    HIS  37           H        HIS  37   3.131  -8.911   0.333
  296    HA   HIS  37           HA       HIS  37   2.787  -6.757  -1.649
  297    HB2  HIS  37           2HB      HIS  37   0.732  -8.611  -0.427
  298    HB3  HIS  37           1HB      HIS  37   0.326  -7.201  -1.395
  299    HD2  HIS  37           2HD      HIS  37   0.030 -10.611  -2.060
  300    HE1  HIS  37           1HE      HIS  37   2.163  -9.287  -5.465
  301    HE2  HIS  37           2HE      HIS  37   0.957 -11.243  -4.399
  302    H    HIS  38           H        HIS  38   0.767  -5.377  -0.822
  303    HA   HIS  38           HA       HIS  38   0.934  -4.785   2.014
  304    HB2  HIS  38           2HB      HIS  38   1.576  -2.670  -0.067
  305    HB3  HIS  38           1HB      HIS  38   1.443  -2.407   1.667
  306    HD2  HIS  38           2HD      HIS  38   4.018  -3.275  -0.951
  307    HE1  HIS  38           1HE      HIS  38   5.744  -4.141   2.803
  308    HE2  HIS  38           2HE      HIS  38   6.109  -4.171   0.303
  309    H    MET  39           H        MET  39  -0.808  -3.403   2.697
  310    HA   MET  39           HA       MET  39  -2.864  -2.780   0.724
  311    HB2  MET  39           2HB      MET  39  -3.329  -4.669   3.049
  312    HB3  MET  39           1HB      MET  39  -4.619  -3.915   2.125
  313    HG2  MET  39           2HG      MET  39  -3.265  -5.047   0.121
  314    HG3  MET  39           1HG      MET  39  -2.828  -6.148   1.421
  315    HE1  MET  39           3HE      MET  39  -6.322  -7.444   2.617
  316    HE2  MET  39           1HE      MET  39  -5.418  -6.077   3.263
  317    HE3  MET  39           2HE      MET  39  -4.574  -7.560   2.825
  318    H    VAL  40           H        VAL  40  -4.266  -1.176   1.404
  319    HA   VAL  40           HA       VAL  40  -3.311   0.441   3.551
  320    HB   VAL  40           HB       VAL  40  -4.176   1.600   1.653
  321   HG11  VAL  40          1HG1      VAL  40  -6.554   1.475   1.000
  322   HG12  VAL  40          2HG1      VAL  40  -6.765   0.140   2.132
  323   HG13  VAL  40          3HG1      VAL  40  -5.685  -0.040   0.750
  324   HG21  VAL  40          3HG2      VAL  40  -4.635   2.440   4.029
  325   HG22  VAL  40          1HG2      VAL  40  -6.310   1.982   3.723
  326   HG23  VAL  40          2HG2      VAL  40  -5.526   3.188   2.702
  327    H    TRP  41           H        TRP  41  -3.551  -0.260   5.485
  328    HA   TRP  41           HA       TRP  41  -5.665  -1.918   6.411
  329    HB2  TRP  41           2HB      TRP  41  -3.196  -1.522   7.254
  330    HB3  TRP  41           1HB      TRP  41  -3.977  -0.333   8.277
  331    HD1  TRP  41           HD       TRP  41  -4.065  -1.398  10.574
  332    HE1  TRP  41           1HE      TRP  41  -4.908  -3.620  11.539
  333    HE3  TRP  41           3HE      TRP  41  -5.209  -3.787   6.202
  334    HZ2  TRP  41           2HZ      TRP  41  -5.948  -6.076  10.563
  335    HZ3  TRP  41           3HZ      TRP  41  -6.131  -6.061   6.309
  336    HH2  TRP  41           HH       TRP  41  -6.492  -7.182   8.448
  337    H    HIS  42           H        HIS  42  -4.888   1.461   6.711
  338    HA   HIS  42           HA       HIS  42  -7.648   2.113   7.321
  339    HB2  HIS  42           2HB      HIS  42  -6.145   1.588   9.464
  340    HB3  HIS  42           1HB      HIS  42  -5.638   3.244   9.205
  341    HD2  HIS  42           2HD      HIS  42  -7.856   5.130   9.240
  342    HE1  HIS  42           1HE      HIS  42 -10.123   2.575  11.732
  343    HE2  HIS  42           2HE      HIS  42  -9.993   4.876  10.684
  344    H    VAL  43           H        VAL  43  -8.137   4.012   6.416
  345    HA   VAL  43           HA       VAL  43  -5.919   5.850   5.889
  346    HB   VAL  43           HB       VAL  43  -6.372   4.801   3.796
  347   HG11  VAL  43          1HG1      VAL  43  -8.517   3.894   4.076
  348   HG12  VAL  43          2HG1      VAL  43  -8.616   5.034   2.734
  349   HG13  VAL  43          3HG1      VAL  43  -9.230   5.487   4.325
  350   HG21  VAL  43          3HG2      VAL  43  -5.923   7.208   3.753
  351   HG22  VAL  43          1HG2      VAL  43  -7.663   7.514   3.803
  352   HG23  VAL  43          2HG2      VAL  43  -6.960   6.691   2.413
  353    H    GLU  44           H        GLU  44  -6.191   7.775   6.569
  354    HA   GLU  44           HA       GLU  44  -8.382   8.535   8.159
  355    HB2  GLU  44           2HB      GLU  44  -5.940   9.917   7.110
  356    HB3  GLU  44           1HB      GLU  44  -7.133  10.765   8.067
  357    HG2  GLU  44           2HG      GLU  44  -6.751   9.422   9.951
  358    HG3  GLU  44           1HG      GLU  44  -5.860   8.229   9.010
  359    H    ASP  45           H        ASP  45 -10.280   9.126   7.462
  360    HA   ASP  45           HA       ASP  45 -10.688  10.204   4.812
  361    HB2  ASP  45           2HB      ASP  45 -13.093  10.110   5.445
  362    HB3  ASP  45           1HB      ASP  45 -12.271   8.568   5.652
  363    H    GLY  46           H        GLY  46  -9.108  11.936   6.209
  364    HA2  GLY  46           2HA      GLY  46 -10.965  14.130   6.873
  365    HA3  GLY  46           1HA      GLY  46  -9.415  13.915   7.661
  366    H    GLY  47           H        GLY  47  -8.810  13.164   4.507
  367    HA2  GLY  47           2HA      GLY  47  -8.934  15.457   3.045
  368    HA3  GLY  47           1HA      GLY  47  -7.569  15.729   4.105
  369    HA   PRO  48           HA       PRO  48  -4.685  13.506   1.645
  370    HB2  PRO  48           2HB      PRO  48  -4.614  11.228   3.557
  371    HB3  PRO  48           1HB      PRO  48  -3.286  12.180   2.883
  372    HG2  PRO  48           2HG      PRO  48  -4.033  12.627   5.351
  373    HG3  PRO  48           1HG      PRO  48  -3.772  14.021   4.275
  374    HD2  PRO  48           2HD      PRO  48  -6.354  12.706   5.066
  375    HD3  PRO  48           1HD      PRO  48  -5.929  14.428   5.028
  376    H    ALA  49           H        ALA  49  -4.408  10.441   2.052
  377    HA   ALA  49           HA       ALA  49  -5.140   9.562  -0.385
  378    HB1  ALA  49           1HB      ALA  49  -4.188   7.687   0.296
  379    HB2  ALA  49           2HB      ALA  49  -5.444   7.393   1.502
  380    HB3  ALA  49           3HB      ALA  49  -4.057   8.408   1.907
  381    H    SER  50           H        SER  50  -7.318   9.522   2.436
  382    HA   SER  50           HA       SER  50  -9.295   7.895   1.305
  383    HB2  SER  50           2HB      SER  50  -9.102   9.756   3.558
  384    HB3  SER  50           1HB      SER  50 -10.726   9.558   2.910
  385    HG   SER  50           HG       SER  50  -9.810   8.012   4.616
  386    H    GLU  51           H        GLU  51  -9.304  11.457   1.534
  387    HA   GLU  51           HA       GLU  51 -11.611  11.803  -0.055
  388    HB2  GLU  51           2HB      GLU  51  -9.393  13.795   0.377
  389    HB3  GLU  51           1HB      GLU  51 -11.062  14.147  -0.059
  390    HG2  GLU  51           2HG      GLU  51 -11.396  12.735   2.219
  391    HG3  GLU  51           1HG      GLU  51  -9.871  13.551   2.546
  392    H    ALA  52           H        ALA  52  -8.265  11.437  -0.761
  393    HA   ALA  52           HA       ALA  52  -8.200  12.435  -3.385
  394    HB1  ALA  52           1HB      ALA  52  -6.242  11.778  -1.911
  395    HB2  ALA  52           2HB      ALA  52  -6.132  11.316  -3.613
  396    HB3  ALA  52           3HB      ALA  52  -6.566  10.114  -2.395
  397    H    GLY  53           H        GLY  53  -9.334   9.435  -2.014
  398    HA2  GLY  53           2HA      GLY  53 -11.157   8.524  -3.561
  399    HA3  GLY  53           1HA      GLY  53  -9.835   8.380  -4.705
  400    H    LEU  54           H        LEU  54  -8.282   7.755  -1.973
  401    HA   LEU  54           HA       LEU  54  -8.216   4.959  -2.453
  402    HB2  LEU  54           2HB      LEU  54  -6.465   6.620  -1.327
  403    HB3  LEU  54           1HB      LEU  54  -7.205   6.002   0.131
  404    HG   LEU  54           HG       LEU  54  -5.829   4.381  -2.010
  405   HD11  LEU  54          1HD1      LEU  54  -4.237   5.557  -0.655
  406   HD12  LEU  54          2HD1      LEU  54  -4.252   3.861  -0.170
  407   HD13  LEU  54          3HD1      LEU  54  -5.070   5.069   0.820
  408   HD21  LEU  54          3HD2      LEU  54  -6.987   3.435   0.584
  409   HD22  LEU  54          1HD2      LEU  54  -6.201   2.462  -0.658
  410   HD23  LEU  54          2HD2      LEU  54  -7.751   3.233  -0.990
  411    H    ARG  55           H        ARG  55  -9.600   3.525  -1.863
  412    HA   ARG  55           HA       ARG  55 -11.418   4.061   0.354
  413    HB2  ARG  55           2HB      ARG  55 -12.658   2.076  -0.444
  414    HB3  ARG  55           1HB      ARG  55 -12.477   3.298  -1.689
  415    HG2  ARG  55           2HG      ARG  55 -11.832   1.622  -3.003
  416    HG3  ARG  55           1HG      ARG  55 -10.303   1.686  -2.124
  417    HD2  ARG  55           2HD      ARG  55 -11.046  -0.583  -2.131
  418    HD3  ARG  55           1HD      ARG  55 -11.263   0.045  -0.500
  419    HE   ARG  55           HE       ARG  55 -13.641   0.367  -1.992
  420   HH11  ARG  55          1HH1      ARG  55 -11.721  -2.105  -0.413
  421   HH12  ARG  55          2HH1      ARG  55 -13.086  -3.136  -0.112
  422   HH21  ARG  55          1HH2      ARG  55 -15.429  -0.999  -1.598
  423   HH22  ARG  55          2HH2      ARG  55 -15.187  -2.508  -0.777
  424    H    GLN  56           H        GLN  56 -10.932   3.317   2.336
  425    HA   GLN  56           HA       GLN  56  -8.790   1.756   3.023
  426    HB2  GLN  56           2HB      GLN  56 -10.272   2.996   4.592
  427    HB3  GLN  56           1HB      GLN  56 -11.434   1.704   4.458
  428    HG2  GLN  56           2HG      GLN  56 -10.072   0.245   5.550
  429    HG3  GLN  56           1HG      GLN  56  -8.625   1.191   5.290
  430   HE21  GLN  56          1HE2      GLN  56  -9.847   0.110   7.749
  431   HE22  GLN  56          2HE2      GLN  56 -10.050   1.469   8.797
  432    H    GLY  57           H        GLY  57  -8.305  -0.363   3.083
  433    HA2  GLY  57           2HA      GLY  57  -8.671  -2.671   2.997
  434    HA3  GLY  57           1HA      GLY  57 -10.375  -2.366   2.680
  435    H    ASP  58           H        ASP  58  -7.271  -1.636   1.128
  436    HA   ASP  58           HA       ASP  58  -8.169  -2.933  -1.334
  437    HB2  ASP  58           2HB      ASP  58  -8.503  -0.271  -1.212
  438    HB3  ASP  58           1HB      ASP  58  -6.810  -0.320  -1.701
  439    H    LEU  59           H        LEU  59  -6.494  -3.635  -2.642
  440    HA   LEU  59           HA       LEU  59  -3.970  -3.926  -1.211
  441    HB2  LEU  59           2HB      LEU  59  -4.792  -6.011  -1.931
  442    HB3  LEU  59           1HB      LEU  59  -5.235  -5.388  -3.506
  443    HG   LEU  59           HG       LEU  59  -2.679  -5.062  -3.844
  444   HD11  LEU  59          1HD1      LEU  59  -1.996  -5.466  -1.559
  445   HD12  LEU  59          2HD1      LEU  59  -1.317  -6.697  -2.626
  446   HD13  LEU  59          3HD1      LEU  59  -2.706  -7.081  -1.608
  447   HD21  LEU  59          3HD2      LEU  59  -3.960  -7.789  -3.790
  448   HD22  LEU  59          1HD2      LEU  59  -2.466  -7.388  -4.637
  449   HD23  LEU  59          2HD2      LEU  59  -3.985  -6.636  -5.124
  450    H    ILE  60           H        ILE  60  -2.141  -2.991  -1.822
  451    HA   ILE  60           HA       ILE  60  -2.241  -1.149  -4.070
  452    HB   ILE  60           HB       ILE  60  -0.165  -1.547  -1.904
  453   HG12  ILE  60          2HG1      ILE  60  -0.874   0.895  -1.451
  454   HG13  ILE  60          1HG1      ILE  60  -2.281   0.529  -2.438
  455   HG21  ILE  60          1HG2      ILE  60   0.944   0.444  -2.812
  456   HG22  ILE  60          2HG2      ILE  60  -0.194   0.457  -4.161
  457   HG23  ILE  60          3HG2      ILE  60   0.934  -0.885  -3.969
  458   HD11  ILE  60          3HD1      ILE  60  -2.703   0.332  -0.032
  459   HD12  ILE  60          1HD1      ILE  60  -1.493  -0.948   0.058
  460   HD13  ILE  60          2HD1      ILE  60  -2.961  -1.188  -0.892
  461    H    THR  61           H        THR  61  -1.411  -1.608  -5.974
  462    HA   THR  61           HA       THR  61   0.215  -4.032  -6.235
  463    HB   THR  61           HB       THR  61  -0.479  -4.112  -8.533
  464    HG1  THR  61           1HG      THR  61  -0.513  -2.035  -9.245
  465   HG21  THR  61          3HG2      THR  61  -2.829  -3.285  -6.817
  466   HG22  THR  61          1HG2      THR  61  -2.125  -4.904  -6.886
  467   HG23  THR  61          2HG2      THR  61  -2.915  -4.224  -8.311
  468    H    HIS  62           H        HIS  62   0.120  -0.618  -7.077
  469    HA   HIS  62           HA       HIS  62   3.020  -0.658  -7.507
  470    HB2  HIS  62           2HB      HIS  62   1.004   0.613  -9.372
  471    HB3  HIS  62           1HB      HIS  62   2.736   0.870  -9.453
  472    HD2  HIS  62           2HD      HIS  62   4.220  -1.247 -10.505
  473    HE1  HIS  62           1HE      HIS  62   0.834  -3.467 -11.731
  474    HE2  HIS  62           2HE      HIS  62   3.327  -3.137 -12.044
  475    H    VAL  63           H        VAL  63   4.003   1.445  -7.291
  476    HA   VAL  63           HA       VAL  63   2.313   3.538  -6.172
  477    HB   VAL  63           HB       VAL  63   3.114   2.324  -4.225
  478   HG11  VAL  63          1HG1      VAL  63   5.143   1.340  -5.179
  479   HG12  VAL  63          2HG1      VAL  63   5.464   2.152  -3.648
  480   HG13  VAL  63          3HG1      VAL  63   5.910   2.927  -5.169
  481   HG21  VAL  63          3HG2      VAL  63   2.861   4.507  -3.610
  482   HG22  VAL  63          1HG2      VAL  63   4.063   5.088  -4.764
  483   HG23  VAL  63          2HG2      VAL  63   4.580   4.306  -3.270
  484    H    ASN  64           H        ASN  64   2.634   5.158  -7.490
  485    HA   ASN  64           HA       ASN  64   3.633   6.765  -8.756
  486    HB2  ASN  64           2HB      ASN  64   5.043   6.662  -6.446
  487    HB3  ASN  64           1HB      ASN  64   6.320   6.341  -7.614
  488   HD21  ASN  64          1HD2      ASN  64   7.304   8.300  -7.133
  489   HD22  ASN  64          2HD2      ASN  64   6.665   9.813  -7.664
  490    H    GLY  65           H        GLY  65   3.596   4.061  -9.745
  491    HA2  GLY  65           2HA      GLY  65   4.322   3.052 -11.694
  492    HA3  GLY  65           1HA      GLY  65   5.453   4.374 -11.900
  493    H    GLU  66           H        GLU  66   5.164   2.194  -9.191
  494    HA   GLU  66           HA       GLU  66   7.563   0.763  -9.876
  495    HB2  GLU  66           2HB      GLU  66   7.963   2.948  -8.553
  496    HB3  GLU  66           1HB      GLU  66   7.292   2.070  -7.195
  497    HG2  GLU  66           2HG      GLU  66   9.802   2.092  -7.355
  498    HG3  GLU  66           1HG      GLU  66   9.044   0.514  -7.173
  499    HA   PRO  67           HA       PRO  67   4.510  -2.239  -8.338
  500    HB2  PRO  67           2HB      PRO  67   6.475  -4.261  -8.525
  501    HB3  PRO  67           1HB      PRO  67   5.214  -3.901  -9.704
  502    HG2  PRO  67           2HG      PRO  67   8.068  -3.122  -9.691
  503    HG3  PRO  67           1HG      PRO  67   6.980  -3.400 -11.063
  504    HD2  PRO  67           2HD      PRO  67   7.730  -0.932 -10.287
  505    HD3  PRO  67           1HD      PRO  67   6.144  -1.245 -10.991
  506    H    VAL  68           H        VAL  68   4.150  -2.678  -6.347
  507    HA   VAL  68           HA       VAL  68   6.194  -2.234  -4.339
  508    HB   VAL  68           HB       VAL  68   4.433  -2.335  -2.685
  509   HG11  VAL  68          1HG1      VAL  68   3.662  -0.713  -5.107
  510   HG12  VAL  68          2HG1      VAL  68   4.691  -0.208  -3.768
  511   HG13  VAL  68          3HG1      VAL  68   2.975  -0.498  -3.498
  512   HG21  VAL  68          3HG2      VAL  68   3.129  -4.153  -3.648
  513   HG22  VAL  68          1HG2      VAL  68   2.596  -3.089  -4.950
  514   HG23  VAL  68          2HG2      VAL  68   2.106  -2.762  -3.287
  515    H    HIS  69           H        HIS  69   4.876  -4.624  -6.073
  516    HA   HIS  69           HA       HIS  69   4.723  -6.857  -4.492
  517    HB2  HIS  69           2HB      HIS  69   5.295  -6.272  -7.375
  518    HB3  HIS  69           1HB      HIS  69   5.275  -7.898  -6.779
  519    HD2  HIS  69           2HD      HIS  69   2.638  -5.389  -5.476
  520    HE1  HIS  69           1HE      HIS  69   0.740  -8.132  -8.088
  521    HE2  HIS  69           2HE      HIS  69   0.384  -6.401  -6.269
  522    H    GLY  70           H        GLY  70   6.410  -7.113  -3.038
  523    HA2  GLY  70           2HA      GLY  70   8.424  -8.485  -2.836
  524    HA3  GLY  70           1HA      GLY  70   9.042  -7.673  -4.266
  525    H    LEU  71           H        LEU  71   7.701  -5.178  -2.877
  526    HA   LEU  71           HA       LEU  71  10.161  -4.213  -1.740
  527    HB2  LEU  71           2HB      LEU  71   7.399  -3.013  -1.947
  528    HB3  LEU  71           1HB      LEU  71   8.737  -2.189  -1.181
  529    HG   LEU  71           HG       LEU  71   8.414  -2.873  -4.092
  530   HD11  LEU  71          1HD1      LEU  71   8.783  -0.414  -4.303
  531   HD12  LEU  71          2HD1      LEU  71   8.724  -0.304  -2.542
  532   HD13  LEU  71          3HD1      LEU  71   7.311  -0.852  -3.439
  533   HD21  LEU  71          3HD2      LEU  71  10.692  -3.397  -3.586
  534   HD22  LEU  71          1HD2      LEU  71  10.875  -1.921  -2.639
  535   HD23  LEU  71          2HD2      LEU  71  10.657  -1.828  -4.387
  536    H    VAL  72           H        VAL  72  10.612  -3.846   0.420
  537    HA   VAL  72           HA       VAL  72   9.105  -5.398   2.304
  538    HB   VAL  72           HB       VAL  72  11.700  -4.693   2.206
  539   HG11  VAL  72          1HG1      VAL  72  10.708  -2.901   4.397
  540   HG12  VAL  72          2HG1      VAL  72  11.011  -2.303   2.767
  541   HG13  VAL  72          3HG1      VAL  72  12.326  -3.014   3.701
  542   HG21  VAL  72          3HG2      VAL  72  11.888  -5.459   4.530
  543   HG22  VAL  72          1HG2      VAL  72  10.796  -6.463   3.576
  544   HG23  VAL  72          2HG2      VAL  72  10.145  -5.284   4.713
  545    H    HIS  73           H        HIS  73   8.368  -4.389   4.411
  546    HA   HIS  73           HA       HIS  73   6.235  -2.744   4.177
  547    HB2  HIS  73           2HB      HIS  73   6.867  -3.942   6.247
  548    HB3  HIS  73           1HB      HIS  73   8.138  -2.774   6.525
  549    HD1  HIS  73           1HD      HIS  73   4.338  -2.881   6.303
  550    HD2  HIS  73           2HD      HIS  73   7.401  -0.568   7.877
  551    HE1  HIS  73           1HE      HIS  73   3.233  -1.128   7.739
  552    H    THR  74           H        THR  74   9.425  -1.653   5.161
  553    HA   THR  74           HA       THR  74   8.664   1.083   5.251
  554    HB   THR  74           HB       THR  74  10.885   1.473   5.994
  555    HG1  THR  74           1HG      THR  74  12.447   0.445   4.996
  556   HG21  THR  74          3HG2      THR  74   9.682   0.369   7.692
  557   HG22  THR  74          1HG2      THR  74  11.201  -0.522   7.597
  558   HG23  THR  74          2HG2      THR  74   9.739  -1.185   6.849
  559    H    GLU  75           H        GLU  75   9.717  -0.945   2.695
  560    HA   GLU  75           HA       GLU  75  11.078   1.040   1.188
  561    HB2  GLU  75           2HB      GLU  75  10.044  -1.693   0.628
  562    HB3  GLU  75           1HB      GLU  75  10.440  -0.644  -0.722
  563    HG2  GLU  75           2HG      GLU  75  12.696  -0.320   0.254
  564    HG3  GLU  75           1HG      GLU  75  12.284  -1.516   1.480
  565    H    VAL  76           H        VAL  76   7.717  -0.156   1.197
  566    HA   VAL  76           HA       VAL  76   6.916   1.443  -1.000
  567    HB   VAL  76           HB       VAL  76   4.589   1.163  -0.141
  568   HG11  VAL  76          1HG1      VAL  76   6.189  -1.370  -0.308
  569   HG12  VAL  76          2HG1      VAL  76   5.659  -0.403  -1.685
  570   HG13  VAL  76          3HG1      VAL  76   4.469  -1.184  -0.646
  571   HG21  VAL  76          3HG2      VAL  76   5.999   0.197   2.238
  572   HG22  VAL  76          1HG2      VAL  76   4.676  -0.835   1.695
  573   HG23  VAL  76          2HG2      VAL  76   4.365   0.865   2.080
  574    H    VAL  77           H        VAL  77   6.708   1.890   2.481
  575    HA   VAL  77           HA       VAL  77   5.636   4.402   2.682
  576    HB   VAL  77           HB       VAL  77   7.899   3.305   4.331
  577   HG11  VAL  77          1HG1      VAL  77   7.048   4.732   6.124
  578   HG12  VAL  77          2HG1      VAL  77   5.842   5.384   5.015
  579   HG13  VAL  77          3HG1      VAL  77   7.555   5.673   4.720
  580   HG21  VAL  77          3HG2      VAL  77   6.182   1.672   4.375
  581   HG22  VAL  77          1HG2      VAL  77   4.930   2.899   4.581
  582   HG23  VAL  77          2HG2      VAL  77   6.067   2.566   5.890
  583    H    GLU  78           H        GLU  78   9.055   3.521   2.283
  584    HA   GLU  78           HA       GLU  78  10.046   6.142   2.158
  585    HB2  GLU  78           2HB      GLU  78  11.085   3.493   1.246
  586    HB3  GLU  78           1HB      GLU  78  11.945   4.975   0.842
  587    HG2  GLU  78           2HG      GLU  78  11.693   5.469   3.380
  588    HG3  GLU  78           1HG      GLU  78  11.474   3.728   3.487
  589    H    LEU  79           H        LEU  79   9.059   3.886  -0.383
  590    HA   LEU  79           HA       LEU  79   9.682   5.369  -2.636
  591    HB2  LEU  79           2HB      LEU  79   8.236   3.051  -2.079
  592    HB3  LEU  79           1HB      LEU  79   7.071   4.100  -2.866
  593    HG   LEU  79           HG       LEU  79   8.098   2.671  -4.508
  594   HD11  LEU  79          1HD1      LEU  79   7.565   4.977  -5.164
  595   HD12  LEU  79          2HD1      LEU  79   8.920   4.313  -6.075
  596   HD13  LEU  79          3HD1      LEU  79   9.214   5.457  -4.764
  597   HD21  LEU  79          3HD2      LEU  79  10.740   3.821  -3.621
  598   HD22  LEU  79          1HD2      LEU  79  10.484   2.671  -4.935
  599   HD23  LEU  79          2HD2      LEU  79  10.161   2.193  -3.268
  600    H    ILE  80           H        ILE  80   6.843   5.538  -0.551
  601    HA   ILE  80           HA       ILE  80   5.443   7.467  -2.059
  602    HB   ILE  80           HB       ILE  80   5.260   6.523   0.792
  603   HG12  ILE  80          2HG1      ILE  80   3.123   6.330  -1.289
  604   HG13  ILE  80          1HG1      ILE  80   4.509   5.252  -1.384
  605   HG21  ILE  80          1HG2      ILE  80   3.822   8.764  -0.542
  606   HG22  ILE  80          2HG2      ILE  80   4.479   8.665   1.089
  607   HG23  ILE  80          3HG2      ILE  80   3.005   7.789   0.677
  608   HD11  ILE  80          3HD1      ILE  80   2.720   4.156  -0.231
  609   HD12  ILE  80          1HD1      ILE  80   2.572   5.504   0.896
  610   HD13  ILE  80          2HD1      ILE  80   4.019   4.495   0.914
  611    H    LEU  81           H        LEU  81   7.500   7.727   0.839
  612    HA   LEU  81           HA       LEU  81   7.361  10.518   1.128
  613    HB2  LEU  81           2HB      LEU  81   9.677   8.711   1.843
  614    HB3  LEU  81           1HB      LEU  81   9.381  10.318   2.481
  615    HG   LEU  81           HG       LEU  81   7.512   7.989   2.907
  616   HD11  LEU  81          1HD1      LEU  81   8.447   7.890   5.176
  617   HD12  LEU  81          2HD1      LEU  81   9.666   9.077   4.714
  618   HD13  LEU  81          3HD1      LEU  81   9.645   7.491   3.945
  619   HD21  LEU  81          3HD2      LEU  81   7.723  10.699   4.205
  620   HD22  LEU  81          1HD2      LEU  81   6.617   9.414   4.692
  621   HD23  LEU  81          2HD2      LEU  81   6.457  10.162   3.103
  622    H    LYS  82           H        LYS  82   9.495   8.466  -0.740
  623    HA   LYS  82           HA       LYS  82  11.385  10.305  -1.613
  624    HB2  LYS  82           2HB      LYS  82  11.266   7.753  -1.818
  625    HB3  LYS  82           1HB      LYS  82  10.399   8.094  -3.286
  626    HG2  LYS  82           2HG      LYS  82  12.453   9.614  -3.818
  627    HG3  LYS  82           1HG      LYS  82  13.252   8.551  -2.661
  628    HD2  LYS  82           2HD      LYS  82  11.726   7.603  -5.077
  629    HD3  LYS  82           1HD      LYS  82  13.476   7.805  -5.022
  630    HE2  LYS  82           2HE      LYS  82  13.523   6.199  -3.110
  631    HE3  LYS  82           1HE      LYS  82  11.806   5.915  -3.376
  632    HZ1  LYS  82           3HZ      LYS  82  13.123   4.226  -4.461
  633    HZ2  LYS  82           1HZ      LYS  82  13.977   5.399  -5.330
  634    HZ3  LYS  82           2HZ      LYS  82  12.329   5.161  -5.627
  635    H    SER  83           H        SER  83   8.290   9.401  -3.008
  636    HA   SER  83           HA       SER  83   8.420  10.698  -5.433
  637    HB2  SER  83           2HB      SER  83   6.591   9.209  -4.853
  638    HB3  SER  83           1HB      SER  83   6.036  10.329  -3.610
  639    HG   SER  83           HG       SER  83   4.984  11.361  -5.079
  640    H    GLY  84           H        GLY  84   7.844  12.091  -2.252
  641    HA2  GLY  84           2HA      GLY  84   8.673  14.479  -2.238
  642    HA3  GLY  84           1HA      GLY  84   7.541  14.718  -3.556
  643    H    ASN  85           H        ASN  85   5.892  15.876  -2.863
  644    HA   ASN  85           HA       ASN  85   4.937  15.491  -0.116
  645    HB2  ASN  85           2HB      ASN  85   3.687  17.593  -0.473
  646    HB3  ASN  85           1HB      ASN  85   5.420  17.790  -0.699
  647   HD21  ASN  85          1HD2      ASN  85   6.214  18.294  -2.699
  648   HD22  ASN  85          2HD2      ASN  85   5.203  18.762  -4.020
  649    H    LYS  86           H        LYS  86   4.413  14.027  -2.815
  650    HA   LYS  86           HA       LYS  86   1.767  13.210  -2.139
  651    HB2  LYS  86           2HB      LYS  86   0.887  13.642  -4.422
  652    HB3  LYS  86           1HB      LYS  86   1.051  15.051  -3.423
  653    HG2  LYS  86           2HG      LYS  86   2.918  15.818  -4.652
  654    HG3  LYS  86           1HG      LYS  86   3.103  14.261  -5.465
  655    HD2  LYS  86           2HD      LYS  86   0.909  14.593  -6.541
  656    HD3  LYS  86           1HD      LYS  86   0.794  16.178  -5.779
  657    HE2  LYS  86           2HE      LYS  86   1.537  16.358  -8.087
  658    HE3  LYS  86           1HE      LYS  86   2.790  16.904  -6.973
  659    HZ1  LYS  86           3HZ      LYS  86   4.075  15.040  -7.383
  660    HZ2  LYS  86           1HZ      LYS  86   3.435  15.375  -8.910
  661    HZ3  LYS  86           2HZ      LYS  86   2.777  14.132  -7.973
  662    H    VAL  87           H        VAL  87   0.989  11.609  -3.879
  663    HA   VAL  87           HA       VAL  87   3.016  10.276  -5.408
  664    HB   VAL  87           HB       VAL  87   3.716   9.701  -3.087
  665   HG11  VAL  87          1HG1      VAL  87   1.136   8.145  -3.029
  666   HG12  VAL  87          2HG1      VAL  87   1.501   9.579  -2.069
  667   HG13  VAL  87          3HG1      VAL  87   2.406   8.087  -1.810
  668   HG21  VAL  87          3HG2      VAL  87   2.889   7.485  -4.945
  669   HG22  VAL  87          1HG2      VAL  87   3.875   7.220  -3.506
  670   HG23  VAL  87          2HG2      VAL  87   4.470   8.259  -4.801
  671    H    ALA  88           H        ALA  88   2.285   8.552  -6.622
  672    HA   ALA  88           HA       ALA  88  -0.617   8.318  -6.901
  673    HB1  ALA  88           1HB      ALA  88   0.575   8.807  -8.922
  674    HB2  ALA  88           2HB      ALA  88  -0.052   7.160  -9.027
  675    HB3  ALA  88           3HB      ALA  88   1.652   7.436  -8.668
  676    H    ILE  89           H        ILE  89  -1.311   6.883  -5.346
  677    HA   ILE  89           HA       ILE  89   0.083   4.337  -5.070
  678    HB   ILE  89           HB       ILE  89  -0.579   5.293  -2.990
  679   HG12  ILE  89          2HG1      ILE  89  -2.611   3.128  -3.500
  680   HG13  ILE  89          1HG1      ILE  89  -0.886   2.802  -3.376
  681   HG21  ILE  89          1HG2      ILE  89  -2.338   6.775  -3.676
  682   HG22  ILE  89          2HG2      ILE  89  -2.948   5.708  -2.411
  683   HG23  ILE  89          3HG2      ILE  89  -3.374   5.412  -4.095
  684   HD11  ILE  89          3HD1      ILE  89  -2.257   2.467  -1.285
  685   HD12  ILE  89          1HD1      ILE  89  -2.419   4.221  -1.226
  686   HD13  ILE  89          2HD1      ILE  89  -0.822   3.480  -1.123
  687    H    SER  90           H        SER  90  -0.369   2.733  -6.445
  688    HA   SER  90           HA       SER  90  -2.922   2.716  -7.844
  689    HB2  SER  90           2HB      SER  90  -0.482   2.239  -8.768
  690    HB3  SER  90           1HB      SER  90  -0.868   0.598  -8.254
  691    HG   SER  90           HG       SER  90  -2.715   2.046  -9.804
  692    H    THR  91           H        THR  91  -4.550   1.902  -6.682
  693    HA   THR  91           HA       THR  91  -4.131  -0.570  -5.160
  694    HB   THR  91           HB       THR  91  -6.378  -0.049  -4.182
  695    HG1  THR  91           1HG      THR  91  -7.509   1.368  -5.254
  696   HG21  THR  91          3HG2      THR  91  -4.424   2.239  -3.921
  697   HG22  THR  91          1HG2      THR  91  -4.254   0.680  -3.105
  698   HG23  THR  91          2HG2      THR  91  -5.627   1.724  -2.737
  699    H    THR  92           H        THR  92  -6.012  -2.168  -5.279
  700    HA   THR  92           HA       THR  92  -6.655  -2.445  -8.138
  701    HB   THR  92           HB       THR  92  -5.490  -4.359  -7.457
  702    HG1  THR  92           1HG      THR  92  -8.239  -5.072  -7.204
  703   HG21  THR  92          3HG2      THR  92  -7.319  -4.564  -5.070
  704   HG22  THR  92          1HG2      THR  92  -5.635  -4.042  -5.039
  705   HG23  THR  92          2HG2      THR  92  -6.038  -5.699  -5.490
  706    HA   PRO  93           HA       PRO  93 -10.828  -1.100  -6.950
  707    HB2  PRO  93           2HB      PRO  93 -11.177  -1.857  -9.812
  708    HB3  PRO  93           1HB      PRO  93 -11.736  -0.415  -8.955
  709    HG2  PRO  93           2HG      PRO  93  -9.630  -0.306 -10.580
  710    HG3  PRO  93           1HG      PRO  93  -9.646   0.597  -9.061
  711    HD2  PRO  93           2HD      PRO  93  -8.192  -1.874  -9.763
  712    HD3  PRO  93           1HD      PRO  93  -7.713  -0.559  -8.686
  713    H    LEU  94           H        LEU  94 -13.006  -2.079  -7.465
  714    HA   LEU  94           HA       LEU  94 -13.105  -4.715  -6.502
  715    HB2  LEU  94           2HB      LEU  94 -15.517  -3.918  -7.873
  716    HB3  LEU  94           1HB      LEU  94 -15.263  -4.228  -6.184
  717    HG   LEU  94           HG       LEU  94 -14.164  -1.813  -6.269
  718   HD11  LEU  94          1HD1      LEU  94 -14.370  -1.198  -8.459
  719   HD12  LEU  94          2HD1      LEU  94 -15.879  -0.554  -7.800
  720   HD13  LEU  94          3HD1      LEU  94 -15.877  -2.092  -8.661
  721   HD21  LEU  94          3HD2      LEU  94 -15.958  -2.402  -4.777
  722   HD22  LEU  94          1HD2      LEU  94 -17.107  -2.449  -6.116
  723   HD23  LEU  94          2HD2      LEU  94 -16.391  -0.915  -5.622
  724    H    GLU  95           H        GLU  95 -14.349  -6.474  -7.588
  725    HA   GLU  95           HA       GLU  95 -14.378  -6.577 -10.444
  726    HB2  GLU  95           2HB      GLU  95 -12.725  -8.301 -10.776
  727    HB3  GLU  95           1HB      GLU  95 -11.954  -6.956  -9.950
  728    HG2  GLU  95           2HG      GLU  95 -13.017  -9.308  -8.432
  729    HG3  GLU  95           1HG      GLU  95 -11.420  -9.339  -9.173
  730    H    ASN  96           H        ASN  96 -14.869  -8.956 -11.111
  731    HA   ASN  96           HA       ASN  96 -17.117  -9.778  -9.521
  732    HB2  ASN  96           2HB      ASN  96 -17.389 -11.532 -11.317
  733    HB3  ASN  96           1HB      ASN  96 -17.438  -9.867 -11.886
  734   HD21  ASN  96          1HD2      ASN  96 -15.760  -9.080 -13.147
  735   HD22  ASN  96          2HD2      ASN  96 -14.593 -10.122 -13.889
  736    H1   SER 101           1HT      SER 101  -1.787 -18.594   4.690
  737    H2   SER 101           2HT      SER 101  -1.800 -19.337   3.168
  738    H3   SER 101           3HT      SER 101  -2.968 -18.179   3.550
  739    HA   SER 101           HA       SER 101  -0.135 -17.827   2.907
  740    HB2  SER 101           2HB      SER 101  -2.446 -16.072   2.116
  741    HB3  SER 101           1HB      SER 101  -0.921 -16.344   1.273
  742    HG   SER 101           HG       SER 101  -3.095 -17.470   0.649
  743    H    TRP 102           H        TRP 102  -2.858 -16.103   4.456
  744    HA   TRP 102           HA       TRP 102  -0.858 -14.463   5.860
  745    HB2  TRP 102           2HB      TRP 102  -2.236 -13.149   4.276
  746    HB3  TRP 102           1HB      TRP 102  -3.688 -13.681   5.118
  747    HD1  TRP 102           HD       TRP 102  -0.793 -12.823   7.368
  748    HE1  TRP 102           1HE      TRP 102  -1.257 -10.597   8.569
  749    HE3  TRP 102           3HE      TRP 102  -4.885 -11.288   4.696
  750    HZ2  TRP 102           2HZ      TRP 102  -3.086  -8.474   8.397
  751    HZ3  TRP 102           3HZ      TRP 102  -5.920  -9.131   5.292
  752    HH2  TRP 102           HH       TRP 102  -5.038  -7.762   7.098
  753    H    GLU 103           H        GLU 103  -0.684 -15.880   7.580
  754    HA   GLU 103           HA       GLU 103  -3.078 -16.493   9.124
  755    HB2  GLU 103           2HB      GLU 103  -0.209 -17.401   9.363
  756    HB3  GLU 103           1HB      GLU 103  -1.447 -17.825  10.535
  757    HG2  GLU 103           2HG      GLU 103  -1.189 -19.654   9.036
  758    HG3  GLU 103           1HG      GLU 103  -2.739 -18.889   8.693
  759    H    SER 104           H        SER 104  -0.098 -14.664   9.327
  760    HA   SER 104           HA       SER 104  -1.202 -13.023  11.432
  761    HB2  SER 104           2HB      SER 104   1.399 -14.512  11.860
  762    HB3  SER 104           1HB      SER 104   0.683 -13.337  12.963
  763    HG   SER 104           HG       SER 104  -1.170 -15.143  12.458
  764    H    HIS 105           H        HIS 105   0.984 -11.568  12.138
  765    HA   HIS 105           HA       HIS 105   1.461  -9.988   9.821
  766    HB2  HIS 105           2HB      HIS 105   2.932  -9.823  12.457
  767    HB3  HIS 105           1HB      HIS 105   2.745  -8.546  11.262
  768    HD2  HIS 105           2HD      HIS 105   0.764  -6.835  11.832
  769    HE1  HIS 105           1HE      HIS 105  -1.404  -9.357  14.446
  770    HE2  HIS 105           2HE      HIS 105  -1.136  -6.987  13.596
  771    H    LYS 106           H        LYS 106   2.346 -11.889   8.615
  772    HA   LYS 106           HA       LYS 106   5.055 -12.693   9.204
  773    HB2  LYS 106           2HB      LYS 106   3.285 -13.228   6.806
  774    HB3  LYS 106           1HB      LYS 106   4.868 -13.947   7.063
  775    HG2  LYS 106           2HG      LYS 106   4.075 -15.104   9.021
  776    HG3  LYS 106           1HG      LYS 106   2.508 -14.303   8.896
  777    HD2  LYS 106           2HD      LYS 106   1.824 -15.605   7.161
  778    HD3  LYS 106           1HD      LYS 106   3.456 -15.787   6.514
  779    HE2  LYS 106           2HE      LYS 106   3.997 -17.334   8.339
  780    HE3  LYS 106           1HE      LYS 106   2.359 -17.160   8.962
  781    HZ1  LYS 106           3HZ      LYS 106   1.476 -18.188   7.021
  782    HZ2  LYS 106           1HZ      LYS 106   2.717 -19.181   7.606
  783    HZ3  LYS 106           2HZ      LYS 106   2.990 -18.199   6.258
  784    H    SER 107           H        SER 107   5.483 -10.203   9.156
  785    HA   SER 107           HA       SER 107   6.901  -9.676   6.697
  786    HB2  SER 107           2HB      SER 107   5.750  -7.331   6.631
  787    HB3  SER 107           1HB      SER 107   4.911  -8.714   5.926
  788    HG   SER 107           HG       SER 107   3.445  -7.699   7.239
  789    H    GLY 108           H        GLY 108   5.628  -7.638   9.315
  790    HA2  GLY 108           2HA      GLY 108   7.009  -7.106  11.254
  791    HA3  GLY 108           1HA      GLY 108   8.408  -7.182  10.193
  792    H    GLY 109           H        GLY 109   6.263  -5.152  11.710
  793    HA2  GLY 109           2HA      GLY 109   6.983  -2.778  11.587
  794    HA3  GLY 109           1HA      GLY 109   6.922  -2.963   9.842
  795    H    GLU 110           H        GLU 110   5.464  -1.318  12.009
  796    HA   GLU 110           HA       GLU 110   2.762  -1.741  10.899
  797    HB2  GLU 110           2HB      GLU 110   3.578  -1.020  13.713
  798    HB3  GLU 110           1HB      GLU 110   1.964  -0.706  13.098
  799    HG2  GLU 110           2HG      GLU 110   1.764  -3.143  12.600
  800    HG3  GLU 110           1HG      GLU 110   3.295  -3.378  13.443
  801    H    THR 111           H        THR 111   5.166   0.042  10.294
  802    HA   THR 111           HA       THR 111   4.618   2.707  10.952
  803    HB   THR 111           HB       THR 111   5.828   1.975   8.305
  804    HG1  THR 111           1HG      THR 111   7.101   0.650   9.373
  805   HG21  THR 111          3HG2      THR 111   5.596   4.357   9.090
  806   HG22  THR 111          1HG2      THR 111   7.245   3.858   8.710
  807   HG23  THR 111          2HG2      THR 111   6.720   3.965  10.390
  808    H    ARG 112           H        ARG 112   3.609   4.366   9.748
  809    HA   ARG 112           HA       ARG 112   1.842   3.480   7.586
  810    HB2  ARG 112           2HB      ARG 112   0.052   4.961   8.621
  811    HB3  ARG 112           1HB      ARG 112   0.383   3.441   9.442
  812    HG2  ARG 112           2HG      ARG 112   0.646   4.594  11.317
  813    HG3  ARG 112           1HG      ARG 112   2.104   5.293  10.617
  814    HD2  ARG 112           2HD      ARG 112   0.857   7.155  11.224
  815    HD3  ARG 112           1HD      ARG 112   0.510   6.972   9.505
  816    HE   ARG 112           HE       ARG 112  -1.318   5.817  11.487
  817   HH11  ARG 112          1HH1      ARG 112  -0.690   8.060   8.851
  818   HH12  ARG 112          2HH1      ARG 112  -2.360   8.580   8.758
  819   HH21  ARG 112          1HH2      ARG 112  -3.494   6.486  11.315
  820   HH22  ARG 112          2HH2      ARG 112  -3.927   7.685  10.136
  821    H    LEU 113           H        LEU 113   0.769   5.445   6.553
  822    HA   LEU 113           HA       LEU 113   2.836   7.491   6.157
  823    HB2  LEU 113           2HB      LEU 113   0.608   6.461   4.406
  824    HB3  LEU 113           1HB      LEU 113   1.453   7.946   4.046
  825    HG   LEU 113           HG       LEU 113   2.433   6.298   2.676
  826   HD11  LEU 113          1HD1      LEU 113   4.060   7.754   3.738
  827   HD12  LEU 113          2HD1      LEU 113   4.726   6.148   3.445
  828   HD13  LEU 113          3HD1      LEU 113   4.225   6.611   5.069
  829   HD21  LEU 113          3HD2      LEU 113   2.756   4.548   5.104
  830   HD22  LEU 113          1HD2      LEU 113   3.222   4.153   3.448
  831   HD23  LEU 113          2HD2      LEU 113   1.518   4.354   3.863
  Start of MODEL    4
    1    H1   GLY   1           1HT      GLY   1 -10.809 -11.243 -13.188
    2    H2   GLY   1           2HT      GLY   1  -9.856 -12.028 -12.037
    3    H3   GLY   1           3HT      GLY   1  -9.181 -11.576 -13.518
    4    HA2  GLY   1           1HA      GLY   1 -10.142  -9.759 -11.389
    5    HA3  GLY   1           2HA      GLY   1  -8.466 -10.049 -11.821
    6    H    GLY   2           H        GLY   2  -8.335  -7.734 -12.128
    7    HA2  GLY   2           2HA      GLY   2  -9.504  -6.883 -14.704
    8    HA3  GLY   2           1HA      GLY   2  -9.267  -5.792 -13.345
    9    H    SER   3           H        SER   3  -8.051  -4.452 -14.769
   10    HA   SER   3           HA       SER   3  -5.239  -5.059 -14.703
   11    HB2  SER   3           2HB      SER   3  -6.114  -6.137 -16.844
   12    HB3  SER   3           1HB      SER   3  -6.475  -4.507 -17.409
   13    HG   SER   3           HG       SER   3  -3.954  -5.644 -16.796
   14    H    MET   4           H        MET   4  -3.962  -3.158 -15.454
   15    HA   MET   4           HA       MET   4  -3.445  -0.963 -15.251
   16    HB2  MET   4           2HB      MET   4  -5.993  -0.958 -16.784
   17    HB3  MET   4           1HB      MET   4  -5.412   0.582 -16.169
   18    HG2  MET   4           2HG      MET   4  -3.328   0.317 -17.350
   19    HG3  MET   4           1HG      MET   4  -3.808  -1.288 -17.894
   20    HE1  MET   4           3HE      MET   4  -6.299   1.715 -17.628
   21    HE2  MET   4           1HE      MET   4  -6.091   2.508 -19.190
   22    HE3  MET   4           2HE      MET   4  -4.784   2.535 -18.007
   23    H    ARG   5           H        ARG   5  -3.487  -1.166 -12.942
   24    HA   ARG   5           HA       ARG   5  -5.810  -0.472 -11.443
   25    HB2  ARG   5           2HB      ARG   5  -2.896  -0.689 -10.692
   26    HB3  ARG   5           1HB      ARG   5  -4.143  -0.239  -9.537
   27    HG2  ARG   5           2HG      ARG   5  -3.947  -2.501  -9.170
   28    HG3  ARG   5           1HG      ARG   5  -5.287  -2.440 -10.319
   29    HD2  ARG   5           2HD      ARG   5  -3.512  -2.725 -12.127
   30    HD3  ARG   5           1HD      ARG   5  -2.421  -3.180 -10.820
   31    HE   ARG   5           HE       ARG   5  -4.561  -4.803 -10.444
   32   HH11  ARG   5          1HH1      ARG   5  -2.507  -4.080 -13.180
   33   HH12  ARG   5          2HH1      ARG   5  -2.714  -5.638 -13.917
   34   HH21  ARG   5          1HH2      ARG   5  -4.846  -6.867 -11.410
   35   HH22  ARG   5          2HH2      ARG   5  -4.031  -7.240 -12.895
   36    HA   PRO   6           HA       PRO   6  -5.276   3.906 -11.924
   37    HB2  PRO   6           2HB      PRO   6  -7.374   4.427 -10.059
   38    HB3  PRO   6           1HB      PRO   6  -7.491   4.351 -11.819
   39    HG2  PRO   6           2HG      PRO   6  -8.679   2.541 -10.102
   40    HG3  PRO   6           1HG      PRO   6  -8.284   2.207 -11.790
   41    HD2  PRO   6           2HD      PRO   6  -6.765   1.536  -9.301
   42    HD3  PRO   6           1HD      PRO   6  -7.126   0.528 -10.716
   43    HA   PRO   7           HA       PRO   7  -2.851   4.647  -8.158
   44    HB2  PRO   7           2HB      PRO   7  -1.759   6.868  -9.685
   45    HB3  PRO   7           1HB      PRO   7  -0.931   5.500  -8.948
   46    HG2  PRO   7           2HG      PRO   7  -1.194   5.773 -11.617
   47    HG3  PRO   7           1HG      PRO   7  -1.170   4.187 -10.826
   48    HD2  PRO   7           2HD      PRO   7  -3.509   5.757 -11.854
   49    HD3  PRO   7           1HD      PRO   7  -3.212   4.007 -11.924
   50    H    ILE   8           H        ILE   8  -3.825   5.643  -6.613
   51    HA   ILE   8           HA       ILE   8  -5.385   8.035  -7.073
   52    HB   ILE   8           HB       ILE   8  -4.947   6.721  -4.410
   53   HG12  ILE   8          2HG1      ILE   8  -6.988   5.904  -6.477
   54   HG13  ILE   8          1HG1      ILE   8  -5.503   5.035  -6.172
   55   HG21  ILE   8          1HG2      ILE   8  -7.176   7.538  -3.973
   56   HG22  ILE   8          2HG2      ILE   8  -7.311   8.108  -5.634
   57   HG23  ILE   8          3HG2      ILE   8  -6.157   8.864  -4.536
   58   HD11  ILE   8          3HD1      ILE   8  -6.256   4.736  -3.820
   59   HD12  ILE   8          1HD1      ILE   8  -7.228   3.906  -5.035
   60   HD13  ILE   8          2HD1      ILE   8  -7.811   5.406  -4.315
   61    H    ILE   9           H        ILE   9  -4.332   9.880  -7.107
   62    HA   ILE   9           HA       ILE   9  -1.751  10.187  -5.923
   63    HB   ILE   9           HB       ILE   9  -3.350  12.509  -6.916
   64   HG12  ILE   9          2HG1      ILE   9  -3.608  10.585  -8.544
   65   HG13  ILE   9          1HG1      ILE   9  -2.857  12.030  -9.206
   66   HG21  ILE   9          1HG2      ILE   9  -1.199  13.012  -6.002
   67   HG22  ILE   9          2HG2      ILE   9  -1.090  13.178  -7.754
   68   HG23  ILE   9          3HG2      ILE   9  -0.435  11.744  -6.961
   69   HD11  ILE   9          3HD1      ILE   9  -1.729  10.072 -10.012
   70   HD12  ILE   9          1HD1      ILE   9  -1.460   9.502  -8.366
   71   HD13  ILE   9          2HD1      ILE   9  -0.654  10.962  -8.935
   72    H    ILE  10           H        ILE  10  -1.745  10.173  -3.721
   73    HA   ILE  10           HA       ILE  10  -3.669  11.717  -2.203
   74    HB   ILE  10           HB       ILE  10  -1.030  10.600  -1.194
   75   HG12  ILE  10          2HG1      ILE  10  -3.467   9.195  -0.414
   76   HG13  ILE  10          1HG1      ILE  10  -3.063   9.019  -2.091
   77   HG21  ILE  10          1HG2      ILE  10  -2.459  10.567   0.973
   78   HG22  ILE  10          2HG2      ILE  10  -3.452  11.749   0.121
   79   HG23  ILE  10          3HG2      ILE  10  -1.747  12.085   0.420
   80   HD11  ILE  10          3HD1      ILE  10  -0.762   8.352  -1.352
   81   HD12  ILE  10          1HD1      ILE  10  -2.069   7.218  -1.001
   82   HD13  ILE  10          2HD1      ILE  10  -1.447   8.265   0.271
   83    H    HIS  11           H        HIS  11  -2.956  13.547  -0.843
   84    HA   HIS  11           HA       HIS  11  -0.541  14.865  -1.819
   85    HB2  HIS  11           2HB      HIS  11  -2.493  15.844  -3.021
   86    HB3  HIS  11           1HB      HIS  11  -3.221  16.252  -1.470
   87    HD2  HIS  11           2HD      HIS  11   0.421  17.010  -2.822
   88    HE1  HIS  11           1HE      HIS  11  -1.387  20.547  -1.379
   89    HE2  HIS  11           2HE      HIS  11   0.642  19.578  -2.544
   90    H    ARG  12           H        ARG  12   0.677  14.960  -0.093
   91    HA   ARG  12           HA       ARG  12  -0.261  14.764   2.554
   92    HB2  ARG  12           2HB      ARG  12   1.981  14.072   1.798
   93    HB3  ARG  12           1HB      ARG  12   2.403  15.757   1.546
   94    HG2  ARG  12           2HG      ARG  12   2.234  16.207   3.893
   95    HG3  ARG  12           1HG      ARG  12   1.622  14.578   4.198
   96    HD2  ARG  12           2HD      ARG  12   3.694  13.620   3.422
   97    HD3  ARG  12           1HD      ARG  12   4.312  15.217   3.016
   98    HE   ARG  12           HE       ARG  12   3.688  14.400   5.790
   99   HH11  ARG  12          1HH1      ARG  12   5.757  16.018   3.459
  100   HH12  ARG  12          2HH1      ARG  12   6.940  16.474   4.643
  101   HH21  ARG  12          1HH2      ARG  12   5.234  15.018   7.336
  102   HH22  ARG  12          2HH2      ARG  12   6.639  15.911   6.851
  103    H    ALA  13           H        ALA  13  -1.625  16.292   3.228
  104    HA   ALA  13           HA       ALA  13  -1.228  19.087   2.712
  105    HB1  ALA  13           1HB      ALA  13  -3.219  19.364   4.183
  106    HB2  ALA  13           2HB      ALA  13  -3.189  17.625   4.485
  107    HB3  ALA  13           3HB      ALA  13  -3.480  18.233   2.855
  108    H    GLY  14           H        GLY  14   1.072  18.461   3.774
  109    HA2  GLY  14           2HA      GLY  14   2.489  19.364   5.380
  110    HA3  GLY  14           1HA      GLY  14   1.081  19.874   6.296
  111    H    LYS  15           H        LYS  15  -0.233  17.485   6.659
  112    HA   LYS  15           HA       LYS  15   1.387  16.324   8.724
  113    HB2  LYS  15           2HB      LYS  15  -0.801  14.769   8.777
  114    HB3  LYS  15           1HB      LYS  15  -0.710  16.341   9.546
  115    HG2  LYS  15           2HG      LYS  15  -1.833  17.379   7.699
  116    HG3  LYS  15           1HG      LYS  15  -1.801  15.870   6.785
  117    HD2  LYS  15           2HD      LYS  15  -3.997  16.188   7.749
  118    HD3  LYS  15           1HD      LYS  15  -3.199  14.818   8.523
  119    HE2  LYS  15           2HE      LYS  15  -2.572  16.282  10.409
  120    HE3  LYS  15           1HE      LYS  15  -3.412  17.622   9.630
  121    HZ1  LYS  15           3HZ      LYS  15  -4.731  15.086  10.420
  122    HZ2  LYS  15           1HZ      LYS  15  -5.478  16.502   9.878
  123    HZ3  LYS  15           2HZ      LYS  15  -4.711  16.473  11.385
  124    H    LYS  16           H        LYS  16  -0.666  14.347   6.610
  125    HA   LYS  16           HA       LYS  16   1.608  12.939   5.515
  126    HB2  LYS  16           2HB      LYS  16   0.713  10.736   6.497
  127    HB3  LYS  16           1HB      LYS  16   1.650  11.783   7.543
  128    HG2  LYS  16           2HG      LYS  16  -0.646  12.715   8.275
  129    HG3  LYS  16           1HG      LYS  16  -1.282  11.227   7.572
  130    HD2  LYS  16           2HD      LYS  16   0.033   9.886   9.058
  131    HD3  LYS  16           1HD      LYS  16   0.912  11.303   9.641
  132    HE2  LYS  16           2HE      LYS  16  -1.207  12.190  10.550
  133    HE3  LYS  16           1HE      LYS  16  -2.021  10.713  10.035
  134    HZ1  LYS  16           3HZ      LYS  16  -1.523  10.342  12.252
  135    HZ2  LYS  16           1HZ      LYS  16   0.001  11.064  12.153
  136    HZ3  LYS  16           2HZ      LYS  16  -0.262   9.549  11.457
  137    H    TYR  17           H        TYR  17   0.542  10.659   4.614
  138    HA   TYR  17           HA       TYR  17  -1.433  11.591   2.692
  139    HB2  TYR  17           2HB      TYR  17  -0.163   8.853   2.805
  140    HB3  TYR  17           1HB      TYR  17  -0.934   9.632   1.405
  141    HD1  TYR  17           2HD      TYR  17   0.182  11.415   0.232
  142    HD2  TYR  17           1HD      TYR  17   2.106   9.439   3.454
  143    HE1  TYR  17           2HE      TYR  17   2.327  12.389  -0.467
  144    HE2  TYR  17           1HE      TYR  17   4.261  10.410   2.774
  145    HH   TYR  17           HH       TYR  17   5.250  11.306   0.526
  146    H    GLY  18           H        GLY  18  -1.559  10.500   5.680
  147    HA2  GLY  18           2HA      GLY  18  -3.121   9.563   7.018
  148    HA3  GLY  18           1HA      GLY  18  -4.250  10.154   5.835
  149    H    PHE  19           H        PHE  19  -1.925   7.489   5.768
  150    HA   PHE  19           HA       PHE  19  -4.008   5.558   6.055
  151    HB2  PHE  19           2HB      PHE  19  -4.080   4.554   3.946
  152    HB3  PHE  19           1HB      PHE  19  -4.204   6.254   3.638
  153    HD1  PHE  19           2HD      PHE  19  -2.050   7.477   2.926
  154    HD2  PHE  19           1HD      PHE  19  -2.470   3.246   2.953
  155    HE1  PHE  19           2HE      PHE  19  -0.131   7.274   1.391
  156    HE2  PHE  19           1HE      PHE  19  -0.561   3.038   1.421
  157    HZ   PHE  19           HZ       PHE  19   0.612   5.053   0.636
  158    H    THR  20           H        THR  20  -3.449   3.525   6.248
  159    HA   THR  20           HA       THR  20  -0.706   3.050   7.176
  160    HB   THR  20           HB       THR  20  -3.226   1.418   7.549
  161    HG1  THR  20           1HG      THR  20  -3.036   3.643   8.491
  162   HG21  THR  20          3HG2      THR  20  -0.676   1.272   9.152
  163   HG22  THR  20          1HG2      THR  20  -1.057   0.173   7.825
  164   HG23  THR  20          2HG2      THR  20  -2.084   0.209   9.259
  165    H    LEU  21           H        LEU  21   0.733   2.032   5.861
  166    HA   LEU  21           HA       LEU  21  -0.297   0.267   3.769
  167    HB2  LEU  21           2HB      LEU  21   1.671   2.096   3.537
  168    HB3  LEU  21           1HB      LEU  21   2.634   0.731   4.024
  169    HG   LEU  21           HG       LEU  21   2.434  -0.293   2.023
  170   HD11  LEU  21          1HD1      LEU  21   0.118  -0.860   2.226
  171   HD12  LEU  21          2HD1      LEU  21   0.396  -0.208   0.614
  172   HD13  LEU  21          3HD1      LEU  21  -0.368   0.792   1.850
  173   HD21  LEU  21          3HD2      LEU  21   2.379   1.241   0.196
  174   HD22  LEU  21          1HD2      LEU  21   3.129   2.053   1.569
  175   HD23  LEU  21          2HD2      LEU  21   1.457   2.412   1.139
  176    H    ARG  22           H        ARG  22  -0.926  -1.414   5.207
  177    HA   ARG  22           HA       ARG  22   0.824  -2.702   7.028
  178    HB2  ARG  22           2HB      ARG  22  -1.801  -2.791   6.661
  179    HB3  ARG  22           1HB      ARG  22  -1.398  -4.186   5.677
  180    HG2  ARG  22           2HG      ARG  22  -1.724  -5.228   7.655
  181    HG3  ARG  22           1HG      ARG  22  -0.016  -4.829   7.846
  182    HD2  ARG  22           2HD      ARG  22  -0.448  -3.105   9.323
  183    HD3  ARG  22           1HD      ARG  22  -2.102  -2.881   8.744
  184    HE   ARG  22           HE       ARG  22  -2.092  -5.386   9.832
  185   HH11  ARG  22          1HH1      ARG  22  -1.178  -2.225  11.041
  186   HH12  ARG  22          2HH1      ARG  22  -1.726  -2.565  12.654
  187   HH21  ARG  22          1HH2      ARG  22  -2.775  -5.830  11.961
  188   HH22  ARG  22          2HH2      ARG  22  -2.619  -4.602  13.180
  189    H    ALA  23           H        ALA  23   2.125  -4.492   6.795
  190    HA   ALA  23           HA       ALA  23   2.752  -5.281   4.034
  191    HB1  ALA  23           1HB      ALA  23   4.409  -5.638   6.531
  192    HB2  ALA  23           2HB      ALA  23   4.600  -4.336   5.353
  193    HB3  ALA  23           3HB      ALA  23   4.910  -6.005   4.878
  194    H    ILE  24           H        ILE  24   2.351  -7.288   3.322
  195    HA   ILE  24           HA       ILE  24   2.082  -9.459   5.274
  196    HB   ILE  24           HB       ILE  24   0.110 -10.308   3.838
  197   HG12  ILE  24          2HG1      ILE  24  -0.425  -7.387   3.415
  198   HG13  ILE  24          1HG1      ILE  24   0.497  -8.296   2.222
  199   HG21  ILE  24          1HG2      ILE  24  -1.493  -9.152   5.289
  200   HG22  ILE  24          2HG2      ILE  24  -0.240  -7.996   5.741
  201   HG23  ILE  24          3HG2      ILE  24  -0.072  -9.695   6.183
  202   HD11  ILE  24          3HD1      ILE  24  -1.368  -9.830   1.935
  203   HD12  ILE  24          1HD1      ILE  24  -1.858  -8.162   1.635
  204   HD13  ILE  24          2HD1      ILE  24  -2.286  -8.948   3.154
  205    H    ARG  25           H        ARG  25   1.955 -11.610   4.163
  206    HA   ARG  25           HA       ARG  25   3.348 -11.619   1.592
  207    HB2  ARG  25           2HB      ARG  25   4.693 -13.612   2.620
  208    HB3  ARG  25           1HB      ARG  25   5.207 -11.957   2.894
  209    HG2  ARG  25           2HG      ARG  25   3.537 -12.348   4.999
  210    HG3  ARG  25           1HG      ARG  25   4.209 -13.963   4.781
  211    HD2  ARG  25           2HD      ARG  25   5.537 -12.677   6.359
  212    HD3  ARG  25           1HD      ARG  25   6.467 -13.043   4.909
  213    HE   ARG  25           HE       ARG  25   6.708 -10.813   4.580
  214   HH11  ARG  25          1HH1      ARG  25   3.891 -11.269   6.636
  215   HH12  ARG  25          2HH1      ARG  25   3.597  -9.570   6.822
  216   HH21  ARG  25          1HH2      ARG  25   6.349  -8.576   4.880
  217   HH22  ARG  25          2HH2      ARG  25   5.002  -8.040   5.832
  218    H    VAL  26           H        VAL  26   2.093 -12.659   0.290
  219    HA   VAL  26           HA       VAL  26   0.222 -14.650   1.259
  220    HB   VAL  26           HB       VAL  26  -0.509 -14.727  -1.163
  221   HG11  VAL  26          1HG1      VAL  26  -1.223 -12.113  -0.915
  222   HG12  VAL  26          2HG1      VAL  26  -0.779 -12.507   0.747
  223   HG13  VAL  26          3HG1      VAL  26  -2.018 -13.448  -0.085
  224   HG21  VAL  26          3HG2      VAL  26   1.354 -13.946  -2.358
  225   HG22  VAL  26          1HG2      VAL  26   1.505 -12.512  -1.343
  226   HG23  VAL  26          2HG2      VAL  26   0.156 -12.657  -2.469
  227    H    TYR  27           H        TYR  27   0.789 -16.708   1.455
  228    HA   TYR  27           HA       TYR  27   3.063 -17.768   0.038
  229    HB2  TYR  27           2HB      TYR  27   1.144 -18.867   2.070
  230    HB3  TYR  27           1HB      TYR  27   2.199 -19.953   1.173
  231    HD1  TYR  27           2HD      TYR  27   2.322 -16.875   3.285
  232    HD2  TYR  27           1HD      TYR  27   4.326 -20.383   1.961
  233    HE1  TYR  27           2HE      TYR  27   4.147 -16.423   4.872
  234    HE2  TYR  27           1HE      TYR  27   6.156 -19.943   3.544
  235    HH   TYR  27           HH       TYR  27   7.136 -18.042   4.760
  236    H    MET  28           H        MET  28   2.817 -18.154  -2.059
  237    HA   MET  28           HA       MET  28   0.260 -18.901  -3.163
  238    HB2  MET  28           2HB      MET  28   2.637 -17.708  -4.144
  239    HB3  MET  28           1HB      MET  28   2.332 -19.138  -5.100
  240    HG2  MET  28           2HG      MET  28   1.360 -17.147  -6.063
  241    HG3  MET  28           1HG      MET  28   0.152 -18.335  -5.622
  242    HE1  MET  28           3HE      MET  28  -1.877 -15.114  -4.975
  243    HE2  MET  28           1HE      MET  28  -1.943 -16.766  -5.589
  244    HE3  MET  28           2HE      MET  28  -0.860 -15.590  -6.334
  245    H    GLY  29           H        GLY  29   2.542 -20.649  -1.615
  246    HA2  GLY  29           2HA      GLY  29   1.549 -23.109  -2.759
  247    HA3  GLY  29           1HA      GLY  29   3.261 -22.818  -3.032
  248    H    ASP  30           H        ASP  30   2.367 -25.015  -1.636
  249    HA   ASP  30           HA       ASP  30   2.556 -24.497   1.201
  250    HB2  ASP  30           2HB      ASP  30   1.125 -26.318   0.252
  251    HB3  ASP  30           1HB      ASP  30   2.588 -27.144  -0.270
  252    H    SER  31           H        SER  31   4.667 -23.373   0.579
  253    HA   SER  31           HA       SER  31   6.849 -24.957   1.513
  254    HB2  SER  31           2HB      SER  31   6.969 -23.912  -1.332
  255    HB3  SER  31           1HB      SER  31   8.315 -24.632  -0.458
  256    HG   SER  31           HG       SER  31   6.210 -26.289  -0.367
  257    H    ASP  32           H        ASP  32   8.914 -23.193   0.562
  258    HA   ASP  32           HA       ASP  32   8.409 -20.955   2.300
  259    HB2  ASP  32           2HB      ASP  32  10.697 -20.543   2.218
  260    HB3  ASP  32           1HB      ASP  32  10.623 -22.282   1.963
  261    H    VAL  33           H        VAL  33   7.301 -21.418  -0.643
  262    HA   VAL  33           HA       VAL  33   8.096 -18.964  -1.915
  263    HB   VAL  33           HB       VAL  33   7.710 -20.708  -3.434
  264   HG11  VAL  33          1HG1      VAL  33   5.010 -21.119  -2.158
  265   HG12  VAL  33          2HG1      VAL  33   6.397 -22.200  -2.047
  266   HG13  VAL  33          3HG1      VAL  33   5.593 -21.956  -3.596
  267   HG21  VAL  33          3HG2      VAL  33   5.294 -18.911  -3.489
  268   HG22  VAL  33          1HG2      VAL  33   5.874 -19.888  -4.840
  269   HG23  VAL  33          2HG2      VAL  33   6.869 -18.574  -4.209
  270    H    TYR  34           H        TYR  34   7.211 -17.093  -1.644
  271    HA   TYR  34           HA       TYR  34   4.395 -16.730  -1.191
  272    HB2  TYR  34           2HB      TYR  34   4.647 -15.457   0.922
  273    HB3  TYR  34           1HB      TYR  34   5.097 -17.147   1.118
  274    HD1  TYR  34           1HD      TYR  34   6.349 -13.692   0.996
  275    HD2  TYR  34           2HD      TYR  34   7.381 -17.777   1.583
  276    HE1  TYR  34           1HE      TYR  34   8.531 -13.006   1.896
  277    HE2  TYR  34           2HE      TYR  34   9.563 -17.101   2.487
  278    HH   TYR  34           HH       TYR  34  11.078 -14.779   2.056
  279    H    THR  35           H        THR  35   3.728 -14.550  -1.525
  280    HA   THR  35           HA       THR  35   5.868 -12.886  -2.702
  281    HB   THR  35           HB       THR  35   3.227 -12.008  -3.433
  282    HG1  THR  35           1HG      THR  35   3.750 -14.742  -3.574
  283   HG21  THR  35          3HG2      THR  35   5.284 -11.400  -4.602
  284   HG22  THR  35          1HG2      THR  35   4.146 -12.188  -5.694
  285   HG23  THR  35          2HG2      THR  35   5.527 -13.086  -5.064
  286    H    VAL  36           H        VAL  36   6.236 -10.956  -1.847
  287    HA   VAL  36           HA       VAL  36   4.740 -10.181   0.504
  288    HB   VAL  36           HB       VAL  36   7.151  -8.860  -0.757
  289   HG11  VAL  36          1HG1      VAL  36   7.359  -7.621   1.287
  290   HG12  VAL  36          2HG1      VAL  36   6.004  -8.491   2.006
  291   HG13  VAL  36          3HG1      VAL  36   5.726  -7.382   0.662
  292   HG21  VAL  36          3HG2      VAL  36   8.428  -9.937   1.024
  293   HG22  VAL  36          1HG2      VAL  36   7.619 -11.140   0.019
  294   HG23  VAL  36          2HG2      VAL  36   6.965 -10.729   1.605
  295    H    HIS  37           H        HIS  37   3.041  -8.957   0.400
  296    HA   HIS  37           HA       HIS  37   2.892  -6.858  -1.654
  297    HB2  HIS  37           2HB      HIS  37   0.699  -8.712  -0.705
  298    HB3  HIS  37           1HB      HIS  37   0.362  -7.201  -1.539
  299    HD2  HIS  37           2HD      HIS  37   1.302 -10.817  -2.280
  300    HE1  HIS  37           1HE      HIS  37   1.477  -8.671  -5.917
  301    HE2  HIS  37           2HE      HIS  37   1.285 -10.967  -4.868
  302    H    HIS  38           H        HIS  38   0.845  -5.413  -0.902
  303    HA   HIS  38           HA       HIS  38   0.913  -4.923   1.967
  304    HB2  HIS  38           2HB      HIS  38   1.705  -2.816  -0.067
  305    HB3  HIS  38           1HB      HIS  38   1.447  -2.523   1.648
  306    HD2  HIS  38           2HD      HIS  38   4.215  -3.441  -0.744
  307    HE1  HIS  38           1HE      HIS  38   5.629  -4.339   3.134
  308    HE2  HIS  38           2HE      HIS  38   6.190  -4.371   0.665
  309    H    MET  39           H        MET  39  -0.797  -3.489   2.644
  310    HA   MET  39           HA       MET  39  -2.812  -2.801   0.656
  311    HB2  MET  39           2HB      MET  39  -3.403  -4.665   2.972
  312    HB3  MET  39           1HB      MET  39  -4.618  -3.943   1.928
  313    HG2  MET  39           2HG      MET  39  -3.212  -5.127   0.046
  314    HG3  MET  39           1HG      MET  39  -2.705  -6.151   1.388
  315    HE1  MET  39           3HE      MET  39  -5.402  -6.064   3.205
  316    HE2  MET  39           1HE      MET  39  -4.411  -7.495   2.924
  317    HE3  MET  39           2HE      MET  39  -6.151  -7.561   2.650
  318    H    VAL  40           H        VAL  40  -4.235  -1.204   1.369
  319    HA   VAL  40           HA       VAL  40  -3.261   0.371   3.545
  320    HB   VAL  40           HB       VAL  40  -4.085   1.603   1.692
  321   HG11  VAL  40          1HG1      VAL  40  -5.573  -0.106   0.764
  322   HG12  VAL  40          2HG1      VAL  40  -6.353   1.473   0.859
  323   HG13  VAL  40          3HG1      VAL  40  -6.739   0.226   2.044
  324   HG21  VAL  40          3HG2      VAL  40  -4.647   2.313   4.110
  325   HG22  VAL  40          1HG2      VAL  40  -6.308   1.928   3.669
  326   HG23  VAL  40          2HG2      VAL  40  -5.424   3.164   2.772
  327    H    TRP  41           H        TRP  41  -3.522  -0.420   5.462
  328    HA   TRP  41           HA       TRP  41  -5.704  -2.035   6.306
  329    HB2  TRP  41           2HB      TRP  41  -3.235  -1.753   7.196
  330    HB3  TRP  41           1HB      TRP  41  -3.997  -0.576   8.251
  331    HD1  TRP  41           HD       TRP  41  -4.297  -1.670  10.509
  332    HE1  TRP  41           1HE      TRP  41  -5.190  -3.918  11.361
  333    HE3  TRP  41           3HE      TRP  41  -5.126  -3.967   6.018
  334    HZ2  TRP  41           2HZ      TRP  41  -6.140  -6.355  10.272
  335    HZ3  TRP  41           3HZ      TRP  41  -6.032  -6.254   6.013
  336    HH2  TRP  41           HH       TRP  41  -6.527  -7.420   8.098
  337    H    HIS  42           H        HIS  42  -4.824   1.311   6.725
  338    HA   HIS  42           HA       HIS  42  -7.588   1.986   7.308
  339    HB2  HIS  42           2HB      HIS  42  -6.051   1.419   9.440
  340    HB3  HIS  42           1HB      HIS  42  -5.647   3.111   9.238
  341    HD2  HIS  42           2HD      HIS  42  -7.925   4.874   9.378
  342    HE1  HIS  42           1HE      HIS  42 -10.206   2.042  11.540
  343    HE2  HIS  42           2HE      HIS  42 -10.145   4.407  10.640
  344    H    VAL  43           H        VAL  43  -8.063   3.871   6.403
  345    HA   VAL  43           HA       VAL  43  -5.864   5.753   5.925
  346    HB   VAL  43           HB       VAL  43  -6.348   4.782   3.806
  347   HG11  VAL  43          1HG1      VAL  43  -8.458   3.817   4.115
  348   HG12  VAL  43          2HG1      VAL  43  -8.625   4.990   2.811
  349   HG13  VAL  43          3HG1      VAL  43  -9.206   5.379   4.432
  350   HG21  VAL  43          3HG2      VAL  43  -5.927   7.167   3.762
  351   HG22  VAL  43          1HG2      VAL  43  -7.651   7.488   3.990
  352   HG23  VAL  43          2HG2      VAL  43  -7.094   6.718   2.505
  353    H    GLU  44           H        GLU  44  -6.131   7.676   6.626
  354    HA   GLU  44           HA       GLU  44  -8.304   8.385   8.291
  355    HB2  GLU  44           2HB      GLU  44  -5.708   9.454   7.561
  356    HB3  GLU  44           1HB      GLU  44  -6.913  10.716   7.750
  357    HG2  GLU  44           2HG      GLU  44  -7.475   9.681   9.978
  358    HG3  GLU  44           1HG      GLU  44  -6.042   8.673   9.769
  359    H    ASP  45           H        ASP  45 -10.211   8.957   7.627
  360    HA   ASP  45           HA       ASP  45 -10.687  10.084   5.018
  361    HB2  ASP  45           2HB      ASP  45 -13.084  10.026   5.739
  362    HB3  ASP  45           1HB      ASP  45 -12.275   8.467   5.856
  363    H    GLY  46           H        GLY  46  -9.068  11.754   6.568
  364    HA2  GLY  46           2HA      GLY  46 -10.883  13.946   7.324
  365    HA3  GLY  46           1HA      GLY  46  -9.241  13.755   7.912
  366    H    GLY  47           H        GLY  47  -8.827  13.030   4.788
  367    HA2  GLY  47           2HA      GLY  47  -9.215  15.211   3.226
  368    HA3  GLY  47           1HA      GLY  47  -7.869  15.699   4.231
  369    HA   PRO  48           HA       PRO  48  -4.814  13.504   1.877
  370    HB2  PRO  48           2HB      PRO  48  -4.725  11.167   3.714
  371    HB3  PRO  48           1HB      PRO  48  -3.407  12.168   3.096
  372    HG2  PRO  48           2HG      PRO  48  -4.209  12.506   5.563
  373    HG3  PRO  48           1HG      PRO  48  -3.956  13.945   4.546
  374    HD2  PRO  48           2HD      PRO  48  -6.525  12.548   5.233
  375    HD3  PRO  48           1HD      PRO  48  -6.135  14.276   5.275
  376    H    ALA  49           H        ALA  49  -4.536  10.404   2.224
  377    HA   ALA  49           HA       ALA  49  -5.228   9.591  -0.255
  378    HB1  ALA  49           1HB      ALA  49  -4.241   7.732   0.407
  379    HB2  ALA  49           2HB      ALA  49  -5.549   7.361   1.534
  380    HB3  ALA  49           3HB      ALA  49  -4.203   8.380   2.054
  381    H    SER  50           H        SER  50  -7.420   9.497   2.536
  382    HA   SER  50           HA       SER  50  -9.411   7.910   1.414
  383    HB2  SER  50           2HB      SER  50  -9.398  10.071   3.481
  384    HB3  SER  50           1HB      SER  50 -10.913   9.353   2.961
  385    HG   SER  50           HG       SER  50 -10.021   7.302   3.532
  386    H    GLU  51           H        GLU  51  -9.426  11.466   1.616
  387    HA   GLU  51           HA       GLU  51 -11.637  11.803  -0.098
  388    HB2  GLU  51           2HB      GLU  51  -9.464  13.709   0.746
  389    HB3  GLU  51           1HB      GLU  51 -10.881  14.185  -0.185
  390    HG2  GLU  51           2HG      GLU  51 -11.120  12.772   2.440
  391    HG3  GLU  51           1HG      GLU  51 -10.946  14.520   2.340
  392    H    ALA  52           H        ALA  52  -8.306  11.294  -0.689
  393    HA   ALA  52           HA       ALA  52  -8.150  12.380  -3.296
  394    HB1  ALA  52           1HB      ALA  52  -6.315  11.506  -1.594
  395    HB2  ALA  52           2HB      ALA  52  -6.023  11.553  -3.335
  396    HB3  ALA  52           3HB      ALA  52  -6.484  10.037  -2.558
  397    H    GLY  53           H        GLY  53  -9.426   9.435  -1.991
  398    HA2  GLY  53           2HA      GLY  53 -11.142   8.477  -3.580
  399    HA3  GLY  53           1HA      GLY  53  -9.803   8.380  -4.709
  400    H    LEU  54           H        LEU  54  -8.293   7.755  -1.954
  401    HA   LEU  54           HA       LEU  54  -8.141   4.958  -2.451
  402    HB2  LEU  54           2HB      LEU  54  -6.427   6.656  -1.352
  403    HB3  LEU  54           1HB      LEU  54  -7.156   6.064   0.120
  404    HG   LEU  54           HG       LEU  54  -5.756   4.403  -1.974
  405   HD11  LEU  54          1HD1      LEU  54  -4.167   5.635  -0.679
  406   HD12  LEU  54          2HD1      LEU  54  -4.175   3.968  -0.096
  407   HD13  LEU  54          3HD1      LEU  54  -5.003   5.227   0.818
  408   HD21  LEU  54          3HD2      LEU  54  -7.746   3.411  -0.701
  409   HD22  LEU  54          1HD2      LEU  54  -6.660   3.423   0.685
  410   HD23  LEU  54          2HD2      LEU  54  -6.232   2.507  -0.763
  411    H    ARG  55           H        ARG  55  -9.490   3.491  -1.864
  412    HA   ARG  55           HA       ARG  55 -11.267   3.983   0.400
  413    HB2  ARG  55           2HB      ARG  55 -12.478   1.945  -0.455
  414    HB3  ARG  55           1HB      ARG  55 -12.477   3.331  -1.534
  415    HG2  ARG  55           2HG      ARG  55 -11.803   1.952  -3.130
  416    HG3  ARG  55           1HG      ARG  55 -10.248   1.873  -2.302
  417    HD2  ARG  55           2HD      ARG  55 -11.133  -0.358  -2.756
  418    HD3  ARG  55           1HD      ARG  55 -11.010  -0.056  -1.023
  419    HE   ARG  55           HE       ARG  55 -13.575   0.652  -1.676
  420   HH11  ARG  55          1HH1      ARG  55 -11.645  -2.236  -2.062
  421   HH12  ARG  55          2HH1      ARG  55 -12.991  -3.317  -1.918
  422   HH21  ARG  55          1HH2      ARG  55 -15.359  -0.764  -1.479
  423   HH22  ARG  55          2HH2      ARG  55 -15.115  -2.479  -1.598
  424    H    GLN  56           H        GLN  56 -10.788   3.143   2.319
  425    HA   GLN  56           HA       GLN  56  -8.608   1.603   2.955
  426    HB2  GLN  56           2HB      GLN  56 -10.075   2.816   4.554
  427    HB3  GLN  56           1HB      GLN  56 -11.252   1.539   4.401
  428    HG2  GLN  56           2HG      GLN  56  -9.804   0.020   5.398
  429    HG3  GLN  56           1HG      GLN  56  -8.440   1.109   5.318
  430   HE21  GLN  56          1HE2      GLN  56  -9.776  -0.273   7.588
  431   HE22  GLN  56          2HE2      GLN  56 -10.146   0.985   8.712
  432    H    GLY  57           H        GLY  57  -8.137  -0.552   3.177
  433    HA2  GLY  57           2HA      GLY  57  -8.594  -2.858   3.254
  434    HA3  GLY  57           1HA      GLY  57 -10.210  -2.538   2.643
  435    H    ASP  58           H        ASP  58  -7.989  -0.844   0.801
  436    HA   ASP  58           HA       ASP  58  -8.261  -2.771  -1.370
  437    HB2  ASP  58           2HB      ASP  58  -8.492  -0.099  -1.388
  438    HB3  ASP  58           1HB      ASP  58  -6.784  -0.245  -1.799
  439    H    LEU  59           H        LEU  59  -6.479  -3.384  -2.689
  440    HA   LEU  59           HA       LEU  59  -4.034  -3.778  -1.112
  441    HB2  LEU  59           2HB      LEU  59  -4.779  -5.873  -1.774
  442    HB3  LEU  59           1HB      LEU  59  -5.350  -5.296  -3.326
  443    HG   LEU  59           HG       LEU  59  -2.762  -4.923  -3.761
  444   HD11  LEU  59          1HD1      LEU  59  -2.008  -5.546  -1.552
  445   HD12  LEU  59          2HD1      LEU  59  -1.441  -6.727  -2.735
  446   HD13  LEU  59          3HD1      LEU  59  -2.809  -7.111  -1.691
  447   HD21  LEU  59          3HD2      LEU  59  -2.673  -7.205  -4.717
  448   HD22  LEU  59          1HD2      LEU  59  -4.142  -6.322  -5.133
  449   HD23  LEU  59          2HD2      LEU  59  -4.185  -7.570  -3.890
  450    H    ILE  60           H        ILE  60  -2.120  -2.971  -1.764
  451    HA   ILE  60           HA       ILE  60  -2.186  -1.127  -4.021
  452    HB   ILE  60           HB       ILE  60  -0.125  -1.533  -1.847
  453   HG12  ILE  60          2HG1      ILE  60  -0.810   0.905  -1.390
  454   HG13  ILE  60          1HG1      ILE  60  -2.207   0.572  -2.404
  455   HG21  ILE  60          1HG2      ILE  60  -0.128   0.467  -4.109
  456   HG22  ILE  60          2HG2      ILE  60   0.977  -0.899  -3.932
  457   HG23  ILE  60          3HG2      ILE  60   1.020   0.424  -2.769
  458   HD11  ILE  60          3HD1      ILE  60  -1.506  -0.991   0.068
  459   HD12  ILE  60          1HD1      ILE  60  -2.982  -1.103  -0.893
  460   HD13  ILE  60          2HD1      ILE  60  -2.636   0.365   0.021
  461    H    THR  61           H        THR  61  -1.418  -1.666  -5.925
  462    HA   THR  61           HA       THR  61   0.241  -4.071  -6.146
  463    HB   THR  61           HB       THR  61  -0.422  -4.188  -8.446
  464    HG1  THR  61           1HG      THR  61  -0.417  -2.106  -9.176
  465   HG21  THR  61          3HG2      THR  61  -2.832  -3.324  -6.833
  466   HG22  THR  61          1HG2      THR  61  -2.098  -4.930  -6.788
  467   HG23  THR  61          2HG2      THR  61  -2.841  -4.345  -8.276
  468    H    HIS  62           H        HIS  62   0.105  -0.672  -7.026
  469    HA   HIS  62           HA       HIS  62   3.004  -0.683  -7.465
  470    HB2  HIS  62           2HB      HIS  62   0.928   0.480  -9.329
  471    HB3  HIS  62           1HB      HIS  62   2.626   0.916  -9.388
  472    HD2  HIS  62           2HD      HIS  62   4.169  -0.706 -10.888
  473    HE1  HIS  62           1HE      HIS  62   1.316  -3.784 -11.431
  474    HE2  HIS  62           2HE      HIS  62   3.520  -2.825 -12.230
  475    H    VAL  63           H        VAL  63   3.979   1.396  -7.222
  476    HA   VAL  63           HA       VAL  63   2.303   3.492  -6.075
  477    HB   VAL  63           HB       VAL  63   3.135   2.304  -4.143
  478   HG11  VAL  63          1HG1      VAL  63   5.079   1.223  -5.141
  479   HG12  VAL  63          2HG1      VAL  63   5.505   2.060  -3.648
  480   HG13  VAL  63          3HG1      VAL  63   5.914   2.776  -5.206
  481   HG21  VAL  63          3HG2      VAL  63   3.582   4.175  -2.987
  482   HG22  VAL  63          1HG2      VAL  63   3.332   4.981  -4.535
  483   HG23  VAL  63          2HG2      VAL  63   4.967   4.591  -3.997
  484    H    ASN  64           H        ASN  64   2.594   5.169  -7.353
  485    HA   ASN  64           HA       ASN  64   3.570   6.772  -8.656
  486    HB2  ASN  64           2HB      ASN  64   5.393   6.269  -6.511
  487    HB3  ASN  64           1HB      ASN  64   6.318   6.580  -7.974
  488   HD21  ASN  64          1HD2      ASN  64   7.080   8.556  -7.372
  489   HD22  ASN  64          2HD2      ASN  64   6.073   9.944  -7.152
  490    H    GLY  65           H        GLY  65   3.459   4.003  -9.599
  491    HA2  GLY  65           2HA      GLY  65   4.063   2.965 -11.578
  492    HA3  GLY  65           1HA      GLY  65   5.158   4.301 -11.889
  493    H    GLU  66           H        GLU  66   5.029   2.135  -9.143
  494    HA   GLU  66           HA       GLU  66   7.470   0.803  -9.892
  495    HB2  GLU  66           2HB      GLU  66   7.687   3.024  -8.458
  496    HB3  GLU  66           1HB      GLU  66   7.298   1.929  -7.145
  497    HG2  GLU  66           2HG      GLU  66   9.753   2.339  -7.595
  498    HG3  GLU  66           1HG      GLU  66   9.236   0.660  -7.459
  499    HA   PRO  67           HA       PRO  67   4.603  -2.363  -8.345
  500    HB2  PRO  67           2HB      PRO  67   6.677  -4.271  -8.596
  501    HB3  PRO  67           1HB      PRO  67   5.363  -3.977  -9.737
  502    HG2  PRO  67           2HG      PRO  67   8.171  -3.034  -9.797
  503    HG3  PRO  67           1HG      PRO  67   7.058  -3.356 -11.140
  504    HD2  PRO  67           2HD      PRO  67   7.685  -0.861 -10.357
  505    HD3  PRO  67           1HD      PRO  67   6.096  -1.257 -11.008
  506    H    VAL  68           H        VAL  68   4.299  -2.873  -6.371
  507    HA   VAL  68           HA       VAL  68   6.334  -2.330  -4.364
  508    HB   VAL  68           HB       VAL  68   4.573  -2.541  -2.708
  509   HG11  VAL  68          1HG1      VAL  68   3.023  -0.759  -3.518
  510   HG12  VAL  68          2HG1      VAL  68   3.777  -0.897  -5.107
  511   HG13  VAL  68          3HG1      VAL  68   4.733  -0.379  -3.717
  512   HG21  VAL  68          3HG2      VAL  68   3.341  -4.393  -3.696
  513   HG22  VAL  68          1HG2      VAL  68   2.779  -3.339  -4.995
  514   HG23  VAL  68          2HG2      VAL  68   2.264  -3.044  -3.336
  515    H    HIS  69           H        HIS  69   5.287  -4.731  -6.189
  516    HA   HIS  69           HA       HIS  69   5.098  -7.017  -4.708
  517    HB2  HIS  69           2HB      HIS  69   6.039  -6.375  -7.492
  518    HB3  HIS  69           1HB      HIS  69   5.831  -7.994  -6.915
  519    HD2  HIS  69           2HD      HIS  69   3.119  -5.584  -5.724
  520    HE1  HIS  69           1HE      HIS  69   1.564  -7.788  -8.991
  521    HE2  HIS  69           2HE      HIS  69   0.986  -6.378  -6.964
  522    H    GLY  70           H        GLY  70   6.593  -7.396  -3.123
  523    HA2  GLY  70           2HA      GLY  70   8.600  -8.636  -2.663
  524    HA3  GLY  70           1HA      GLY  70   9.351  -7.864  -4.051
  525    H    LEU  71           H        LEU  71   7.787  -5.394  -2.699
  526    HA   LEU  71           HA       LEU  71  10.182  -4.354  -1.470
  527    HB2  LEU  71           2HB      LEU  71   7.400  -3.205  -1.716
  528    HB3  LEU  71           1HB      LEU  71   8.755  -2.352  -1.012
  529    HG   LEU  71           HG       LEU  71   8.350  -3.126  -3.888
  530   HD11  LEU  71          1HD1      LEU  71   7.343  -1.021  -2.891
  531   HD12  LEU  71          2HD1      LEU  71   8.381  -0.801  -4.300
  532   HD13  LEU  71          3HD1      LEU  71   8.997  -0.445  -2.686
  533   HD21  LEU  71          3HD2      LEU  71  10.857  -2.092  -2.573
  534   HD22  LEU  71          1HD2      LEU  71  10.576  -2.148  -4.313
  535   HD23  LEU  71          2HD2      LEU  71  10.650  -3.645  -3.384
  536    H    VAL  72           H        VAL  72  10.561  -3.986   0.678
  537    HA   VAL  72           HA       VAL  72   8.958  -5.486   2.546
  538    HB   VAL  72           HB       VAL  72  11.542  -5.082   2.593
  539   HG11  VAL  72          1HG1      VAL  72  10.843  -2.820   4.418
  540   HG12  VAL  72          2HG1      VAL  72  11.086  -2.532   2.697
  541   HG13  VAL  72          3HG1      VAL  72  12.389  -3.221   3.665
  542   HG21  VAL  72          3HG2      VAL  72  11.618  -5.735   4.824
  543   HG22  VAL  72          1HG2      VAL  72  10.017  -6.255   4.298
  544   HG23  VAL  72          2HG2      VAL  72  10.200  -4.783   5.252
  545    H    HIS  73           H        HIS  73   8.328  -4.316   4.668
  546    HA   HIS  73           HA       HIS  73   6.246  -2.593   4.265
  547    HB2  HIS  73           2HB      HIS  73   6.957  -3.820   6.416
  548    HB3  HIS  73           1HB      HIS  73   7.945  -2.413   6.740
  549    HD1  HIS  73           1HD      HIS  73   4.478  -3.618   6.978
  550    HD2  HIS  73           2HD      HIS  73   6.483   0.009   7.084
  551    HE1  HIS  73           1HE      HIS  73   2.848  -1.944   7.915
  552    H    THR  74           H        THR  74   9.482  -1.682   5.322
  553    HA   THR  74           HA       THR  74   8.923   1.089   5.384
  554    HB   THR  74           HB       THR  74  11.210   1.350   5.966
  555    HG1  THR  74           1HG      THR  74  12.563  -0.700   5.699
  556   HG21  THR  74          3HG2      THR  74  10.133   0.335   7.781
  557   HG22  THR  74          1HG2      THR  74  11.546  -0.692   7.531
  558   HG23  THR  74          2HG2      THR  74   9.961  -1.213   6.940
  559    H    GLU  75           H        GLU  75   9.861  -1.050   2.833
  560    HA   GLU  75           HA       GLU  75  11.135   0.879   1.200
  561    HB2  GLU  75           2HB      GLU  75  10.078  -1.867   0.784
  562    HB3  GLU  75           1HB      GLU  75  10.425  -0.869  -0.620
  563    HG2  GLU  75           2HG      GLU  75  12.715  -0.514   0.284
  564    HG3  GLU  75           1HG      GLU  75  12.343  -1.691   1.540
  565    H    VAL  76           H        VAL  76   7.773  -0.321   1.346
  566    HA   VAL  76           HA       VAL  76   6.923   1.235  -0.869
  567    HB   VAL  76           HB       VAL  76   4.610   0.978   0.065
  568   HG11  VAL  76          1HG1      VAL  76   6.251  -1.507  -0.294
  569   HG12  VAL  76          2HG1      VAL  76   5.514  -0.542  -1.573
  570   HG13  VAL  76          3HG1      VAL  76   4.494  -1.411  -0.426
  571   HG21  VAL  76          3HG2      VAL  76   6.080   0.052   2.383
  572   HG22  VAL  76          1HG2      VAL  76   4.853  -1.098   1.849
  573   HG23  VAL  76          2HG2      VAL  76   4.388   0.565   2.246
  574    H    VAL  77           H        VAL  77   6.852   1.762   2.614
  575    HA   VAL  77           HA       VAL  77   5.665   4.259   2.701
  576    HB   VAL  77           HB       VAL  77   7.890   3.279   4.461
  577   HG11  VAL  77          1HG1      VAL  77   7.424   5.688   4.677
  578   HG12  VAL  77          2HG1      VAL  77   7.027   4.785   6.138
  579   HG13  VAL  77          3HG1      VAL  77   5.744   5.302   5.046
  580   HG21  VAL  77          3HG2      VAL  77   6.285   1.613   4.626
  581   HG22  VAL  77          1HG2      VAL  77   4.944   2.752   4.475
  582   HG23  VAL  77          2HG2      VAL  77   5.889   2.690   5.965
  583    H    GLU  78           H        GLU  78   9.110   3.438   2.360
  584    HA   GLU  78           HA       GLU  78  10.060   6.067   2.135
  585    HB2  GLU  78           2HB      GLU  78  11.131   3.402   1.268
  586    HB3  GLU  78           1HB      GLU  78  11.968   4.884   0.833
  587    HG2  GLU  78           2HG      GLU  78  11.962   5.471   3.269
  588    HG3  GLU  78           1HG      GLU  78  11.400   3.833   3.576
  589    H    LEU  79           H        LEU  79   9.027   3.736  -0.308
  590    HA   LEU  79           HA       LEU  79   9.604   5.150  -2.620
  591    HB2  LEU  79           2HB      LEU  79   8.143   2.860  -1.952
  592    HB3  LEU  79           1HB      LEU  79   6.988   3.892  -2.771
  593    HG   LEU  79           HG       LEU  79   7.954   2.412  -4.388
  594   HD11  LEU  79          1HD1      LEU  79   7.554   4.727  -5.108
  595   HD12  LEU  79          2HD1      LEU  79   8.878   3.964  -5.987
  596   HD13  LEU  79          3HD1      LEU  79   9.224   5.126  -4.707
  597   HD21  LEU  79          3HD2      LEU  79   9.975   1.822  -3.171
  598   HD22  LEU  79          1HD2      LEU  79  10.636   3.430  -3.463
  599   HD23  LEU  79          2HD2      LEU  79  10.358   2.332  -4.815
  600    H    ILE  80           H        ILE  80   6.836   5.408  -0.460
  601    HA   ILE  80           HA       ILE  80   5.395   7.299  -1.975
  602    HB   ILE  80           HB       ILE  80   5.298   6.443   0.906
  603   HG12  ILE  80          2HG1      ILE  80   3.116   6.180  -1.124
  604   HG13  ILE  80          1HG1      ILE  80   4.490   5.082  -1.188
  605   HG21  ILE  80          1HG2      ILE  80   4.563   8.641   1.077
  606   HG22  ILE  80          2HG2      ILE  80   3.078   7.707   0.893
  607   HG23  ILE  80          3HG2      ILE  80   3.747   8.586  -0.482
  608   HD11  ILE  80          3HD1      ILE  80   2.586   4.161   0.046
  609   HD12  ILE  80          1HD1      ILE  80   2.709   5.489   1.199
  610   HD13  ILE  80          2HD1      ILE  80   4.026   4.324   1.053
  611    H    LEU  81           H        LEU  81   7.461   7.641   0.918
  612    HA   LEU  81           HA       LEU  81   7.341  10.435   1.121
  613    HB2  LEU  81           2HB      LEU  81   9.608   8.598   1.902
  614    HB3  LEU  81           1HB      LEU  81   9.396  10.247   2.458
  615    HG   LEU  81           HG       LEU  81   7.424   8.034   3.011
  616   HD11  LEU  81          1HD1      LEU  81   9.577   7.535   4.049
  617   HD12  LEU  81          2HD1      LEU  81   8.362   7.962   5.253
  618   HD13  LEU  81          3HD1      LEU  81   9.592   9.136   4.788
  619   HD21  LEU  81          3HD2      LEU  81   7.752  10.827   4.094
  620   HD22  LEU  81          1HD2      LEU  81   6.664   9.615   4.769
  621   HD23  LEU  81          2HD2      LEU  81   6.413  10.208   3.128
  622    H    LYS  82           H        LYS  82   9.396   8.320  -0.742
  623    HA   LYS  82           HA       LYS  82  11.358  10.045  -1.656
  624    HB2  LYS  82           2HB      LYS  82  11.129   7.546  -1.936
  625    HB3  LYS  82           1HB      LYS  82  10.095   7.927  -3.284
  626    HG2  LYS  82           2HG      LYS  82  12.026   9.277  -4.218
  627    HG3  LYS  82           1HG      LYS  82  13.018   8.460  -3.003
  628    HD2  LYS  82           2HD      LYS  82  11.292   7.032  -5.018
  629    HD3  LYS  82           1HD      LYS  82  13.012   7.361  -5.253
  630    HE2  LYS  82           2HE      LYS  82  13.498   6.092  -3.187
  631    HE3  LYS  82           1HE      LYS  82  11.783   5.719  -3.039
  632    HZ1  LYS  82           3HZ      LYS  82  13.637   4.839  -5.174
  633    HZ2  LYS  82           1HZ      LYS  82  11.959   4.651  -5.271
  634    HZ3  LYS  82           2HZ      LYS  82  12.831   3.873  -4.047
  635    H    SER  83           H        SER  83   8.156   9.415  -2.898
  636    HA   SER  83           HA       SER  83   8.281  10.799  -5.294
  637    HB2  SER  83           2HB      SER  83   6.407   9.350  -4.620
  638    HB3  SER  83           1HB      SER  83   5.911  10.552  -3.430
  639    HG   SER  83           HG       SER  83   4.928  11.579  -4.952
  640    H    GLY  84           H        GLY  84   7.443  12.066  -2.056
  641    HA2  GLY  84           2HA      GLY  84   8.551  14.372  -1.835
  642    HA3  GLY  84           1HA      GLY  84   7.546  14.778  -3.207
  643    H    ASN  85           H        ASN  85   5.742  15.762  -2.759
  644    HA   ASN  85           HA       ASN  85   4.693  15.637  -0.016
  645    HB2  ASN  85           2HB      ASN  85   3.444  17.712  -0.686
  646    HB3  ASN  85           1HB      ASN  85   5.193  17.882  -0.659
  647   HD21  ASN  85          1HD2      ASN  85   6.312  18.061  -2.606
  648   HD22  ASN  85          2HD2      ASN  85   5.517  18.510  -4.075
  649    H    LYS  86           H        LYS  86   4.267  14.023  -2.655
  650    HA   LYS  86           HA       LYS  86   1.558  13.301  -2.066
  651    HB2  LYS  86           2HB      LYS  86   0.848  13.607  -4.441
  652    HB3  LYS  86           1HB      LYS  86   0.981  15.079  -3.524
  653    HG2  LYS  86           2HG      LYS  86   2.792  15.816  -4.730
  654    HG3  LYS  86           1HG      LYS  86   3.301  14.183  -5.154
  655    HD2  LYS  86           2HD      LYS  86   1.295  14.015  -6.623
  656    HD3  LYS  86           1HD      LYS  86   0.969  15.716  -6.293
  657    HE2  LYS  86           2HE      LYS  86   2.166  15.372  -8.423
  658    HE3  LYS  86           1HE      LYS  86   3.079  16.354  -7.279
  659    HZ1  LYS  86           3HZ      LYS  86   4.397  14.411  -6.712
  660    HZ2  LYS  86           1HZ      LYS  86   4.480  14.711  -8.374
  661    HZ3  LYS  86           2HZ      LYS  86   3.510  13.458  -7.790
  662    H    VAL  87           H        VAL  87   0.859  11.605  -3.754
  663    HA   VAL  87           HA       VAL  87   2.936  10.207  -5.137
  664    HB   VAL  87           HB       VAL  87   3.554   9.674  -2.801
  665   HG11  VAL  87          1HG1      VAL  87   1.420   9.608  -1.727
  666   HG12  VAL  87          2HG1      VAL  87   2.157   8.013  -1.582
  667   HG13  VAL  87          3HG1      VAL  87   0.881   8.292  -2.767
  668   HG21  VAL  87          3HG2      VAL  87   4.326   8.160  -4.431
  669   HG22  VAL  87          1HG2      VAL  87   2.731   7.434  -4.625
  670   HG23  VAL  87          2HG2      VAL  87   3.646   7.168  -3.141
  671    H    ALA  88           H        ALA  88   2.249   8.578  -6.419
  672    HA   ALA  88           HA       ALA  88  -0.633   8.311  -6.799
  673    HB1  ALA  88           1HB      ALA  88   1.670   7.343  -8.473
  674    HB2  ALA  88           2HB      ALA  88   0.744   8.819  -8.736
  675    HB3  ALA  88           3HB      ALA  88  -0.031   7.243  -8.914
  676    H    ILE  89           H        ILE  89  -1.368   6.886  -5.256
  677    HA   ILE  89           HA       ILE  89   0.010   4.343  -4.937
  678    HB   ILE  89           HB       ILE  89  -0.743   5.367  -2.889
  679   HG12  ILE  89          2HG1      ILE  89  -2.649   3.088  -3.319
  680   HG13  ILE  89          1HG1      ILE  89  -0.908   2.828  -3.308
  681   HG21  ILE  89          1HG2      ILE  89  -2.614   6.672  -3.772
  682   HG22  ILE  89          2HG2      ILE  89  -3.082   5.734  -2.357
  683   HG23  ILE  89          3HG2      ILE  89  -3.552   5.191  -3.966
  684   HD11  ILE  89          3HD1      ILE  89  -2.169   2.473  -1.131
  685   HD12  ILE  89          1HD1      ILE  89  -2.313   4.228  -1.065
  686   HD13  ILE  89          2HD1      ILE  89  -0.718   3.472  -1.068
  687    H    SER  90           H        SER  90  -0.372   2.782  -6.356
  688    HA   SER  90           HA       SER  90  -2.880   2.730  -7.831
  689    HB2  SER  90           2HB      SER  90  -0.275   2.174  -8.501
  690    HB3  SER  90           1HB      SER  90  -0.954   0.562  -8.302
  691    HG   SER  90           HG       SER  90  -2.601   2.233  -9.701
  692    H    THR  91           H        THR  91  -4.544   1.856  -6.748
  693    HA   THR  91           HA       THR  91  -4.089  -0.581  -5.180
  694    HB   THR  91           HB       THR  91  -6.351  -0.139  -4.236
  695    HG1  THR  91           1HG      THR  91  -7.574   1.226  -5.278
  696   HG21  THR  91          3HG2      THR  91  -4.474   2.218  -4.050
  697   HG22  THR  91          1HG2      THR  91  -4.333   0.723  -3.122
  698   HG23  THR  91          2HG2      THR  91  -5.724   1.782  -2.883
  699    H    THR  92           H        THR  92  -6.125  -2.110  -5.251
  700    HA   THR  92           HA       THR  92  -6.599  -2.594  -8.118
  701    HB   THR  92           HB       THR  92  -5.360  -4.391  -7.168
  702    HG1  THR  92           1HG      THR  92  -8.111  -5.070  -7.485
  703   HG21  THR  92          3HG2      THR  92  -7.517  -4.631  -5.072
  704   HG22  THR  92          1HG2      THR  92  -5.881  -4.026  -4.813
  705   HG23  THR  92          2HG2      THR  92  -6.136  -5.710  -5.267
  706    HA   PRO  93           HA       PRO  93 -10.823  -1.228  -7.055
  707    HB2  PRO  93           2HB      PRO  93 -11.041  -1.981  -9.930
  708    HB3  PRO  93           1HB      PRO  93 -11.669  -0.560  -9.084
  709    HG2  PRO  93           2HG      PRO  93  -9.492  -0.393 -10.617
  710    HG3  PRO  93           1HG      PRO  93  -9.610   0.515  -9.107
  711    HD2  PRO  93           2HD      PRO  93  -8.020  -1.888  -9.735
  712    HD3  PRO  93           1HD      PRO  93  -7.678  -0.578  -8.600
  713    H    LEU  94           H        LEU  94 -12.931  -2.232  -7.360
  714    HA   LEU  94           HA       LEU  94 -12.965  -4.934  -6.594
  715    HB2  LEU  94           2HB      LEU  94 -15.512  -4.252  -7.599
  716    HB3  LEU  94           1HB      LEU  94 -15.002  -4.316  -5.937
  717    HG   LEU  94           HG       LEU  94 -14.179  -1.907  -6.281
  718   HD11  LEU  94          1HD1      LEU  94 -14.242  -1.503  -8.531
  719   HD12  LEU  94          2HD1      LEU  94 -15.801  -0.837  -8.031
  720   HD13  LEU  94          3HD1      LEU  94 -15.719  -2.442  -8.758
  721   HD21  LEU  94          3HD2      LEU  94 -16.076  -2.474  -4.889
  722   HD22  LEU  94          1HD2      LEU  94 -17.119  -2.561  -6.308
  723   HD23  LEU  94          2HD2      LEU  94 -16.416  -1.018  -5.824
  724    H    GLU  95           H        GLU  95 -14.060  -6.708  -7.701
  725    HA   GLU  95           HA       GLU  95 -14.458  -6.572 -10.534
  726    HB2  GLU  95           2HB      GLU  95 -12.696  -7.958 -11.269
  727    HB3  GLU  95           1HB      GLU  95 -11.935  -6.778 -10.215
  728    HG2  GLU  95           2HG      GLU  95 -12.723  -9.536  -9.324
  729    HG3  GLU  95           1HG      GLU  95 -11.136  -9.129  -9.958
  730    H    ASN  96           H        ASN  96 -15.006  -8.780 -11.404
  731    HA   ASN  96           HA       ASN  96 -16.883 -10.032  -9.628
  732    HB2  ASN  96           2HB      ASN  96 -17.431 -11.440 -11.615
  733    HB3  ASN  96           1HB      ASN  96 -17.525  -9.713 -11.936
  734   HD21  ASN  96          1HD2      ASN  96 -16.155  -8.789 -13.385
  735   HD22  ASN  96          2HD2      ASN  96 -15.066  -9.697 -14.380
  736    H1   SER 101           1HT      SER 101  -4.256 -17.666   1.338
  737    H2   SER 101           2HT      SER 101  -2.574 -17.770   1.221
  738    H3   SER 101           3HT      SER 101  -3.519 -17.746  -0.179
  739    HA   SER 101           HA       SER 101  -2.410 -15.621   0.283
  740    HB2  SER 101           2HB      SER 101  -5.308 -15.057   0.581
  741    HB3  SER 101           1HB      SER 101  -4.170 -14.488  -0.641
  742    HG   SER 101           HG       SER 101  -4.849 -16.026  -1.897
  743    H    TRP 102           H        TRP 102  -2.192 -13.814   1.605
  744    HA   TRP 102           HA       TRP 102  -2.149 -12.553   3.479
  745    HB2  TRP 102           2HB      TRP 102  -4.575 -12.646   3.492
  746    HB3  TRP 102           1HB      TRP 102  -4.545 -14.209   4.299
  747    HD1  TRP 102           HD       TRP 102  -4.194 -14.227   6.909
  748    HE1  TRP 102           1HE      TRP 102  -4.170 -12.381   8.701
  749    HE3  TRP 102           3HE      TRP 102  -3.892 -10.147   3.853
  750    HZ2  TRP 102           2HZ      TRP 102  -4.048  -9.569   8.799
  751    HZ3  TRP 102           3HZ      TRP 102  -3.828  -7.917   4.880
  752    HH2  TRP 102           HH       TRP 102  -3.907  -7.632   7.298
  753    H    GLU 103           H        GLU 103  -1.269 -12.570   5.578
  754    HA   GLU 103           HA       GLU 103  -0.799 -15.035   6.967
  755    HB2  GLU 103           2HB      GLU 103   1.072 -14.355   4.998
  756    HB3  GLU 103           1HB      GLU 103   1.806 -13.832   6.507
  757    HG2  GLU 103           2HG      GLU 103   0.673 -16.586   6.129
  758    HG3  GLU 103           1HG      GLU 103   2.337 -16.175   5.731
  759    H    SER 104           H        SER 104   0.743 -14.572   8.863
  760    HA   SER 104           HA       SER 104  -0.291 -12.349  10.300
  761    HB2  SER 104           2HB      SER 104   1.541 -13.131  11.979
  762    HB3  SER 104           1HB      SER 104   0.192 -14.210  11.635
  763    HG   SER 104           HG       SER 104   1.513 -15.353  10.202
  764    H    HIS 105           H        HIS 105   1.237 -10.854  11.522
  765    HA   HIS 105           HA       HIS 105   2.715  -9.366   9.589
  766    HB2  HIS 105           2HB      HIS 105   1.501  -8.779  12.014
  767    HB3  HIS 105           1HB      HIS 105   3.221  -8.616  12.358
  768    HD2  HIS 105           2HD      HIS 105   4.560  -6.808  10.509
  769    HE1  HIS 105           1HE      HIS 105   0.966  -4.683   9.841
  770    HE2  HIS 105           2HE      HIS 105   3.497  -4.546   9.819
  771    H    LYS 106           H        LYS 106   4.736  -9.632   9.027
  772    HA   LYS 106           HA       LYS 106   6.563 -11.055  10.843
  773    HB2  LYS 106           2HB      LYS 106   5.862 -11.505   8.073
  774    HB3  LYS 106           1HB      LYS 106   7.585 -11.197   8.225
  775    HG2  LYS 106           2HG      LYS 106   7.364 -13.515   8.392
  776    HG3  LYS 106           1HG      LYS 106   7.584 -12.961  10.050
  777    HD2  LYS 106           2HD      LYS 106   5.176 -13.089  10.420
  778    HD3  LYS 106           1HD      LYS 106   4.940 -13.610   8.751
  779    HE2  LYS 106           2HE      LYS 106   6.366 -15.584   9.215
  780    HE3  LYS 106           1HE      LYS 106   6.454 -15.089  10.902
  781    HZ1  LYS 106           3HZ      LYS 106   4.025 -15.906   9.401
  782    HZ2  LYS 106           1HZ      LYS 106   3.995 -15.255  10.968
  783    HZ3  LYS 106           2HZ      LYS 106   4.767 -16.732  10.680
  784    H    SER 107           H        SER 107   8.836 -10.518   9.142
  785    HA   SER 107           HA       SER 107   9.903  -8.252  10.244
  786    HB2  SER 107           2HB      SER 107  10.657  -9.148   7.469
  787    HB3  SER 107           1HB      SER 107  11.702  -8.546   8.759
  788    HG   SER 107           HG       SER 107  11.282 -11.028   8.197
  789    H    GLY 108           H        GLY 108   9.850  -6.126   9.880
  790    HA2  GLY 108           2HA      GLY 108   9.735  -4.455   7.949
  791    HA3  GLY 108           1HA      GLY 108   8.160  -5.181   7.661
  792    H    GLY 109           H        GLY 109   7.328  -5.528  10.300
  793    HA2  GLY 109           2HA      GLY 109   6.545  -4.407  12.167
  794    HA3  GLY 109           1HA      GLY 109   7.532  -3.026  11.712
  795    H    GLU 110           H        GLU 110   5.872  -1.577  12.141
  796    HA   GLU 110           HA       GLU 110   3.847  -1.390  10.027
  797    HB2  GLU 110           2HB      GLU 110   3.350  -1.892  12.867
  798    HB3  GLU 110           1HB      GLU 110   2.516  -0.463  12.271
  799    HG2  GLU 110           2HG      GLU 110   2.364  -3.105  10.865
  800    HG3  GLU 110           1HG      GLU 110   1.270  -2.663  12.175
  801    H    THR 111           H        THR 111   4.349   0.473   9.094
  802    HA   THR 111           HA       THR 111   4.775   2.844  10.781
  803    HB   THR 111           HB       THR 111   6.296   2.313   8.219
  804    HG1  THR 111           1HG      THR 111   6.701   1.275  10.631
  805   HG21  THR 111          3HG2      THR 111   7.659   4.208   8.927
  806   HG22  THR 111          1HG2      THR 111   6.675   4.390  10.379
  807   HG23  THR 111          2HG2      THR 111   5.966   4.685   8.791
  808    H    ARG 112           H        ARG 112   2.651   3.445  10.439
  809    HA   ARG 112           HA       ARG 112   1.605   3.701   7.767
  810    HB2  ARG 112           2HB      ARG 112  -0.417   3.799   8.764
  811    HB3  ARG 112           1HB      ARG 112   0.451   3.210  10.164
  812    HG2  ARG 112           2HG      ARG 112  -0.478   4.942  11.218
  813    HG3  ARG 112           1HG      ARG 112   0.753   5.913  10.407
  814    HD2  ARG 112           2HD      ARG 112  -0.720   6.755   8.879
  815    HD3  ARG 112           1HD      ARG 112  -1.748   5.323   8.918
  816    HE   ARG 112           HE       ARG 112  -2.265   6.270  11.305
  817   HH11  ARG 112          1HH1      ARG 112  -1.834   8.087   8.329
  818   HH12  ARG 112          2HH1      ARG 112  -2.973   9.323   8.800
  819   HH21  ARG 112          1HH2      ARG 112  -3.743   7.899  11.899
  820   HH22  ARG 112          2HH2      ARG 112  -4.030   9.236  10.817
  821    H    LEU 113           H        LEU 113   0.971   5.654   6.772
  822    HA   LEU 113           HA       LEU 113   2.077   8.098   7.937
  823    HB2  LEU 113           2HB      LEU 113   2.631   8.666   5.410
  824    HB3  LEU 113           1HB      LEU 113   3.785   7.875   6.460
  825    HG   LEU 113           HG       LEU 113   3.226   5.702   5.451
  826   HD11  LEU 113          1HD1      LEU 113   0.889   6.172   4.864
  827   HD12  LEU 113          2HD1      LEU 113   1.809   5.552   3.495
  828   HD13  LEU 113          3HD1      LEU 113   1.439   7.273   3.603
  829   HD21  LEU 113          3HD2      LEU 113   3.837   7.765   3.347
  830   HD22  LEU 113          1HD2      LEU 113   4.305   6.063   3.350
  831   HD23  LEU 113          2HD2      LEU 113   5.005   7.172   4.529
  Start of MODEL    5
    1    H1   GLY   1           1HT      GLY   1 -11.034 -10.791 -13.256
    2    H2   GLY   1           2HT      GLY   1 -10.148 -11.803 -12.234
    3    H3   GLY   1           3HT      GLY   1  -9.411 -11.120 -13.592
    4    HA2  GLY   1           1HA      GLY   1 -10.331  -9.725 -11.153
    5    HA3  GLY   1           2HA      GLY   1  -8.674  -9.916 -11.701
    6    H    GLY   2           H        GLY   2  -7.928  -8.685 -13.450
    7    HA2  GLY   2           2HA      GLY   2  -9.228  -7.086 -15.194
    8    HA3  GLY   2           1HA      GLY   2  -9.248  -6.138 -13.714
    9    H    SER   3           H        SER   3  -8.007  -4.752 -15.356
   10    HA   SER   3           HA       SER   3  -5.187  -5.050 -14.718
   11    HB2  SER   3           2HB      SER   3  -6.172  -4.825 -17.577
   12    HB3  SER   3           1HB      SER   3  -4.486  -4.721 -17.072
   13    HG   SER   3           HG       SER   3  -5.790  -6.949 -16.129
   14    H    MET   4           H        MET   4  -3.957  -3.068 -15.533
   15    HA   MET   4           HA       MET   4  -3.611  -0.838 -15.444
   16    HB2  MET   4           2HB      MET   4  -6.092  -1.124 -16.981
   17    HB3  MET   4           1HB      MET   4  -5.900   0.452 -16.225
   18    HG2  MET   4           2HG      MET   4  -3.693   0.665 -17.285
   19    HG3  MET   4           1HG      MET   4  -3.944  -0.888 -18.079
   20    HE1  MET   4           3HE      MET   4  -5.421   2.695 -17.588
   21    HE2  MET   4           1HE      MET   4  -6.887   1.717 -17.539
   22    HE3  MET   4           2HE      MET   4  -6.598   2.803 -18.898
   23    H    ARG   5           H        ARG   5  -3.545  -1.076 -13.117
   24    HA   ARG   5           HA       ARG   5  -5.845  -0.438 -11.539
   25    HB2  ARG   5           2HB      ARG   5  -2.903  -0.571 -10.863
   26    HB3  ARG   5           1HB      ARG   5  -4.153  -0.219  -9.678
   27    HG2  ARG   5           2HG      ARG   5  -3.871  -2.470  -9.364
   28    HG3  ARG   5           1HG      ARG   5  -5.191  -2.458 -10.535
   29    HD2  ARG   5           2HD      ARG   5  -3.601  -2.820 -12.345
   30    HD3  ARG   5           1HD      ARG   5  -2.268  -2.797 -11.193
   31    HE   ARG   5           HE       ARG   5  -4.016  -4.776 -10.349
   32   HH11  ARG   5          1HH1      ARG   5  -2.046  -4.096 -13.160
   33   HH12  ARG   5          2HH1      ARG   5  -1.782  -5.769 -13.539
   34   HH21  ARG   5          1HH2      ARG   5  -3.659  -6.990 -10.839
   35   HH22  ARG   5          2HH2      ARG   5  -2.695  -7.412 -12.223
   36    HA   PRO   6           HA       PRO   6  -5.312   3.979 -12.001
   37    HB2  PRO   6           2HB      PRO   6  -7.455   4.492 -10.195
   38    HB3  PRO   6           1HB      PRO   6  -7.537   4.395 -11.956
   39    HG2  PRO   6           2HG      PRO   6  -8.736   2.592 -10.230
   40    HG3  PRO   6           1HG      PRO   6  -8.333   2.255 -11.915
   41    HD2  PRO   6           2HD      PRO   6  -6.823   1.592  -9.418
   42    HD3  PRO   6           1HD      PRO   6  -7.174   0.583 -10.835
   43    HA   PRO   7           HA       PRO   7  -2.973   4.667  -8.145
   44    HB2  PRO   7           2HB      PRO   7  -1.807   6.870  -9.652
   45    HB3  PRO   7           1HB      PRO   7  -1.014   5.504  -8.873
   46    HG2  PRO   7           2HG      PRO   7  -1.179   5.722 -11.548
   47    HG3  PRO   7           1HG      PRO   7  -1.250   4.150 -10.732
   48    HD2  PRO   7           2HD      PRO   7  -3.493   5.806 -11.850
   49    HD3  PRO   7           1HD      PRO   7  -3.247   4.047 -11.923
   50    H    ILE   8           H        ILE   8  -3.906   5.705  -6.588
   51    HA   ILE   8           HA       ILE   8  -5.393   8.135  -7.050
   52    HB   ILE   8           HB       ILE   8  -4.913   6.960  -4.344
   53   HG12  ILE   8          2HG1      ILE   8  -7.184   5.922  -5.877
   54   HG13  ILE   8          1HG1      ILE   8  -5.640   5.355  -6.400
   55   HG21  ILE   8          1HG2      ILE   8  -7.438   7.929  -5.586
   56   HG22  ILE   8          2HG2      ILE   8  -6.266   9.056  -4.903
   57   HG23  ILE   8          3HG2      ILE   8  -7.027   7.837  -3.876
   58   HD11  ILE   8          3HD1      ILE   8  -6.812   3.903  -4.740
   59   HD12  ILE   8          1HD1      ILE   8  -6.551   5.189  -3.565
   60   HD13  ILE   8          2HD1      ILE   8  -5.170   4.377  -4.301
   61    H    ILE   9           H        ILE   9  -4.280   9.966  -7.113
   62    HA   ILE   9           HA       ILE   9  -1.664  10.190  -5.965
   63    HB   ILE   9           HB       ILE   9  -3.213  12.558  -6.939
   64   HG12  ILE   9          2HG1      ILE   9  -3.519  10.652  -8.576
   65   HG13  ILE   9          1HG1      ILE   9  -2.747  12.088  -9.230
   66   HG21  ILE   9          1HG2      ILE   9  -1.029  12.978  -6.014
   67   HG22  ILE   9          2HG2      ILE   9  -0.970  13.232  -7.758
   68   HG23  ILE   9          3HG2      ILE   9  -0.307  11.755  -7.060
   69   HD11  ILE   9          3HD1      ILE   9  -1.627  10.162 -10.073
   70   HD12  ILE   9          1HD1      ILE   9  -1.412   9.515  -8.448
   71   HD13  ILE   9          2HD1      ILE   9  -0.552  10.977  -8.934
   72    H    ILE  10           H        ILE  10  -1.656  10.184  -3.744
   73    HA   ILE  10           HA       ILE  10  -3.555  11.767  -2.236
   74    HB   ILE  10           HB       ILE  10  -0.933  10.626  -1.206
   75   HG12  ILE  10          2HG1      ILE  10  -3.397   9.243  -0.450
   76   HG13  ILE  10          1HG1      ILE  10  -2.958   9.048  -2.115
   77   HG21  ILE  10          1HG2      ILE  10  -2.379  10.609   0.945
   78   HG22  ILE  10          2HG2      ILE  10  -3.358  11.794   0.079
   79   HG23  ILE  10          3HG2      ILE  10  -1.653  12.120   0.393
   80   HD11  ILE  10          3HD1      ILE  10  -0.665   8.405  -1.305
   81   HD12  ILE  10          1HD1      ILE  10  -1.978   7.258  -1.025
   82   HD13  ILE  10          2HD1      ILE  10  -1.412   8.288   0.288
   83    H    HIS  11           H        HIS  11  -2.744  13.544  -0.808
   84    HA   HIS  11           HA       HIS  11  -0.353  14.875  -1.807
   85    HB2  HIS  11           2HB      HIS  11  -2.293  15.808  -3.069
   86    HB3  HIS  11           1HB      HIS  11  -3.060  16.235  -1.545
   87    HD2  HIS  11           2HD      HIS  11   0.586  17.046  -2.851
   88    HE1  HIS  11           1HE      HIS  11  -1.349  20.574  -1.551
   89    HE2  HIS  11           2HE      HIS  11   0.793  19.608  -2.499
   90    H    ARG  12           H        ARG  12   0.844  15.103  -0.066
   91    HA   ARG  12           HA       ARG  12  -0.135  14.868   2.570
   92    HB2  ARG  12           2HB      ARG  12   2.252  14.511   1.596
   93    HB3  ARG  12           1HB      ARG  12   2.463  16.222   1.939
   94    HG2  ARG  12           2HG      ARG  12   2.176  15.904   4.251
   95    HG3  ARG  12           1HG      ARG  12   1.540  14.272   4.023
   96    HD2  ARG  12           2HD      ARG  12   3.686  13.512   3.223
   97    HD3  ARG  12           1HD      ARG  12   4.332  15.143   3.334
   98    HE   ARG  12           HE       ARG  12   3.376  14.391   5.865
   99   HH11  ARG  12          1HH1      ARG  12   5.966  13.590   3.635
  100   HH12  ARG  12          2HH1      ARG  12   7.026  13.018   4.885
  101   HH21  ARG  12          1HH2      ARG  12   4.779  13.628   7.501
  102   HH22  ARG  12          2HH2      ARG  12   6.363  13.055   7.075
  103    H    ALA  13           H        ALA  13  -1.614  16.289   3.237
  104    HA   ALA  13           HA       ALA  13  -1.444  19.101   2.697
  105    HB1  ALA  13           1HB      ALA  13  -3.473  19.248   4.066
  106    HB2  ALA  13           2HB      ALA  13  -3.286  17.556   4.523
  107    HB3  ALA  13           3HB      ALA  13  -3.601  17.986   2.843
  108    H    GLY  14           H        GLY  14   0.899  18.539   3.870
  109    HA2  GLY  14           2HA      GLY  14   2.277  19.451   5.474
  110    HA3  GLY  14           1HA      GLY  14   0.871  20.246   6.163
  111    H    LYS  15           H        LYS  15   0.459  16.893   5.837
  112    HA   LYS  15           HA       LYS  15   1.451  16.402   8.543
  113    HB2  LYS  15           2HB      LYS  15  -0.823  14.949   8.664
  114    HB3  LYS  15           1HB      LYS  15  -0.678  16.585   9.285
  115    HG2  LYS  15           2HG      LYS  15  -1.847  17.505   7.501
  116    HG3  LYS  15           1HG      LYS  15  -1.553  16.110   6.462
  117    HD2  LYS  15           2HD      LYS  15  -3.893  16.255   7.263
  118    HD3  LYS  15           1HD      LYS  15  -3.082  14.769   7.754
  119    HE2  LYS  15           2HE      LYS  15  -2.631  15.783   9.959
  120    HE3  LYS  15           1HE      LYS  15  -3.532  17.214   9.463
  121    HZ1  LYS  15           3HZ      LYS  15  -5.507  15.865   9.238
  122    HZ2  LYS  15           1HZ      LYS  15  -4.873  15.685  10.795
  123    HZ3  LYS  15           2HZ      LYS  15  -4.653  14.465   9.645
  124    H    LYS  16           H        LYS  16  -0.595  14.371   6.488
  125    HA   LYS  16           HA       LYS  16   1.619  12.710   5.671
  126    HB2  LYS  16           2HB      LYS  16   0.403  10.664   6.708
  127    HB3  LYS  16           1HB      LYS  16   1.435  11.645   7.730
  128    HG2  LYS  16           2HG      LYS  16  -0.912  12.895   8.123
  129    HG3  LYS  16           1HG      LYS  16  -1.483  11.257   7.804
  130    HD2  LYS  16           2HD      LYS  16   0.062  10.416   9.547
  131    HD3  LYS  16           1HD      LYS  16   0.529  12.082   9.898
  132    HE2  LYS  16           2HE      LYS  16  -1.919  12.540  10.337
  133    HE3  LYS  16           1HE      LYS  16  -2.166  10.795  10.268
  134    HZ1  LYS  16           3HZ      LYS  16  -1.877  11.576  12.536
  135    HZ2  LYS  16           1HZ      LYS  16  -0.356  12.210  12.151
  136    HZ3  LYS  16           2HZ      LYS  16  -0.619  10.539  12.096
  137    H    TYR  17           H        TYR  17   0.516  10.550   4.693
  138    HA   TYR  17           HA       TYR  17  -1.343  11.592   2.717
  139    HB2  TYR  17           2HB      TYR  17  -0.118   8.830   2.764
  140    HB3  TYR  17           1HB      TYR  17  -0.845   9.670   1.374
  141    HD1  TYR  17           1HD      TYR  17   2.110   9.487   3.572
  142    HD2  TYR  17           2HD      TYR  17   0.341  11.422   0.237
  143    HE1  TYR  17           1HE      TYR  17   4.278  10.489   3.022
  144    HE2  TYR  17           2HE      TYR  17   2.514  12.433  -0.341
  145    HH   TYR  17           HH       TYR  17   4.675  12.614   0.207
  146    H    GLY  18           H        GLY  18  -1.687  10.505   5.643
  147    HA2  GLY  18           2HA      GLY  18  -3.390   9.675   6.876
  148    HA3  GLY  18           1HA      GLY  18  -4.402  10.183   5.557
  149    H    PHE  19           H        PHE  19  -2.062   7.534   5.734
  150    HA   PHE  19           HA       PHE  19  -4.126   5.593   6.064
  151    HB2  PHE  19           2HB      PHE  19  -4.169   4.531   3.978
  152    HB3  PHE  19           1HB      PHE  19  -4.308   6.217   3.627
  153    HD1  PHE  19           2HD      PHE  19  -2.074   7.446   3.020
  154    HD2  PHE  19           1HD      PHE  19  -2.618   3.232   2.921
  155    HE1  PHE  19           2HE      PHE  19  -0.129   7.228   1.514
  156    HE2  PHE  19           1HE      PHE  19  -0.685   3.006   1.424
  157    HZ   PHE  19           HZ       PHE  19   0.560   5.006   0.718
  158    H    THR  20           H        THR  20  -3.530   3.559   6.347
  159    HA   THR  20           HA       THR  20  -0.754   3.173   7.229
  160    HB   THR  20           HB       THR  20  -3.260   1.558   7.718
  161    HG1  THR  20           1HG      THR  20  -3.206   3.608   8.768
  162   HG21  THR  20          3HG2      THR  20  -0.617   1.271   9.144
  163   HG22  THR  20          1HG2      THR  20  -1.109   0.231   7.807
  164   HG23  THR  20          2HG2      THR  20  -2.050   0.249   9.301
  165    H    LEU  21           H        LEU  21   0.678   2.128   5.918
  166    HA   LEU  21           HA       LEU  21  -0.331   0.376   3.817
  167    HB2  LEU  21           2HB      LEU  21   1.744   2.141   3.773
  168    HB3  LEU  21           1HB      LEU  21   2.600   0.673   4.152
  169    HG   LEU  21           HG       LEU  21   2.444  -0.089   2.058
  170   HD11  LEU  21          1HD1      LEU  21   0.411   0.009   0.675
  171   HD12  LEU  21          2HD1      LEU  21  -0.381   0.950   1.936
  172   HD13  LEU  21          3HD1      LEU  21   0.116  -0.712   2.255
  173   HD21  LEU  21          3HD2      LEU  21   2.257   1.601   0.355
  174   HD22  LEU  21          1HD2      LEU  21   3.107   2.248   1.760
  175   HD23  LEU  21          2HD2      LEU  21   1.421   2.675   1.479
  176    H    ARG  22           H        ARG  22  -1.069  -1.351   5.091
  177    HA   ARG  22           HA       ARG  22   0.543  -2.727   6.998
  178    HB2  ARG  22           2HB      ARG  22  -2.067  -2.722   6.502
  179    HB3  ARG  22           1HB      ARG  22  -1.651  -4.120   5.530
  180    HG2  ARG  22           2HG      ARG  22  -2.245  -5.033   7.570
  181    HG3  ARG  22           1HG      ARG  22  -0.483  -4.987   7.640
  182    HD2  ARG  22           2HD      ARG  22  -0.482  -3.132   9.088
  183    HD3  ARG  22           1HD      ARG  22  -2.175  -2.759   8.745
  184    HE   ARG  22           HE       ARG  22  -2.324  -5.219   9.840
  185   HH11  ARG  22          1HH1      ARG  22  -0.766  -2.267  10.909
  186   HH12  ARG  22          2HH1      ARG  22  -0.911  -2.654  12.597
  187   HH21  ARG  22          1HH2      ARG  22  -2.552  -5.709  12.042
  188   HH22  ARG  22          2HH2      ARG  22  -1.963  -4.598  13.239
  189    H    ALA  23           H        ALA  23   1.762  -4.617   6.776
  190    HA   ALA  23           HA       ALA  23   2.397  -5.413   4.006
  191    HB1  ALA  23           1HB      ALA  23   4.056  -5.671   6.516
  192    HB2  ALA  23           2HB      ALA  23   4.323  -4.527   5.196
  193    HB3  ALA  23           3HB      ALA  23   4.528  -6.256   4.920
  194    H    ILE  24           H        ILE  24   2.425  -7.597   3.444
  195    HA   ILE  24           HA       ILE  24   1.800  -9.593   5.473
  196    HB   ILE  24           HB       ILE  24   0.024 -10.517   3.777
  197   HG12  ILE  24          2HG1      ILE  24  -0.265  -7.549   3.301
  198   HG13  ILE  24          1HG1      ILE  24   0.451  -8.660   2.137
  199   HG21  ILE  24          1HG2      ILE  24  -0.439  -9.961   6.092
  200   HG22  ILE  24          2HG2      ILE  24  -1.752  -9.418   5.049
  201   HG23  ILE  24          3HG2      ILE  24  -0.583  -8.253   5.670
  202   HD11  ILE  24          3HD1      ILE  24  -1.873  -8.179   1.602
  203   HD12  ILE  24          1HD1      ILE  24  -2.369  -8.780   3.184
  204   HD13  ILE  24          2HD1      ILE  24  -1.654  -9.881   2.008
  205    H    ARG  25           H        ARG  25   2.517 -11.619   4.982
  206    HA   ARG  25           HA       ARG  25   3.980 -11.907   2.439
  207    HB2  ARG  25           2HB      ARG  25   4.303 -13.710   4.833
  208    HB3  ARG  25           1HB      ARG  25   5.413 -13.469   3.493
  209    HG2  ARG  25           2HG      ARG  25   5.507 -11.024   4.436
  210    HG3  ARG  25           1HG      ARG  25   4.973 -11.819   5.920
  211    HD2  ARG  25           2HD      ARG  25   7.461 -12.353   4.316
  212    HD3  ARG  25           1HD      ARG  25   7.341 -11.768   5.969
  213    HE   ARG  25           HE       ARG  25   6.257 -14.421   5.428
  214   HH11  ARG  25          1HH1      ARG  25   8.858 -12.473   6.735
  215   HH12  ARG  25          2HH1      ARG  25   9.589 -13.795   7.588
  216   HH21  ARG  25          1HH2      ARG  25   7.208 -16.170   6.558
  217   HH22  ARG  25          2HH2      ARG  25   8.658 -15.900   7.478
  218    H    VAL  26           H        VAL  26   2.339 -12.617   1.119
  219    HA   VAL  26           HA       VAL  26   0.593 -14.762   1.941
  220    HB   VAL  26           HB       VAL  26  -0.225 -14.637  -0.447
  221   HG11  VAL  26          1HG1      VAL  26  -1.207 -12.287  -0.079
  222   HG12  VAL  26          2HG1      VAL  26  -0.311 -12.311   1.440
  223   HG13  VAL  26          3HG1      VAL  26  -1.547 -13.529   1.127
  224   HG21  VAL  26          3HG2      VAL  26   1.866 -13.650  -1.365
  225   HG22  VAL  26          1HG2      VAL  26   1.445 -12.143  -0.547
  226   HG23  VAL  26          2HG2      VAL  26   0.395 -12.785  -1.811
  227    H    TYR  27           H        TYR  27   1.211 -16.808   1.948
  228    HA   TYR  27           HA       TYR  27   3.462 -17.695   0.345
  229    HB2  TYR  27           2HB      TYR  27   1.737 -19.014   2.430
  230    HB3  TYR  27           1HB      TYR  27   2.870 -19.944   1.460
  231    HD1  TYR  27           2HD      TYR  27   3.085 -16.617   3.150
  232    HD2  TYR  27           1HD      TYR  27   4.710 -20.525   2.729
  233    HE1  TYR  27           2HE      TYR  27   4.883 -16.031   4.714
  234    HE2  TYR  27           1HE      TYR  27   6.511 -19.953   4.303
  235    HH   TYR  27           HH       TYR  27   7.552 -18.240   5.371
  236    H    MET  28           H        MET  28   3.286 -18.513  -1.608
  237    HA   MET  28           HA       MET  28   0.656 -19.048  -2.706
  238    HB2  MET  28           2HB      MET  28   3.392 -19.081  -3.980
  239    HB3  MET  28           1HB      MET  28   1.893 -19.333  -4.835
  240    HG2  MET  28           2HG      MET  28   2.597 -16.885  -3.350
  241    HG3  MET  28           1HG      MET  28   2.796 -17.084  -5.074
  242    HE1  MET  28           3HE      MET  28   0.684 -15.468  -2.521
  243    HE2  MET  28           1HE      MET  28   0.199 -17.115  -2.124
  244    HE3  MET  28           2HE      MET  28  -0.977 -15.990  -2.802
  245    H    GLY  29           H        GLY  29  -0.042 -20.933  -1.792
  246    HA2  GLY  29           2HA      GLY  29  -0.375 -23.237  -2.189
  247    HA3  GLY  29           1HA      GLY  29   1.273 -23.350  -2.789
  248    H    ASP  30           H        ASP  30   1.859 -25.062  -1.496
  249    HA   ASP  30           HA       ASP  30   1.703 -24.685   1.406
  250    HB2  ASP  30           2HB      ASP  30   0.872 -26.826   0.446
  251    HB3  ASP  30           1HB      ASP  30   2.494 -27.157  -0.154
  252    H    SER  31           H        SER  31   3.848 -24.389  -1.175
  253    HA   SER  31           HA       SER  31   6.262 -25.078   0.155
  254    HB2  SER  31           2HB      SER  31   6.287 -23.132  -2.092
  255    HB3  SER  31           1HB      SER  31   7.290 -24.555  -1.826
  256    HG   SER  31           HG       SER  31   5.257 -24.377  -3.430
  257    H    ASP  32           H        ASP  32   8.049 -23.373   0.368
  258    HA   ASP  32           HA       ASP  32   7.098 -21.398   2.233
  259    HB2  ASP  32           2HB      ASP  32   9.311 -21.149   2.918
  260    HB3  ASP  32           1HB      ASP  32   9.216 -22.837   2.437
  261    H    VAL  33           H        VAL  33   6.935 -21.187  -0.931
  262    HA   VAL  33           HA       VAL  33   8.266 -18.688  -1.389
  263    HB   VAL  33           HB       VAL  33   8.048 -20.120  -3.292
  264   HG11  VAL  33          1HG1      VAL  33   5.915 -20.792  -4.240
  265   HG12  VAL  33          2HG1      VAL  33   5.059 -19.970  -2.937
  266   HG13  VAL  33          3HG1      VAL  33   6.065 -21.371  -2.584
  267   HG21  VAL  33          3HG2      VAL  33   6.125 -17.828  -3.633
  268   HG22  VAL  33          1HG2      VAL  33   7.048 -18.629  -4.904
  269   HG23  VAL  33          2HG2      VAL  33   7.882 -17.688  -3.667
  270    H    TYR  34           H        TYR  34   7.490 -16.738  -1.127
  271    HA   TYR  34           HA       TYR  34   4.613 -16.324  -0.842
  272    HB2  TYR  34           2HB      TYR  34   4.911 -14.987   1.203
  273    HB3  TYR  34           1HB      TYR  34   5.396 -16.660   1.447
  274    HD1  TYR  34           2HD      TYR  34   7.788 -17.233   1.701
  275    HD2  TYR  34           1HD      TYR  34   6.512 -13.189   1.345
  276    HE1  TYR  34           2HE      TYR  34   9.976 -16.473   2.531
  277    HE2  TYR  34           1HE      TYR  34   8.697 -12.423   2.170
  278    HH   TYR  34           HH       TYR  34  11.374 -14.155   2.199
  279    H    THR  35           H        THR  35   3.904 -14.242  -1.367
  280    HA   THR  35           HA       THR  35   5.992 -12.571  -2.613
  281    HB   THR  35           HB       THR  35   3.233 -11.844  -3.231
  282    HG1  THR  35           1HG      THR  35   4.124 -14.479  -3.575
  283   HG21  THR  35          3HG2      THR  35   4.108 -11.817  -5.518
  284   HG22  THR  35          1HG2      THR  35   5.598 -12.580  -4.960
  285   HG23  THR  35          2HG2      THR  35   5.182 -10.955  -4.417
  286    H    VAL  36           H        VAL  36   6.291 -10.538  -1.909
  287    HA   VAL  36           HA       VAL  36   4.920  -9.789   0.533
  288    HB   VAL  36           HB       VAL  36   7.036  -8.151  -0.851
  289   HG11  VAL  36          1HG1      VAL  36   7.469  -7.355   1.433
  290   HG12  VAL  36          2HG1      VAL  36   6.162  -8.377   2.031
  291   HG13  VAL  36          3HG1      VAL  36   5.805  -7.041   0.937
  292   HG21  VAL  36          3HG2      VAL  36   7.880 -10.434  -0.567
  293   HG22  VAL  36          1HG2      VAL  36   7.457 -10.374   1.143
  294   HG23  VAL  36          2HG2      VAL  36   8.700  -9.298   0.506
  295    H    HIS  37           H        HIS  37   3.008  -8.860   0.343
  296    HA   HIS  37           HA       HIS  37   2.675  -6.745  -1.685
  297    HB2  HIS  37           2HB      HIS  37   0.601  -8.644  -0.556
  298    HB3  HIS  37           1HB      HIS  37   0.205  -7.220  -1.504
  299    HD2  HIS  37           2HD      HIS  37   0.866 -10.863  -2.013
  300    HE1  HIS  37           1HE      HIS  37   1.555  -8.990  -5.743
  301    HE2  HIS  37           2HE      HIS  37   1.030 -11.179  -4.582
  302    H    HIS  38           H        HIS  38   0.691  -5.320  -0.895
  303    HA   HIS  38           HA       HIS  38   0.772  -4.847   1.971
  304    HB2  HIS  38           2HB      HIS  38   1.569  -2.722  -0.040
  305    HB3  HIS  38           1HB      HIS  38   1.302  -2.445   1.677
  306    HD2  HIS  38           2HD      HIS  38   4.100  -3.263  -0.693
  307    HE1  HIS  38           1HE      HIS  38   5.441  -4.339   3.165
  308    HE2  HIS  38           2HE      HIS  38   6.049  -4.256   0.710
  309    H    MET  39           H        MET  39  -0.928  -3.465   2.673
  310    HA   MET  39           HA       MET  39  -2.955  -2.741   0.702
  311    HB2  MET  39           2HB      MET  39  -3.505  -4.622   3.010
  312    HB3  MET  39           1HB      MET  39  -4.743  -3.872   2.019
  313    HG2  MET  39           2HG      MET  39  -3.337  -5.046   0.090
  314    HG3  MET  39           1HG      MET  39  -2.930  -6.126   1.420
  315    HE1  MET  39           3HE      MET  39  -6.440  -7.407   2.548
  316    HE2  MET  39           1HE      MET  39  -5.466  -6.097   3.211
  317    HE3  MET  39           2HE      MET  39  -4.698  -7.609   2.731
  318    H    VAL  40           H        VAL  40  -4.323  -1.127   1.407
  319    HA   VAL  40           HA       VAL  40  -3.333   0.429   3.583
  320    HB   VAL  40           HB       VAL  40  -4.162   1.633   1.699
  321   HG11  VAL  40          1HG1      VAL  40  -6.776   0.211   2.158
  322   HG12  VAL  40          2HG1      VAL  40  -5.698   0.042   0.772
  323   HG13  VAL  40          3HG1      VAL  40  -6.549   1.561   1.048
  324   HG21  VAL  40          3HG2      VAL  40  -6.295   2.055   3.766
  325   HG22  VAL  40          1HG2      VAL  40  -5.444   3.249   2.785
  326   HG23  VAL  40          2HG2      VAL  40  -4.607   2.428   4.105
  327    H    TRP  41           H        TRP  41  -3.602  -0.343   5.506
  328    HA   TRP  41           HA       TRP  41  -5.771  -1.965   6.364
  329    HB2  TRP  41           2HB      TRP  41  -3.310  -1.668   7.250
  330    HB3  TRP  41           1HB      TRP  41  -4.068  -0.481   8.297
  331    HD1  TRP  41           HD       TRP  41  -4.310  -1.579  10.568
  332    HE1  TRP  41           1HE      TRP  41  -5.227  -3.811  11.443
  333    HE3  TRP  41           3HE      TRP  41  -5.295  -3.856   6.099
  334    HZ2  TRP  41           2HZ      TRP  41  -6.247  -6.229  10.367
  335    HZ3  TRP  41           3HZ      TRP  41  -6.249  -6.122   6.110
  336    HH2  TRP  41           HH       TRP  41  -6.713  -7.281   8.204
  337    H    HIS  42           H        HIS  42  -4.922   1.380   6.766
  338    HA   HIS  42           HA       HIS  42  -7.669   2.051   7.435
  339    HB2  HIS  42           2HB      HIS  42  -6.213   1.469   9.537
  340    HB3  HIS  42           1HB      HIS  42  -5.533   3.060   9.272
  341    HD2  HIS  42           2HD      HIS  42  -7.358   5.210   9.552
  342    HE1  HIS  42           1HE      HIS  42 -10.154   2.865  11.694
  343    HE2  HIS  42           2HE      HIS  42  -9.348   5.222  11.215
  344    H    VAL  43           H        VAL  43  -8.137   3.836   6.374
  345    HA   VAL  43           HA       VAL  43  -5.965   5.738   5.877
  346    HB   VAL  43           HB       VAL  43  -6.420   4.695   3.780
  347   HG11  VAL  43          1HG1      VAL  43  -8.545   3.742   4.136
  348   HG12  VAL  43          2HG1      VAL  43  -8.665   4.829   2.752
  349   HG13  VAL  43          3HG1      VAL  43  -9.288   5.329   4.325
  350   HG21  VAL  43          3HG2      VAL  43  -6.029   7.100   3.720
  351   HG22  VAL  43          1HG2      VAL  43  -7.769   7.382   3.849
  352   HG23  VAL  43          2HG2      VAL  43  -7.113   6.584   2.420
  353    H    GLU  44           H        GLU  44  -6.258   7.646   6.594
  354    HA   GLU  44           HA       GLU  44  -8.487   8.382   8.149
  355    HB2  GLU  44           2HB      GLU  44  -6.074   9.874   7.134
  356    HB3  GLU  44           1HB      GLU  44  -7.261  10.582   8.202
  357    HG2  GLU  44           2HG      GLU  44  -6.765   8.974   9.920
  358    HG3  GLU  44           1HG      GLU  44  -5.670   8.120   8.836
  359    H    ASP  45           H        ASP  45 -10.342   9.162   7.485
  360    HA   ASP  45           HA       ASP  45 -10.669  10.126   4.772
  361    HB2  ASP  45           2HB      ASP  45 -13.080  10.168   5.317
  362    HB3  ASP  45           1HB      ASP  45 -12.350   8.601   5.646
  363    H    GLY  46           H        GLY  46  -9.176  11.667   6.821
  364    HA2  GLY  46           2HA      GLY  46 -10.820  13.974   7.364
  365    HA3  GLY  46           1HA      GLY  46  -9.121  13.785   7.757
  366    H    GLY  47           H        GLY  47  -8.631  12.996   4.836
  367    HA2  GLY  47           2HA      GLY  47  -9.340  15.036   3.125
  368    HA3  GLY  47           1HA      GLY  47  -7.953  15.633   4.007
  369    HA   PRO  48           HA       PRO  48  -4.895  13.461   1.652
  370    HB2  PRO  48           2HB      PRO  48  -4.757  11.179   3.570
  371    HB3  PRO  48           1HB      PRO  48  -3.448  12.128   2.851
  372    HG2  PRO  48           2HG      PRO  48  -4.147  12.605   5.322
  373    HG3  PRO  48           1HG      PRO  48  -3.920  13.982   4.223
  374    HD2  PRO  48           2HD      PRO  48  -6.467  12.683   5.126
  375    HD3  PRO  48           1HD      PRO  48  -6.061  14.404   4.999
  376    H    ALA  49           H        ALA  49  -4.565  10.380   2.084
  377    HA   ALA  49           HA       ALA  49  -5.244   9.507  -0.376
  378    HB1  ALA  49           1HB      ALA  49  -4.181   7.713   0.328
  379    HB2  ALA  49           2HB      ALA  49  -5.509   7.289   1.415
  380    HB3  ALA  49           3HB      ALA  49  -4.216   8.355   1.977
  381    H    SER  50           H        SER  50  -7.454   9.431   2.414
  382    HA   SER  50           HA       SER  50  -9.369   7.735   1.266
  383    HB2  SER  50           2HB      SER  50  -9.234   9.559   3.536
  384    HB3  SER  50           1HB      SER  50 -10.847   9.403   2.852
  385    HG   SER  50           HG       SER  50 -10.523   7.085   3.008
  386    H    GLU  51           H        GLU  51  -9.522  11.286   1.509
  387    HA   GLU  51           HA       GLU  51 -11.826  11.549  -0.087
  388    HB2  GLU  51           2HB      GLU  51  -9.647  13.524   0.568
  389    HB3  GLU  51           1HB      GLU  51 -11.115  13.944  -0.303
  390    HG2  GLU  51           2HG      GLU  51 -11.346  12.584   2.328
  391    HG3  GLU  51           1HG      GLU  51 -10.938  14.297   2.279
  392    H    ALA  52           H        ALA  52  -8.453  11.396  -0.830
  393    HA   ALA  52           HA       ALA  52  -8.476  12.313  -3.468
  394    HB1  ALA  52           1HB      ALA  52  -6.413  10.892  -3.691
  395    HB2  ALA  52           2HB      ALA  52  -6.722  10.326  -2.047
  396    HB3  ALA  52           3HB      ALA  52  -6.404  12.034  -2.348
  397    H    GLY  53           H        GLY  53  -9.437   9.258  -2.063
  398    HA2  GLY  53           2HA      GLY  53 -11.180   8.232  -3.642
  399    HA3  GLY  53           1HA      GLY  53  -9.826   8.151  -4.754
  400    H    LEU  54           H        LEU  54  -8.249   7.618  -2.046
  401    HA   LEU  54           HA       LEU  54  -8.093   4.819  -2.476
  402    HB2  LEU  54           2HB      LEU  54  -6.380   6.551  -1.410
  403    HB3  LEU  54           1HB      LEU  54  -7.085   5.950   0.074
  404    HG   LEU  54           HG       LEU  54  -5.659   4.347  -2.039
  405   HD11  LEU  54          1HD1      LEU  54  -4.143   5.573  -0.613
  406   HD12  LEU  54          2HD1      LEU  54  -4.099   3.860  -0.190
  407   HD13  LEU  54          3HD1      LEU  54  -4.986   4.995   0.825
  408   HD21  LEU  54          3HD2      LEU  54  -6.948   3.399   0.491
  409   HD22  LEU  54          1HD2      LEU  54  -5.979   2.426  -0.617
  410   HD23  LEU  54          2HD2      LEU  54  -7.524   3.093  -1.145
  411    H    ARG  55           H        ARG  55  -9.452   3.381  -1.872
  412    HA   ARG  55           HA       ARG  55 -11.246   3.904   0.370
  413    HB2  ARG  55           2HB      ARG  55 -12.524   1.968  -0.435
  414    HB3  ARG  55           1HB      ARG  55 -12.298   3.164  -1.701
  415    HG2  ARG  55           2HG      ARG  55 -11.680   1.447  -2.974
  416    HG3  ARG  55           1HG      ARG  55 -10.161   1.496  -2.081
  417    HD2  ARG  55           2HD      ARG  55 -10.858  -0.743  -1.972
  418    HD3  ARG  55           1HD      ARG  55 -11.280  -0.054  -0.403
  419    HE   ARG  55           HE       ARG  55 -13.256  -0.331  -2.575
  420   HH11  ARG  55          1HH1      ARG  55 -12.306  -0.796   0.774
  421   HH12  ARG  55          2HH1      ARG  55 -13.843  -1.455   1.240
  422   HH21  ARG  55          1HH2      ARG  55 -15.271  -1.158  -1.954
  423   HH22  ARG  55          2HH2      ARG  55 -15.532  -1.660  -0.314
  424    H    GLN  56           H        GLN  56 -10.881   3.044   2.316
  425    HA   GLN  56           HA       GLN  56  -8.674   1.578   3.041
  426    HB2  GLN  56           2HB      GLN  56 -10.308   2.738   4.548
  427    HB3  GLN  56           1HB      GLN  56 -11.357   1.357   4.387
  428    HG2  GLN  56           2HG      GLN  56  -9.848   0.003   5.489
  429    HG3  GLN  56           1HG      GLN  56  -8.548   1.171   5.384
  430   HE21  GLN  56          1HE2      GLN  56  -9.766  -0.183   7.697
  431   HE22  GLN  56          2HE2      GLN  56 -10.289   1.083   8.756
  432    H    GLY  57           H        GLY  57  -8.146  -0.555   3.241
  433    HA2  GLY  57           2HA      GLY  57  -8.476  -2.869   3.206
  434    HA3  GLY  57           1HA      GLY  57 -10.128  -2.606   2.675
  435    H    ASP  58           H        ASP  58  -7.966  -0.803   0.850
  436    HA   ASP  58           HA       ASP  58  -8.305  -2.566  -1.442
  437    HB2  ASP  58           2HB      ASP  58  -8.427   0.114  -1.246
  438    HB3  ASP  58           1HB      ASP  58  -6.732  -0.064  -1.681
  439    H    LEU  59           H        LEU  59  -6.623  -3.355  -2.695
  440    HA   LEU  59           HA       LEU  59  -4.141  -3.794  -1.213
  441    HB2  LEU  59           2HB      LEU  59  -5.065  -5.845  -1.926
  442    HB3  LEU  59           1HB      LEU  59  -5.463  -5.208  -3.510
  443    HG   LEU  59           HG       LEU  59  -2.895  -5.012  -3.826
  444   HD11  LEU  59          1HD1      LEU  59  -2.233  -5.454  -1.541
  445   HD12  LEU  59          2HD1      LEU  59  -1.629  -6.729  -2.600
  446   HD13  LEU  59          3HD1      LEU  59  -3.039  -7.023  -1.584
  447   HD21  LEU  59          3HD2      LEU  59  -2.801  -7.354  -4.602
  448   HD22  LEU  59          1HD2      LEU  59  -4.258  -6.509  -5.120
  449   HD23  LEU  59          2HD2      LEU  59  -4.334  -7.656  -3.783
  450    H    ILE  60           H        ILE  60  -2.271  -2.914  -1.813
  451    HA   ILE  60           HA       ILE  60  -2.299  -1.077  -4.064
  452    HB   ILE  60           HB       ILE  60  -0.230  -1.557  -1.912
  453   HG12  ILE  60          2HG1      ILE  60  -0.861   0.892  -1.424
  454   HG13  ILE  60          1HG1      ILE  60  -2.274   0.592  -2.421
  455   HG21  ILE  60          1HG2      ILE  60   0.923   0.425  -2.805
  456   HG22  ILE  60          2HG2      ILE  60  -0.215   0.465  -4.153
  457   HG23  ILE  60          3HG2      ILE  60   0.888  -0.901  -3.969
  458   HD11  ILE  60          3HD1      ILE  60  -1.555  -0.902   0.086
  459   HD12  ILE  60          1HD1      ILE  60  -2.991  -1.163  -0.903
  460   HD13  ILE  60          2HD1      ILE  60  -2.772   0.368  -0.052
  461    H    THR  61           H        THR  61  -1.463  -1.521  -5.977
  462    HA   THR  61           HA       THR  61   0.127  -3.971  -6.268
  463    HB   THR  61           HB       THR  61  -0.509  -3.965  -8.601
  464    HG1  THR  61           1HG      THR  61  -0.625  -1.875  -9.234
  465   HG21  THR  61          3HG2      THR  61  -2.939  -3.304  -6.929
  466   HG22  THR  61          1HG2      THR  61  -2.128  -4.870  -6.949
  467   HG23  THR  61          2HG2      THR  61  -2.903  -4.263  -8.413
  468    H    HIS  62           H        HIS  62   0.085  -0.530  -7.002
  469    HA   HIS  62           HA       HIS  62   2.977  -0.609  -7.471
  470    HB2  HIS  62           2HB      HIS  62   0.964   0.711  -9.303
  471    HB3  HIS  62           1HB      HIS  62   2.699   0.958  -9.394
  472    HD2  HIS  62           2HD      HIS  62   4.151  -1.139 -10.516
  473    HE1  HIS  62           1HE      HIS  62   0.736  -3.361 -11.661
  474    HE2  HIS  62           2HE      HIS  62   3.230  -3.052 -12.009
  475    H    VAL  63           H        VAL  63   3.986   1.487  -7.263
  476    HA   VAL  63           HA       VAL  63   2.342   3.574  -6.069
  477    HB   VAL  63           HB       VAL  63   3.196   2.366  -4.156
  478   HG11  VAL  63          1HG1      VAL  63   5.151   1.322  -5.176
  479   HG12  VAL  63          2HG1      VAL  63   5.564   2.150  -3.675
  480   HG13  VAL  63          3HG1      VAL  63   5.959   2.890  -5.227
  481   HG21  VAL  63          3HG2      VAL  63   4.540   4.248  -3.113
  482   HG22  VAL  63          1HG2      VAL  63   2.964   4.675  -3.784
  483   HG23  VAL  63          2HG2      VAL  63   4.434   5.048  -4.682
  484    H    ASN  64           H        ASN  64   2.619   5.230  -7.347
  485    HA   ASN  64           HA       ASN  64   3.565   6.877  -8.601
  486    HB2  ASN  64           2HB      ASN  64   5.200   6.563  -6.397
  487    HB3  ASN  64           1HB      ASN  64   6.325   6.497  -7.748
  488   HD21  ASN  64          1HD2      ASN  64   7.204   8.482  -7.039
  489   HD22  ASN  64          2HD2      ASN  64   6.389   9.982  -7.325
  490    H    GLY  65           H        GLY  65   3.569   4.079  -9.534
  491    HA2  GLY  65           2HA      GLY  65   4.140   3.159 -11.586
  492    HA3  GLY  65           1HA      GLY  65   5.253   4.493 -11.830
  493    H    GLU  66           H        GLU  66   5.104   2.224  -9.167
  494    HA   GLU  66           HA       GLU  66   7.430   0.801 -10.038
  495    HB2  GLU  66           2HB      GLU  66   7.809   2.994  -8.534
  496    HB3  GLU  66           1HB      GLU  66   7.529   1.818  -7.262
  497    HG2  GLU  66           2HG      GLU  66   9.917   2.125  -7.789
  498    HG3  GLU  66           1HG      GLU  66   9.360   0.468  -8.009
  499    HA   PRO  67           HA       PRO  67   4.535  -2.257  -8.412
  500    HB2  PRO  67           2HB      PRO  67   6.560  -4.226  -8.609
  501    HB3  PRO  67           1HB      PRO  67   5.258  -3.916  -9.761
  502    HG2  PRO  67           2HG      PRO  67   8.089  -3.071  -9.837
  503    HG3  PRO  67           1HG      PRO  67   6.964  -3.362 -11.172
  504    HD2  PRO  67           2HD      PRO  67   7.695  -0.883 -10.397
  505    HD3  PRO  67           1HD      PRO  67   6.106  -1.215 -11.077
  506    H    VAL  68           H        VAL  68   4.192  -2.810  -6.454
  507    HA   VAL  68           HA       VAL  68   6.191  -2.272  -4.410
  508    HB   VAL  68           HB       VAL  68   4.379  -2.509  -2.783
  509   HG11  VAL  68          1HG1      VAL  68   3.693  -0.747  -5.134
  510   HG12  VAL  68          2HG1      VAL  68   4.691  -0.322  -3.741
  511   HG13  VAL  68          3HG1      VAL  68   2.965  -0.613  -3.532
  512   HG21  VAL  68          3HG2      VAL  68   3.110  -4.263  -3.917
  513   HG22  VAL  68          1HG2      VAL  68   2.620  -3.108  -5.156
  514   HG23  VAL  68          2HG2      VAL  68   2.079  -2.897  -3.490
  515    H    HIS  69           H        HIS  69   5.128  -4.684  -6.235
  516    HA   HIS  69           HA       HIS  69   4.917  -6.942  -4.695
  517    HB2  HIS  69           2HB      HIS  69   5.747  -6.331  -7.510
  518    HB3  HIS  69           1HB      HIS  69   5.671  -7.954  -6.918
  519    HD2  HIS  69           2HD      HIS  69   2.930  -5.406  -5.940
  520    HE1  HIS  69           1HE      HIS  69   1.275  -8.231  -8.624
  521    HE2  HIS  69           2HE      HIS  69   0.756  -6.437  -6.908
  522    H    GLY  70           H        GLY  70   6.481  -7.109  -3.084
  523    HA2  GLY  70           2HA      GLY  70   8.491  -8.443  -2.693
  524    HA3  GLY  70           1HA      GLY  70   9.215  -7.637  -4.076
  525    H    LEU  71           H        LEU  71   7.703  -5.158  -2.812
  526    HA   LEU  71           HA       LEU  71  10.045  -4.131  -1.503
  527    HB2  LEU  71           2HB      LEU  71   7.261  -3.002  -1.830
  528    HB3  LEU  71           1HB      LEU  71   8.566  -2.146  -1.038
  529    HG   LEU  71           HG       LEU  71   8.349  -2.878  -3.952
  530   HD11  LEU  71          1HD1      LEU  71   8.523  -0.448  -4.248
  531   HD12  LEU  71          2HD1      LEU  71   8.580  -0.244  -2.495
  532   HD13  LEU  71          3HD1      LEU  71   7.131  -0.891  -3.259
  533   HD21  LEU  71          3HD2      LEU  71  10.633  -3.295  -3.331
  534   HD22  LEU  71          1HD2      LEU  71  10.715  -1.774  -2.443
  535   HD23  LEU  71          2HD2      LEU  71  10.555  -1.763  -4.200
  536    H    VAL  72           H        VAL  72  10.398  -3.862   0.661
  537    HA   VAL  72           HA       VAL  72   8.752  -5.417   2.435
  538    HB   VAL  72           HB       VAL  72  11.357  -4.982   2.480
  539   HG11  VAL  72          1HG1      VAL  72  10.530  -2.932   4.503
  540   HG12  VAL  72          2HG1      VAL  72  10.945  -2.494   2.848
  541   HG13  VAL  72          3HG1      VAL  72  12.142  -3.282   3.877
  542   HG21  VAL  72          3HG2      VAL  72   9.956  -6.446   3.981
  543   HG22  VAL  72          1HG2      VAL  72   9.888  -5.086   5.102
  544   HG23  VAL  72          2HG2      VAL  72  11.441  -5.813   4.690
  545    H    HIS  73           H        HIS  73   8.056  -4.425   4.569
  546    HA   HIS  73           HA       HIS  73   5.978  -2.698   4.337
  547    HB2  HIS  73           2HB      HIS  73   6.721  -4.066   6.348
  548    HB3  HIS  73           1HB      HIS  73   7.777  -2.736   6.746
  549    HD1  HIS  73           1HD      HIS  73   4.056  -3.436   6.375
  550    HD2  HIS  73           2HD      HIS  73   6.656  -0.704   8.108
  551    HE1  HIS  73           1HE      HIS  73   2.649  -1.966   7.863
  552    H    THR  74           H        THR  74   9.272  -1.812   5.178
  553    HA   THR  74           HA       THR  74   8.623   0.961   5.473
  554    HB   THR  74           HB       THR  74  10.889   1.228   6.153
  555    HG1  THR  74           1HG      THR  74  12.463  -0.307   5.699
  556   HG21  THR  74          3HG2      THR  74   9.696   0.153   7.864
  557   HG22  THR  74          1HG2      THR  74  11.149  -0.834   7.686
  558   HG23  THR  74          2HG2      THR  74   9.617  -1.375   6.980
  559    H    GLU  75           H        GLU  75   9.658  -1.042   2.863
  560    HA   GLU  75           HA       GLU  75  10.996   0.970   1.375
  561    HB2  GLU  75           2HB      GLU  75   9.980  -1.765   0.793
  562    HB3  GLU  75           1HB      GLU  75  10.373  -0.698  -0.547
  563    HG2  GLU  75           2HG      GLU  75  12.628  -0.401   0.350
  564    HG3  GLU  75           1HG      GLU  75  12.233  -1.496   1.673
  565    H    VAL  76           H        VAL  76   7.641  -0.218   1.420
  566    HA   VAL  76           HA       VAL  76   6.819   1.343  -0.799
  567    HB   VAL  76           HB       VAL  76   4.497   1.130   0.189
  568   HG11  VAL  76          1HG1      VAL  76   6.063  -1.390  -0.272
  569   HG12  VAL  76          2HG1      VAL  76   5.385  -0.350  -1.525
  570   HG13  VAL  76          3HG1      VAL  76   4.316  -1.210  -0.419
  571   HG21  VAL  76          3HG2      VAL  76   6.041   0.041   2.413
  572   HG22  VAL  76          1HG2      VAL  76   4.718  -1.000   1.885
  573   HG23  VAL  76          2HG2      VAL  76   4.383   0.665   2.379
  574    H    VAL  77           H        VAL  77   6.690   1.876   2.680
  575    HA   VAL  77           HA       VAL  77   5.586   4.394   2.785
  576    HB   VAL  77           HB       VAL  77   7.788   3.288   4.500
  577   HG11  VAL  77          1HG1      VAL  77   7.242   5.816   4.562
  578   HG12  VAL  77          2HG1      VAL  77   7.381   4.929   6.079
  579   HG13  VAL  77          3HG1      VAL  77   5.790   5.301   5.417
  580   HG21  VAL  77          3HG2      VAL  77   6.291   2.055   5.633
  581   HG22  VAL  77          1HG2      VAL  77   5.307   2.217   4.175
  582   HG23  VAL  77          2HG2      VAL  77   5.052   3.307   5.539
  583    H    GLU  78           H        GLU  78   8.990   3.476   2.413
  584    HA   GLU  78           HA       GLU  78  10.000   6.099   2.245
  585    HB2  GLU  78           2HB      GLU  78  11.041   3.413   1.472
  586    HB3  GLU  78           1HB      GLU  78  11.897   4.858   0.948
  587    HG2  GLU  78           2HG      GLU  78  11.694   5.534   3.450
  588    HG3  GLU  78           1HG      GLU  78  11.467   3.803   3.677
  589    H    LEU  79           H        LEU  79   9.022   3.773  -0.228
  590    HA   LEU  79           HA       LEU  79   9.663   5.193  -2.517
  591    HB2  LEU  79           2HB      LEU  79   8.166   2.904  -1.907
  592    HB3  LEU  79           1HB      LEU  79   7.054   3.946  -2.770
  593    HG   LEU  79           HG       LEU  79   8.054   2.499  -4.377
  594   HD11  LEU  79          1HD1      LEU  79   9.158   4.036  -5.881
  595   HD12  LEU  79          2HD1      LEU  79   9.456   5.159  -4.554
  596   HD13  LEU  79          3HD1      LEU  79   7.804   4.832  -5.077
  597   HD21  LEU  79          3HD2      LEU  79  10.463   2.287  -4.667
  598   HD22  LEU  79          1HD2      LEU  79   9.981   1.801  -3.042
  599   HD23  LEU  79          2HD2      LEU  79  10.735   3.373  -3.303
  600    H    ILE  80           H        ILE  80   6.808   5.441  -0.452
  601    HA   ILE  80           HA       ILE  80   5.444   7.357  -2.016
  602    HB   ILE  80           HB       ILE  80   5.227   6.415   0.824
  603   HG12  ILE  80          2HG1      ILE  80   3.067   6.392  -1.240
  604   HG13  ILE  80          1HG1      ILE  80   4.388   5.239  -1.370
  605   HG21  ILE  80          1HG2      ILE  80   4.599   8.623   1.138
  606   HG22  ILE  80          2HG2      ILE  80   3.069   7.800   0.824
  607   HG23  ILE  80          3HG2      ILE  80   3.850   8.734  -0.453
  608   HD11  ILE  80          3HD1      ILE  80   2.566   4.214  -0.230
  609   HD12  ILE  80          1HD1      ILE  80   2.477   5.551   0.916
  610   HD13  ILE  80          2HD1      ILE  80   3.877   4.480   0.922
  611    H    LEU  81           H        LEU  81   7.387   7.659   0.950
  612    HA   LEU  81           HA       LEU  81   7.289  10.453   1.152
  613    HB2  LEU  81           2HB      LEU  81   9.461   8.559   2.062
  614    HB3  LEU  81           1HB      LEU  81   9.301  10.225   2.573
  615    HG   LEU  81           HG       LEU  81   7.269   8.067   3.118
  616   HD11  LEU  81          1HD1      LEU  81   9.334   7.670   4.342
  617   HD12  LEU  81          2HD1      LEU  81   8.048   8.201   5.428
  618   HD13  LEU  81          3HD1      LEU  81   9.311   9.329   4.940
  619   HD21  LEU  81          3HD2      LEU  81   6.182  10.174   3.021
  620   HD22  LEU  81          1HD2      LEU  81   7.469  10.951   3.938
  621   HD23  LEU  81          2HD2      LEU  81   6.405   9.788   4.728
  622    H    LYS  82           H        LYS  82   9.331   8.334  -0.706
  623    HA   LYS  82           HA       LYS  82  11.371  10.073  -1.465
  624    HB2  LYS  82           2HB      LYS  82  11.117   7.553  -1.795
  625    HB3  LYS  82           1HB      LYS  82  10.237   7.998  -3.231
  626    HG2  LYS  82           2HG      LYS  82  12.382   9.424  -3.731
  627    HG3  LYS  82           1HG      LYS  82  13.128   8.240  -2.654
  628    HD2  LYS  82           2HD      LYS  82  11.435   7.478  -5.026
  629    HD3  LYS  82           1HD      LYS  82  13.185   7.681  -5.117
  630    HE2  LYS  82           2HE      LYS  82  12.061   5.901  -3.011
  631    HE3  LYS  82           1HE      LYS  82  12.106   5.320  -4.675
  632    HZ1  LYS  82           3HZ      LYS  82  14.420   6.251  -3.071
  633    HZ2  LYS  82           1HZ      LYS  82  14.497   5.820  -4.706
  634    HZ3  LYS  82           2HZ      LYS  82  14.095   4.661  -3.542
  635    H    SER  83           H        SER  83   8.220   9.466  -2.834
  636    HA   SER  83           HA       SER  83   8.446  10.834  -5.234
  637    HB2  SER  83           2HB      SER  83   6.542   9.394  -4.643
  638    HB3  SER  83           1HB      SER  83   6.009  10.586  -3.458
  639    HG   SER  83           HG       SER  83   5.078  11.633  -4.998
  640    H    GLY  84           H        GLY  84   7.223  12.114  -2.114
  641    HA2  GLY  84           2HA      GLY  84   8.373  14.391  -1.726
  642    HA3  GLY  84           1HA      GLY  84   7.584  14.809  -3.238
  643    H    ASN  85           H        ASN  85   6.085  16.238  -2.701
  644    HA   ASN  85           HA       ASN  85   4.632  16.160  -0.243
  645    HB2  ASN  85           2HB      ASN  85   3.392  18.074  -1.159
  646    HB3  ASN  85           1HB      ASN  85   5.129  18.283  -1.321
  647   HD21  ASN  85          1HD2      ASN  85   6.064  18.246  -3.354
  648   HD22  ASN  85          2HD2      ASN  85   5.131  18.379  -4.805
  649    H    LYS  86           H        LYS  86   4.304  14.310  -2.927
  650    HA   LYS  86           HA       LYS  86   1.687  13.425  -2.168
  651    HB2  LYS  86           2HB      LYS  86   0.833  13.684  -4.489
  652    HB3  LYS  86           1HB      LYS  86   0.974  15.166  -3.595
  653    HG2  LYS  86           2HG      LYS  86   2.871  15.846  -4.813
  654    HG3  LYS  86           1HG      LYS  86   3.096  14.234  -5.495
  655    HD2  LYS  86           2HD      LYS  86   0.969  14.481  -6.715
  656    HD3  LYS  86           1HD      LYS  86   0.812  16.119  -6.075
  657    HE2  LYS  86           2HE      LYS  86   1.710  16.151  -8.335
  658    HE3  LYS  86           1HE      LYS  86   2.897  16.752  -7.179
  659    HZ1  LYS  86           3HZ      LYS  86   4.068  14.703  -7.279
  660    HZ2  LYS  86           1HZ      LYS  86   3.801  15.205  -8.872
  661    HZ3  LYS  86           2HZ      LYS  86   2.859  13.969  -8.207
  662    H    VAL  87           H        VAL  87   0.972  11.697  -3.835
  663    HA   VAL  87           HA       VAL  87   3.051  10.312  -5.245
  664    HB   VAL  87           HB       VAL  87   3.715   9.805  -2.924
  665   HG11  VAL  87          1HG1      VAL  87   1.020   8.472  -2.780
  666   HG12  VAL  87          2HG1      VAL  87   1.598   9.828  -1.811
  667   HG13  VAL  87          3HG1      VAL  87   2.314   8.229  -1.607
  668   HG21  VAL  87          3HG2      VAL  87   4.416   8.232  -4.529
  669   HG22  VAL  87          1HG2      VAL  87   2.805   7.525  -4.652
  670   HG23  VAL  87          2HG2      VAL  87   3.762   7.291  -3.189
  671    H    ALA  88           H        ALA  88   2.340   8.586  -6.459
  672    HA   ALA  88           HA       ALA  88  -0.560   8.364  -6.779
  673    HB1  ALA  88           1HB      ALA  88   0.715   8.845  -8.778
  674    HB2  ALA  88           2HB      ALA  88  -0.022   7.245  -8.901
  675    HB3  ALA  88           3HB      ALA  88   1.692   7.401  -8.527
  676    H    ILE  89           H        ILE  89  -1.267   6.946  -5.217
  677    HA   ILE  89           HA       ILE  89   0.101   4.389  -4.937
  678    HB   ILE  89           HB       ILE  89  -0.583   5.349  -2.860
  679   HG12  ILE  89          2HG1      ILE  89  -2.669   3.244  -3.283
  680   HG13  ILE  89          1HG1      ILE  89  -0.958   2.836  -3.376
  681   HG21  ILE  89          1HG2      ILE  89  -2.336   6.835  -3.569
  682   HG22  ILE  89          2HG2      ILE  89  -2.952   5.771  -2.305
  683   HG23  ILE  89          3HG2      ILE  89  -3.367   5.470  -3.993
  684   HD11  ILE  89          3HD1      ILE  89  -2.146   2.530  -1.139
  685   HD12  ILE  89          1HD1      ILE  89  -2.097   4.288  -1.021
  686   HD13  ILE  89          2HD1      ILE  89  -0.595   3.370  -1.135
  687    H    SER  90           H        SER  90  -0.340   2.827  -6.360
  688    HA   SER  90           HA       SER  90  -2.888   2.846  -7.767
  689    HB2  SER  90           2HB      SER  90  -0.376   2.350  -8.623
  690    HB3  SER  90           1HB      SER  90  -0.918   0.705  -8.298
  691    HG   SER  90           HG       SER  90  -1.636   1.000 -10.298
  692    H    THR  91           H        THR  91  -4.546   1.872  -6.867
  693    HA   THR  91           HA       THR  91  -4.092  -0.574  -5.300
  694    HB   THR  91           HB       THR  91  -6.308  -0.101  -4.283
  695    HG1  THR  91           1HG      THR  91  -7.514   1.408  -5.119
  696   HG21  THR  91          3HG2      THR  91  -4.324   2.169  -4.070
  697   HG22  THR  91          1HG2      THR  91  -4.246   0.641  -3.187
  698   HG23  THR  91          2HG2      THR  91  -5.570   1.765  -2.887
  699    H    THR  92           H        THR  92  -6.182  -2.048  -5.361
  700    HA   THR  92           HA       THR  92  -6.738  -2.390  -8.235
  701    HB   THR  92           HB       THR  92  -5.586  -4.292  -7.419
  702    HG1  THR  92           1HG      THR  92  -8.143  -5.388  -7.271
  703   HG21  THR  92          3HG2      THR  92  -6.310  -5.626  -5.525
  704   HG22  THR  92          1HG2      THR  92  -7.667  -4.536  -5.250
  705   HG23  THR  92          2HG2      THR  92  -6.016  -3.961  -5.019
  706    HA   PRO  93           HA       PRO  93 -10.916  -0.975  -7.154
  707    HB2  PRO  93           2HB      PRO  93 -11.213  -1.667 -10.026
  708    HB3  PRO  93           1HB      PRO  93 -11.744  -0.222  -9.160
  709    HG2  PRO  93           2HG      PRO  93  -9.601  -0.149 -10.734
  710    HG3  PRO  93           1HG      PRO  93  -9.620   0.725  -9.199
  711    HD2  PRO  93           2HD      PRO  93  -8.236  -1.789  -9.910
  712    HD3  PRO  93           1HD      PRO  93  -7.729  -0.500  -8.813
  713    H    LEU  94           H        LEU  94 -13.115  -1.893  -7.721
  714    HA   LEU  94           HA       LEU  94 -13.298  -4.544  -6.817
  715    HB2  LEU  94           2HB      LEU  94 -15.715  -3.918  -8.090
  716    HB3  LEU  94           1HB      LEU  94 -15.356  -3.814  -6.392
  717    HG   LEU  94           HG       LEU  94 -14.495  -1.452  -6.895
  718   HD11  LEU  94          1HD1      LEU  94 -14.340  -1.177  -9.133
  719   HD12  LEU  94          2HD1      LEU  94 -16.015  -0.649  -8.929
  720   HD13  LEU  94          3HD1      LEU  94 -15.665  -2.294  -9.461
  721   HD21  LEU  94          3HD2      LEU  94 -16.795  -0.540  -6.805
  722   HD22  LEU  94          1HD2      LEU  94 -16.513  -1.834  -5.639
  723   HD23  LEU  94          2HD2      LEU  94 -17.416  -2.159  -7.119
  724    H    GLU  95           H        GLU  95 -14.351  -6.351  -7.926
  725    HA   GLU  95           HA       GLU  95 -14.394  -6.357 -10.802
  726    HB2  GLU  95           2HB      GLU  95 -12.667  -7.895 -11.225
  727    HB3  GLU  95           1HB      GLU  95 -11.959  -6.725 -10.126
  728    HG2  GLU  95           2HG      GLU  95 -13.078  -9.373  -9.245
  729    HG3  GLU  95           1HG      GLU  95 -11.394  -9.120  -9.677
  730    H    ASN  96           H        ASN  96 -15.225  -8.338 -11.677
  731    HA   ASN  96           HA       ASN  96 -17.269  -9.455  -9.985
  732    HB2  ASN  96           2HB      ASN  96 -17.925 -10.716 -12.042
  733    HB3  ASN  96           1HB      ASN  96 -17.863  -8.972 -12.271
  734   HD21  ASN  96          1HD2      ASN  96 -16.430  -8.113 -13.683
  735   HD22  ASN  96          2HD2      ASN  96 -15.413  -9.058 -14.716
  736    H1   SER 101           1HT      SER 101  -3.874 -17.074   2.078
  737    H2   SER 101           2HT      SER 101  -2.275 -16.846   1.579
  738    H3   SER 101           3HT      SER 101  -3.442 -17.381   0.475
  739    HA   SER 101           HA       SER 101  -2.915 -15.050   0.150
  740    HB2  SER 101           2HB      SER 101  -5.714 -15.416   1.240
  741    HB3  SER 101           1HB      SER 101  -5.194 -14.298  -0.020
  742    HG   SER 101           HG       SER 101  -5.687 -15.851  -1.340
  743    H    TRP 102           H        TRP 102  -2.627 -15.942   3.195
  744    HA   TRP 102           HA       TRP 102  -1.903 -13.467   4.242
  745    HB2  TRP 102           2HB      TRP 102  -4.405 -13.108   4.191
  746    HB3  TRP 102           1HB      TRP 102  -4.557 -14.421   5.351
  747    HD1  TRP 102           HD       TRP 102  -2.854 -13.894   7.680
  748    HE1  TRP 102           1HE      TRP 102  -2.828 -11.708   9.035
  749    HE3  TRP 102           3HE      TRP 102  -4.862 -10.745   4.183
  750    HZ2  TRP 102           2HZ      TRP 102  -3.574  -9.019   8.677
  751    HZ3  TRP 102           3HZ      TRP 102  -5.179  -8.378   4.784
  752    HH2  TRP 102           HH       TRP 102  -4.549  -7.537   6.981
  753    H    GLU 103           H        GLU 103  -0.205 -14.909   4.703
  754    HA   GLU 103           HA       GLU 103  -0.803 -16.915   6.753
  755    HB2  GLU 103           2HB      GLU 103   1.415 -16.684   4.732
  756    HB3  GLU 103           1HB      GLU 103   1.505 -17.795   6.088
  757    HG2  GLU 103           2HG      GLU 103   0.748 -18.946   4.095
  758    HG3  GLU 103           1HG      GLU 103  -0.524 -18.920   5.310
  759    H    SER 104           H        SER 104   2.204 -15.156   5.982
  760    HA   SER 104           HA       SER 104   2.499 -14.669   8.856
  761    HB2  SER 104           2HB      SER 104   4.697 -14.058   6.941
  762    HB3  SER 104           1HB      SER 104   4.777 -14.727   8.570
  763    HG   SER 104           HG       SER 104   3.718 -16.645   7.529
  764    H    HIS 105           H        HIS 105   2.863 -12.643   9.702
  765    HA   HIS 105           HA       HIS 105   2.234 -10.405   7.894
  766    HB2  HIS 105           2HB      HIS 105   0.843 -11.079  10.058
  767    HB3  HIS 105           1HB      HIS 105   2.082 -10.117  10.858
  768    HD2  HIS 105           2HD      HIS 105   2.017  -7.387  10.344
  769    HE1  HIS 105           1HE      HIS 105  -1.646  -7.524   8.236
  770    HE2  HIS 105           2HE      HIS 105   0.218  -6.027   9.071
  771    H    LYS 106           H        LYS 106   4.678 -11.810   9.745
  772    HA   LYS 106           HA       LYS 106   6.108  -9.512  10.570
  773    HB2  LYS 106           2HB      LYS 106   6.478 -11.735  11.548
  774    HB3  LYS 106           1HB      LYS 106   7.120 -12.306  10.013
  775    HG2  LYS 106           2HG      LYS 106   8.925 -10.603  10.210
  776    HG3  LYS 106           1HG      LYS 106   8.317 -10.219  11.821
  777    HD2  LYS 106           2HD      LYS 106   8.804 -12.414  12.609
  778    HD3  LYS 106           1HD      LYS 106   9.161 -12.981  10.978
  779    HE2  LYS 106           2HE      LYS 106  11.087 -11.480  10.878
  780    HE3  LYS 106           1HE      LYS 106  10.726 -10.907  12.503
  781    HZ1  LYS 106           3HZ      LYS 106  11.344 -12.913  13.437
  782    HZ2  LYS 106           1HZ      LYS 106  12.487 -12.722  12.205
  783    HZ3  LYS 106           2HZ      LYS 106  11.183 -13.775  11.992
  784    H    SER 107           H        SER 107   6.421  -8.045   8.980
  785    HA   SER 107           HA       SER 107   8.504  -8.625   7.070
  786    HB2  SER 107           2HB      SER 107   6.802  -7.433   5.319
  787    HB3  SER 107           1HB      SER 107   7.006  -9.181   5.445
  788    HG   SER 107           HG       SER 107   5.262  -8.663   7.260
  789    H    GLY 108           H        GLY 108   7.943  -6.892   9.401
  790    HA2  GLY 108           2HA      GLY 108   9.368  -4.713   9.073
  791    HA3  GLY 108           1HA      GLY 108   7.909  -4.213   8.230
  792    H    GLY 109           H        GLY 109   6.121  -3.610   9.389
  793    HA2  GLY 109           2HA      GLY 109   5.703  -4.222  12.116
  794    HA3  GLY 109           1HA      GLY 109   6.463  -2.641  11.979
  795    H    GLU 110           H        GLU 110   4.945  -1.160  12.300
  796    HA   GLU 110           HA       GLU 110   2.479  -1.345  10.699
  797    HB2  GLU 110           2HB      GLU 110   2.686  -0.409  13.571
  798    HB3  GLU 110           1HB      GLU 110   1.232  -0.353  12.585
  799    HG2  GLU 110           2HG      GLU 110   1.286  -2.806  12.412
  800    HG3  GLU 110           1HG      GLU 110   2.699  -2.828  13.467
  801    H    THR 111           H        THR 111   4.874  -0.011  10.062
  802    HA   THR 111           HA       THR 111   4.762   2.768  10.696
  803    HB   THR 111           HB       THR 111   6.144   1.523   8.317
  804    HG1  THR 111           1HG      THR 111   6.683   1.356  11.054
  805   HG21  THR 111          3HG2      THR 111   7.728   3.360   8.617
  806   HG22  THR 111          1HG2      THR 111   6.806   3.941  10.004
  807   HG23  THR 111          2HG2      THR 111   6.092   3.980   8.394
  808    H    ARG 112           H        ARG 112   2.844   3.692  10.161
  809    HA   ARG 112           HA       ARG 112   1.705   3.245   7.523
  810    HB2  ARG 112           2HB      ARG 112  -0.149   4.692   8.405
  811    HB3  ARG 112           1HB      ARG 112   0.119   3.199   9.296
  812    HG2  ARG 112           2HG      ARG 112   0.796   4.279  11.166
  813    HG3  ARG 112           1HG      ARG 112   1.542   5.602  10.266
  814    HD2  ARG 112           2HD      ARG 112  -1.432   5.202  10.522
  815    HD3  ARG 112           1HD      ARG 112  -0.481   6.246  11.579
  816    HE   ARG 112           HE       ARG 112   0.140   7.096   9.059
  817   HH11  ARG 112          1HH1      ARG 112  -2.862   6.685  10.822
  818   HH12  ARG 112          2HH1      ARG 112  -3.647   8.000  10.011
  819   HH21  ARG 112          1HH2      ARG 112  -0.896   8.788   7.990
  820   HH22  ARG 112          2HH2      ARG 112  -2.543   9.209   8.420
  821    H    LEU 113           H        LEU 113   0.694   5.296   6.522
  822    HA   LEU 113           HA       LEU 113   2.848   7.262   6.230
  823    HB2  LEU 113           2HB      LEU 113   0.612   6.349   4.435
  824    HB3  LEU 113           1HB      LEU 113   1.441   7.858   4.139
  825    HG   LEU 113           HG       LEU 113   2.433   6.274   2.698
  826   HD11  LEU 113          1HD1      LEU 113   4.727   6.134   3.441
  827   HD12  LEU 113          2HD1      LEU 113   4.231   6.508   5.090
  828   HD13  LEU 113          3HD1      LEU 113   4.038   7.714   3.818
  829   HD21  LEU 113          3HD2      LEU 113   1.587   4.244   3.727
  830   HD22  LEU 113          1HD2      LEU 113   2.715   4.438   5.070
  831   HD23  LEU 113          2HD2      LEU 113   3.323   4.123   3.447
  Start of MODEL    6
    1    H1   GLY   1           1HT      GLY   1 -10.150 -12.028 -12.021
    2    H2   GLY   1           2HT      GLY   1  -9.375 -11.722 -13.494
    3    H3   GLY   1           3HT      GLY   1 -10.985 -11.264 -13.277
    4    HA2  GLY   1           1HA      GLY   1 -10.316  -9.696 -11.551
    5    HA3  GLY   1           2HA      GLY   1  -8.645 -10.139 -11.858
    6    H    GLY   2           H        GLY   2  -8.631  -7.714 -12.188
    7    HA2  GLY   2           2HA      GLY   2  -9.175  -7.157 -15.035
    8    HA3  GLY   2           1HA      GLY   2  -9.503  -5.969 -13.781
    9    H    SER   3           H        SER   3  -7.963  -5.008 -15.619
   10    HA   SER   3           HA       SER   3  -5.252  -5.127 -14.482
   11    HB2  SER   3           2HB      SER   3  -5.874  -4.731 -17.417
   12    HB3  SER   3           1HB      SER   3  -4.288  -4.970 -16.683
   13    HG   SER   3           HG       SER   3  -6.231  -6.934 -16.269
   14    H    MET   4           H        MET   4  -4.001  -3.100 -15.565
   15    HA   MET   4           HA       MET   4  -3.702  -0.857 -15.477
   16    HB2  MET   4           2HB      MET   4  -6.300  -1.183 -16.844
   17    HB3  MET   4           1HB      MET   4  -5.977   0.419 -16.200
   18    HG2  MET   4           2HG      MET   4  -3.972   0.601 -17.494
   19    HG3  MET   4           1HG      MET   4  -4.119  -1.069 -18.034
   20    HE1  MET   4           3HE      MET   4  -6.789   1.833 -17.685
   21    HE2  MET   4           1HE      MET   4  -6.821   2.427 -19.346
   22    HE3  MET   4           2HE      MET   4  -5.356   2.591 -18.379
   23    H    ARG   5           H        ARG   5  -3.595  -1.160 -13.130
   24    HA   ARG   5           HA       ARG   5  -5.868  -0.493 -11.531
   25    HB2  ARG   5           2HB      ARG   5  -2.932  -0.682 -10.844
   26    HB3  ARG   5           1HB      ARG   5  -4.196  -0.376  -9.661
   27    HG2  ARG   5           2HG      ARG   5  -3.925  -2.640  -9.431
   28    HG3  ARG   5           1HG      ARG   5  -5.217  -2.584 -10.631
   29    HD2  ARG   5           2HD      ARG   5  -3.485  -2.769 -12.408
   30    HD3  ARG   5           1HD      ARG   5  -2.276  -2.995 -11.148
   31    HE   ARG   5           HE       ARG   5  -4.381  -4.871 -10.856
   32   HH11  ARG   5          1HH1      ARG   5  -1.602  -4.149 -12.865
   33   HH12  ARG   5          2HH1      ARG   5  -1.308  -5.809 -13.281
   34   HH21  ARG   5          1HH2      ARG   5  -4.015  -7.057 -11.430
   35   HH22  ARG   5          2HH2      ARG   5  -2.679  -7.461 -12.461
   36    HA   PRO   6           HA       PRO   6  -5.291   3.906 -11.987
   37    HB2  PRO   6           2HB      PRO   6  -7.395   4.385 -10.101
   38    HB3  PRO   6           1HB      PRO   6  -7.500   4.390 -11.862
   39    HG2  PRO   6           2HG      PRO   6  -8.738   2.522 -10.270
   40    HG3  PRO   6           1HG      PRO   6  -8.265   2.234 -11.947
   41    HD2  PRO   6           2HD      PRO   6  -6.832   1.515  -9.418
   42    HD3  PRO   6           1HD      PRO   6  -7.173   0.519 -10.848
   43    HA   PRO   7           HA       PRO   7  -2.938   4.668  -8.188
   44    HB2  PRO   7           2HB      PRO   7  -1.794   6.911  -9.604
   45    HB3  PRO   7           1HB      PRO   7  -1.004   5.464  -8.991
   46    HG2  PRO   7           2HG      PRO   7  -1.327   5.968 -11.637
   47    HG3  PRO   7           1HG      PRO   7  -1.282   4.325 -10.970
   48    HD2  PRO   7           2HD      PRO   7  -3.650   5.974 -11.796
   49    HD3  PRO   7           1HD      PRO   7  -3.347   4.238 -12.033
   50    H    ILE   8           H        ILE   8  -3.854   5.675  -6.612
   51    HA   ILE   8           HA       ILE   8  -5.420   8.077  -7.007
   52    HB   ILE   8           HB       ILE   8  -4.832   6.834  -4.342
   53   HG12  ILE   8          2HG1      ILE   8  -7.087   5.856  -6.045
   54   HG13  ILE   8          1HG1      ILE   8  -5.503   5.163  -6.228
   55   HG21  ILE   8          1HG2      ILE   8  -6.133   8.913  -4.487
   56   HG22  ILE   8          2HG2      ILE   8  -7.085   7.567  -3.856
   57   HG23  ILE   8          3HG2      ILE   8  -7.290   8.082  -5.528
   58   HD11  ILE   8          3HD1      ILE   8  -6.749   5.332  -3.542
   59   HD12  ILE   8          1HD1      ILE   8  -5.516   4.220  -4.126
   60   HD13  ILE   8          2HD1      ILE   8  -7.189   4.037  -4.654
   61    H    ILE   9           H        ILE   9  -4.362   9.928  -7.068
   62    HA   ILE   9           HA       ILE   9  -1.727  10.167  -5.973
   63    HB   ILE   9           HB       ILE   9  -3.290  12.520  -6.947
   64   HG12  ILE   9          2HG1      ILE   9  -3.661  10.696  -8.591
   65   HG13  ILE   9          1HG1      ILE   9  -2.714  12.023  -9.248
   66   HG21  ILE   9          1HG2      ILE   9  -1.102  12.942  -6.034
   67   HG22  ILE   9          2HG2      ILE   9  -1.056  13.191  -7.779
   68   HG23  ILE   9          3HG2      ILE   9  -0.385  11.714  -7.080
   69   HD11  ILE   9          3HD1      ILE   9  -1.795   9.944  -9.985
   70   HD12  ILE   9          1HD1      ILE   9  -1.687   9.355  -8.326
   71   HD13  ILE   9          2HD1      ILE   9  -0.670  10.695  -8.855
   72    H    ILE  10           H        ILE  10  -1.698  10.141  -3.763
   73    HA   ILE  10           HA       ILE  10  -3.543  11.742  -2.220
   74    HB   ILE  10           HB       ILE  10  -0.918  10.557  -1.247
   75   HG12  ILE  10          2HG1      ILE  10  -3.318   9.196  -0.351
   76   HG13  ILE  10          1HG1      ILE  10  -3.077   9.046  -2.064
   77   HG21  ILE  10          1HG2      ILE  10  -2.317  10.557   0.931
   78   HG22  ILE  10          2HG2      ILE  10  -3.290  11.767   0.096
   79   HG23  ILE  10          3HG2      ILE  10  -1.572  12.054   0.373
   80   HD11  ILE  10          3HD1      ILE  10  -0.992   8.019  -1.796
   81   HD12  ILE  10          1HD1      ILE  10  -2.090   7.251  -0.648
   82   HD13  ILE  10          2HD1      ILE  10  -0.941   8.467  -0.093
   83    H    HIS  11           H        HIS  11  -2.734  13.525  -0.846
   84    HA   HIS  11           HA       HIS  11  -0.326  14.836  -1.846
   85    HB2  HIS  11           2HB      HIS  11  -2.240  15.829  -3.064
   86    HB3  HIS  11           1HB      HIS  11  -3.032  16.178  -1.532
   87    HD2  HIS  11           2HD      HIS  11   0.511  17.163  -3.014
   88    HE1  HIS  11           1HE      HIS  11  -1.287  20.495  -1.129
   89    HE2  HIS  11           2HE      HIS  11   0.814  19.621  -2.243
   90    H    ARG  12           H        ARG  12   0.895  14.974  -0.102
   91    HA   ARG  12           HA       ARG  12  -0.062  14.709   2.533
   92    HB2  ARG  12           2HB      ARG  12   2.257  14.201   1.695
   93    HB3  ARG  12           1HB      ARG  12   2.558  15.933   1.692
   94    HG2  ARG  12           2HG      ARG  12   2.189  16.031   4.080
   95    HG3  ARG  12           1HG      ARG  12   1.789  14.309   4.105
   96    HD2  ARG  12           2HD      ARG  12   4.005  13.743   3.372
   97    HD3  ARG  12           1HD      ARG  12   4.419  15.446   3.198
   98    HE   ARG  12           HE       ARG  12   3.763  14.216   5.809
   99   HH11  ARG  12          1HH1      ARG  12   5.778  16.298   3.834
  100   HH12  ARG  12          2HH1      ARG  12   6.753  16.817   5.171
  101   HH21  ARG  12          1HH2      ARG  12   5.039  14.914   7.561
  102   HH22  ARG  12          2HH2      ARG  12   6.331  16.044   7.284
  103    H    ALA  13           H        ALA  13  -1.456  16.137   3.294
  104    HA   ALA  13           HA       ALA  13  -1.298  18.948   2.758
  105    HB1  ALA  13           1HB      ALA  13  -3.253  19.096   4.240
  106    HB2  ALA  13           2HB      ALA  13  -3.053  17.396   4.656
  107    HB3  ALA  13           3HB      ALA  13  -3.451  17.856   3.002
  108    H    GLY  14           H        GLY  14   1.095  18.295   3.852
  109    HA2  GLY  14           2HA      GLY  14   2.534  19.276   5.373
  110    HA3  GLY  14           1HA      GLY  14   1.147  19.983   6.184
  111    H    LYS  15           H        LYS  15   0.345  16.847   6.011
  112    HA   LYS  15           HA       LYS  15   1.729  16.203   8.526
  113    HB2  LYS  15           2HB      LYS  15  -0.477  14.752   8.850
  114    HB3  LYS  15           1HB      LYS  15  -0.376  16.428   9.360
  115    HG2  LYS  15           2HG      LYS  15  -1.588  17.173   7.468
  116    HG3  LYS  15           1HG      LYS  15  -1.468  15.596   6.689
  117    HD2  LYS  15           2HD      LYS  15  -3.691  15.902   7.622
  118    HD3  LYS  15           1HD      LYS  15  -2.840  14.619   8.481
  119    HE2  LYS  15           2HE      LYS  15  -2.388  16.063  10.336
  120    HE3  LYS  15           1HE      LYS  15  -2.983  17.468   9.458
  121    HZ1  LYS  15           3HZ      LYS  15  -5.196  16.391   9.430
  122    HZ2  LYS  15           1HZ      LYS  15  -4.650  16.761  10.983
  123    HZ3  LYS  15           2HZ      LYS  15  -4.589  15.164  10.426
  124    H    LYS  16           H        LYS  16  -0.417  14.226   6.492
  125    HA   LYS  16           HA       LYS  16   1.776  12.587   5.575
  126    HB2  LYS  16           2HB      LYS  16   0.525  10.523   6.568
  127    HB3  LYS  16           1HB      LYS  16   1.621  11.441   7.585
  128    HG2  LYS  16           2HG      LYS  16  -0.196  12.571   8.651
  129    HG3  LYS  16           1HG      LYS  16  -1.352  11.872   7.517
  130    HD2  LYS  16           2HD      LYS  16  -1.111   9.720   8.434
  131    HD3  LYS  16           1HD      LYS  16   0.368  10.166   9.291
  132    HE2  LYS  16           2HE      LYS  16  -0.826  11.490  10.843
  133    HE3  LYS  16           1HE      LYS  16  -2.300  11.421   9.877
  134    HZ1  LYS  16           3HZ      LYS  16  -2.766   9.308  10.560
  135    HZ2  LYS  16           1HZ      LYS  16  -1.995   9.893  11.949
  136    HZ3  LYS  16           2HZ      LYS  16  -1.145   8.913  10.866
  137    H    TYR  17           H        TYR  17   0.553  10.413   4.669
  138    HA   TYR  17           HA       TYR  17  -1.298  11.512   2.708
  139    HB2  TYR  17           2HB      TYR  17  -0.099   8.740   2.716
  140    HB3  TYR  17           1HB      TYR  17  -0.842   9.593   1.345
  141    HD1  TYR  17           1HD      TYR  17   2.131   9.381   3.513
  142    HD2  TYR  17           2HD      TYR  17   0.352  11.331   0.184
  143    HE1  TYR  17           1HE      TYR  17   4.302  10.370   2.950
  144    HE2  TYR  17           2HE      TYR  17   2.531  12.327  -0.401
  145    HH   TYR  17           HH       TYR  17   4.667  12.653   0.273
  146    H    GLY  18           H        GLY  18  -1.572  10.432   5.640
  147    HA2  GLY  18           2HA      GLY  18  -3.241   9.626   6.932
  148    HA3  GLY  18           1HA      GLY  18  -4.292  10.146   5.647
  149    H    PHE  19           H        PHE  19  -1.969   7.479   5.710
  150    HA   PHE  19           HA       PHE  19  -4.042   5.556   6.115
  151    HB2  PHE  19           2HB      PHE  19  -4.152   4.495   4.033
  152    HB3  PHE  19           1HB      PHE  19  -4.288   6.182   3.691
  153    HD1  PHE  19           2HD      PHE  19  -2.091   7.390   2.969
  154    HD2  PHE  19           1HD      PHE  19  -2.638   3.175   2.962
  155    HE1  PHE  19           2HE      PHE  19  -0.213   7.144   1.382
  156    HE2  PHE  19           1HE      PHE  19  -0.774   2.921   1.385
  157    HZ   PHE  19           HZ       PHE  19   0.441   4.910   0.591
  158    H    THR  20           H        THR  20  -3.461   3.556   6.455
  159    HA   THR  20           HA       THR  20  -0.664   3.149   7.260
  160    HB   THR  20           HB       THR  20  -3.150   1.526   7.845
  161    HG1  THR  20           1HG      THR  20  -2.582   3.838   8.757
  162   HG21  THR  20          3HG2      THR  20  -0.561   1.371   9.359
  163   HG22  THR  20          1HG2      THR  20  -0.875   0.343   7.963
  164   HG23  THR  20          2HG2      THR  20  -1.927   0.249   9.377
  165    H    LEU  21           H        LEU  21   0.698   2.134   5.837
  166    HA   LEU  21           HA       LEU  21  -0.397   0.294   3.859
  167    HB2  LEU  21           2HB      LEU  21   1.574   2.128   3.592
  168    HB3  LEU  21           1HB      LEU  21   2.533   0.731   3.988
  169    HG   LEU  21           HG       LEU  21   2.261  -0.189   1.966
  170   HD11  LEU  21          1HD1      LEU  21   0.150  -0.155   0.676
  171   HD12  LEU  21          2HD1      LEU  21  -0.580   0.818   1.952
  172   HD13  LEU  21          3HD1      LEU  21  -0.041  -0.826   2.296
  173   HD21  LEU  21          3HD2      LEU  21   1.177   2.522   1.260
  174   HD22  LEU  21          1HD2      LEU  21   2.008   1.397   0.188
  175   HD23  LEU  21          2HD2      LEU  21   2.879   2.153   1.523
  176    H    ARG  22           H        ARG  22  -0.957  -1.419   5.306
  177    HA   ARG  22           HA       ARG  22   1.036  -2.706   6.921
  178    HB2  ARG  22           2HB      ARG  22  -1.773  -2.852   6.632
  179    HB3  ARG  22           1HB      ARG  22  -1.149  -4.460   6.296
  180    HG2  ARG  22           2HG      ARG  22  -1.718  -4.188   8.648
  181    HG3  ARG  22           1HG      ARG  22   0.009  -4.480   8.430
  182    HD2  ARG  22           2HD      ARG  22   0.550  -2.229   8.852
  183    HD3  ARG  22           1HD      ARG  22  -1.125  -1.707   8.657
  184    HE   ARG  22           HE       ARG  22  -1.228  -3.422  10.760
  185   HH11  ARG  22          1HH1      ARG  22   0.739  -0.609  10.059
  186   HH12  ARG  22          2HH1      ARG  22   0.858  -0.127  11.721
  187   HH21  ARG  22          1HH2      ARG  22  -1.060  -2.799  12.939
  188   HH22  ARG  22          2HH2      ARG  22  -0.159  -1.375  13.357
  189    H    ALA  23           H        ALA  23   2.119  -4.623   6.544
  190    HA   ALA  23           HA       ALA  23   2.372  -5.396   3.733
  191    HB1  ALA  23           1HB      ALA  23   4.189  -6.241   5.968
  192    HB2  ALA  23           2HB      ALA  23   4.375  -4.688   5.144
  193    HB3  ALA  23           3HB      ALA  23   4.525  -6.197   4.237
  194    H    ILE  24           H        ILE  24   2.184  -7.529   3.063
  195    HA   ILE  24           HA       ILE  24   1.543  -9.572   5.043
  196    HB   ILE  24           HB       ILE  24  -0.367 -10.368   3.618
  197   HG12  ILE  24          2HG1      ILE  24  -0.407  -7.561   2.524
  198   HG13  ILE  24          1HG1      ILE  24   0.290  -8.914   1.642
  199   HG21  ILE  24          1HG2      ILE  24  -0.797  -9.318   5.735
  200   HG22  ILE  24          2HG2      ILE  24  -1.997  -8.770   4.564
  201   HG23  ILE  24          3HG2      ILE  24  -0.654  -7.716   5.008
  202   HD11  ILE  24          3HD1      ILE  24  -1.850 -10.039   1.613
  203   HD12  ILE  24          1HD1      ILE  24  -2.002  -8.416   0.937
  204   HD13  ILE  24          2HD1      ILE  24  -2.564  -8.747   2.577
  205    H    ARG  25           H        ARG  25   2.196 -11.603   4.436
  206    HA   ARG  25           HA       ARG  25   3.541 -11.765   1.814
  207    HB2  ARG  25           2HB      ARG  25   4.113 -13.531   4.188
  208    HB3  ARG  25           1HB      ARG  25   5.077 -13.329   2.735
  209    HG2  ARG  25           2HG      ARG  25   5.524 -10.984   3.419
  210    HG3  ARG  25           1HG      ARG  25   4.674 -11.314   4.932
  211    HD2  ARG  25           2HD      ARG  25   6.381 -13.382   4.923
  212    HD3  ARG  25           1HD      ARG  25   7.335 -12.216   4.007
  213    HE   ARG  25           HE       ARG  25   6.330 -10.947   6.293
  214   HH11  ARG  25          1HH1      ARG  25   8.676 -13.396   5.383
  215   HH12  ARG  25          2HH1      ARG  25   9.650 -13.154   6.797
  216   HH21  ARG  25          1HH2      ARG  25   7.591 -10.685   8.180
  217   HH22  ARG  25          2HH2      ARG  25   9.026 -11.638   8.390
  218    H    VAL  26           H        VAL  26   2.085 -12.665   0.473
  219    HA   VAL  26           HA       VAL  26   0.417 -14.864   1.354
  220    HB   VAL  26           HB       VAL  26  -0.305 -14.867  -1.104
  221   HG11  VAL  26          1HG1      VAL  26  -1.770 -12.922  -0.768
  222   HG12  VAL  26          2HG1      VAL  26  -0.755 -12.394   0.572
  223   HG13  VAL  26          3HG1      VAL  26  -1.657 -13.905   0.692
  224   HG21  VAL  26          3HG2      VAL  26   0.118 -12.826  -2.358
  225   HG22  VAL  26          1HG2      VAL  26   1.623 -13.674  -2.003
  226   HG23  VAL  26          2HG2      VAL  26   1.175 -12.246  -1.072
  227    H    TYR  27           H        TYR  27   1.169 -16.881   1.402
  228    HA   TYR  27           HA       TYR  27   3.520 -17.607  -0.112
  229    HB2  TYR  27           2HB      TYR  27   1.789 -18.968   1.910
  230    HB3  TYR  27           1HB      TYR  27   2.846 -19.945   0.898
  231    HD1  TYR  27           2HD      TYR  27   3.127 -16.761   2.864
  232    HD2  TYR  27           1HD      TYR  27   4.840 -20.524   1.871
  233    HE1  TYR  27           2HE      TYR  27   4.996 -16.309   4.398
  234    HE2  TYR  27           1HE      TYR  27   6.708 -20.086   3.407
  235    HH   TYR  27           HH       TYR  27   7.840 -18.189   4.440
  236    H    MET  28           H        MET  28   3.629 -19.179  -1.735
  237    HA   MET  28           HA       MET  28   1.214 -19.344  -3.349
  238    HB2  MET  28           2HB      MET  28   3.979 -20.375  -3.968
  239    HB3  MET  28           1HB      MET  28   2.664 -20.189  -5.105
  240    HG2  MET  28           2HG      MET  28   2.753 -17.791  -4.697
  241    HG3  MET  28           1HG      MET  28   4.152 -18.024  -3.670
  242    HE1  MET  28           3HE      MET  28   5.603 -16.313  -5.089
  243    HE2  MET  28           1HE      MET  28   4.185 -15.995  -6.088
  244    HE3  MET  28           2HE      MET  28   5.732 -16.373  -6.848
  245    H    GLY  29           H        GLY  29   0.418 -20.674  -1.406
  246    HA2  GLY  29           2HA      GLY  29  -0.486 -22.716  -0.827
  247    HA3  GLY  29           1HA      GLY  29   0.320 -23.423  -2.223
  248    H    ASP  30           H        ASP  30   1.405 -25.133  -1.430
  249    HA   ASP  30           HA       ASP  30   2.851 -24.847   1.084
  250    HB2  ASP  30           2HB      ASP  30   1.570 -26.935   0.665
  251    HB3  ASP  30           1HB      ASP  30   2.619 -27.276  -0.711
  252    H    SER  31           H        SER  31   4.404 -23.364   0.428
  253    HA   SER  31           HA       SER  31   6.761 -24.534  -0.691
  254    HB2  SER  31           2HB      SER  31   6.950 -22.761  -2.494
  255    HB3  SER  31           1HB      SER  31   5.749 -24.013  -2.799
  256    HG   SER  31           HG       SER  31   4.234 -22.551  -2.733
  257    H    ASP  32           H        ASP  32   8.586 -22.967  -0.625
  258    HA   ASP  32           HA       ASP  32   8.362 -21.337   1.746
  259    HB2  ASP  32           2HB      ASP  32  10.343 -22.753   1.360
  260    HB3  ASP  32           1HB      ASP  32  10.721 -21.815  -0.079
  261    H    VAL  33           H        VAL  33   8.071 -20.893  -1.574
  262    HA   VAL  33           HA       VAL  33   8.932 -18.163  -1.656
  263    HB   VAL  33           HB       VAL  33   9.176 -19.556  -3.647
  264   HG11  VAL  33          1HG1      VAL  33   7.163 -20.125  -4.996
  265   HG12  VAL  33          2HG1      VAL  33   6.169 -19.680  -3.609
  266   HG13  VAL  33          3HG1      VAL  33   7.302 -21.025  -3.486
  267   HG21  VAL  33          3HG2      VAL  33   8.075 -18.010  -5.290
  268   HG22  VAL  33          1HG2      VAL  33   9.064 -17.223  -4.061
  269   HG23  VAL  33          2HG2      VAL  33   7.307 -17.216  -3.917
  270    H    TYR  34           H        TYR  34   7.727 -16.399  -1.641
  271    HA   TYR  34           HA       TYR  34   4.831 -16.536  -1.592
  272    HB2  TYR  34           2HB      TYR  34   4.683 -15.270   0.534
  273    HB3  TYR  34           1HB      TYR  34   5.382 -16.869   0.765
  274    HD1  TYR  34           1HD      TYR  34   6.063 -13.261   0.739
  275    HD2  TYR  34           2HD      TYR  34   7.687 -17.130   1.443
  276    HE1  TYR  34           1HE      TYR  34   8.002 -12.238   1.850
  277    HE2  TYR  34           2HE      TYR  34   9.626 -16.111   2.561
  278    HH   TYR  34           HH       TYR  34  10.818 -13.791   2.417
  279    H    THR  35           H        THR  35   3.849 -14.432  -1.851
  280    HA   THR  35           HA       THR  35   5.714 -12.519  -3.078
  281    HB   THR  35           HB       THR  35   2.928 -11.878  -3.450
  282    HG1  THR  35           1HG      THR  35   2.300 -13.725  -4.549
  283   HG21  THR  35          3HG2      THR  35   5.121 -12.668  -5.362
  284   HG22  THR  35          1HG2      THR  35   4.724 -11.028  -4.852
  285   HG23  THR  35          2HG2      THR  35   3.577 -11.953  -5.822
  286    H    VAL  36           H        VAL  36   6.051 -10.607  -2.175
  287    HA   VAL  36           HA       VAL  36   4.730 -10.003   0.341
  288    HB   VAL  36           HB       VAL  36   6.812  -8.236  -0.904
  289   HG11  VAL  36          1HG1      VAL  36   5.641  -7.494   1.122
  290   HG12  VAL  36          2HG1      VAL  36   7.358  -7.765   1.420
  291   HG13  VAL  36          3HG1      VAL  36   6.172  -8.955   1.958
  292   HG21  VAL  36          3HG2      VAL  36   7.773 -10.439  -1.084
  293   HG22  VAL  36          1HG2      VAL  36   7.320 -10.815   0.577
  294   HG23  VAL  36          2HG2      VAL  36   8.543  -9.588   0.254
  295    H    HIS  37           H        HIS  37   2.819  -9.046   0.183
  296    HA   HIS  37           HA       HIS  37   2.508  -6.876  -1.783
  297    HB2  HIS  37           2HB      HIS  37   0.411  -8.689  -0.564
  298    HB3  HIS  37           1HB      HIS  37   0.039  -7.276  -1.539
  299    HD2  HIS  37           2HD      HIS  37  -0.309 -10.686  -2.179
  300    HE1  HIS  37           1HE      HIS  37   1.864  -9.429  -5.578
  301    HE2  HIS  37           2HE      HIS  37   0.602 -11.346  -4.512
  302    H    HIS  38           H        HIS  38   0.548  -5.424  -0.942
  303    HA   HIS  38           HA       HIS  38   0.738  -4.872   1.906
  304    HB2  HIS  38           2HB      HIS  38   1.499  -2.808  -0.187
  305    HB3  HIS  38           1HB      HIS  38   1.276  -2.478   1.525
  306    HD2  HIS  38           2HD      HIS  38   4.004  -3.363  -0.884
  307    HE1  HIS  38           1HE      HIS  38   5.431  -4.367   2.962
  308    HE2  HIS  38           2HE      HIS  38   5.968  -4.368   0.492
  309    H    MET  39           H        MET  39  -0.956  -3.482   2.621
  310    HA   MET  39           HA       MET  39  -3.008  -2.765   0.673
  311    HB2  MET  39           2HB      MET  39  -3.647  -4.528   3.046
  312    HB3  MET  39           1HB      MET  39  -4.787  -3.926   1.858
  313    HG2  MET  39           2HG      MET  39  -3.606  -5.264   0.136
  314    HG3  MET  39           1HG      MET  39  -2.603  -5.941   1.412
  315    HE1  MET  39           3HE      MET  39  -5.320  -7.765   3.612
  316    HE2  MET  39           1HE      MET  39  -5.053  -6.027   3.745
  317    HE3  MET  39           2HE      MET  39  -3.680  -7.119   3.562
  318    H    VAL  40           H        VAL  40  -4.388  -1.160   1.408
  319    HA   VAL  40           HA       VAL  40  -3.345   0.416   3.546
  320    HB   VAL  40           HB       VAL  40  -4.261   1.627   1.712
  321   HG11  VAL  40          1HG1      VAL  40  -6.708   1.506   1.186
  322   HG12  VAL  40          2HG1      VAL  40  -6.774   0.049   2.177
  323   HG13  VAL  40          3HG1      VAL  40  -5.760   0.091   0.731
  324   HG21  VAL  40          3HG2      VAL  40  -4.703   2.369   4.143
  325   HG22  VAL  40          1HG2      VAL  40  -6.383   1.967   3.793
  326   HG23  VAL  40          2HG2      VAL  40  -5.553   3.191   2.831
  327    H    TRP  41           H        TRP  41  -3.527  -0.327   5.473
  328    HA   TRP  41           HA       TRP  41  -5.594  -2.013   6.438
  329    HB2  TRP  41           2HB      TRP  41  -3.073  -1.471   7.202
  330    HB3  TRP  41           1HB      TRP  41  -3.951  -0.472   8.353
  331    HD1  TRP  41           HD       TRP  41  -4.359  -1.670  10.523
  332    HE1  TRP  41           1HE      TRP  41  -4.770  -4.101  11.258
  333    HE3  TRP  41           3HE      TRP  41  -4.189  -3.927   5.944
  334    HZ2  TRP  41           2HZ      TRP  41  -5.000  -6.652  10.033
  335    HZ3  TRP  41           3HZ      TRP  41  -4.509  -6.361   5.812
  336    HH2  TRP  41           HH       TRP  41  -4.903  -7.689   7.820
  337    H    HIS  42           H        HIS  42  -4.884   1.393   6.755
  338    HA   HIS  42           HA       HIS  42  -7.639   1.990   7.373
  339    HB2  HIS  42           2HB      HIS  42  -6.185   1.449   9.539
  340    HB3  HIS  42           1HB      HIS  42  -5.693   3.117   9.322
  341    HD2  HIS  42           2HD      HIS  42  -7.923   4.975   9.312
  342    HE1  HIS  42           1HE      HIS  42 -10.269   2.365  11.673
  343    HE2  HIS  42           2HE      HIS  42 -10.114   4.685  10.665
  344    H    VAL  43           H        VAL  43  -8.132   3.839   6.419
  345    HA   VAL  43           HA       VAL  43  -5.949   5.729   5.931
  346    HB   VAL  43           HB       VAL  43  -6.381   4.690   3.830
  347   HG11  VAL  43          1HG1      VAL  43  -8.551   3.769   4.237
  348   HG12  VAL  43          2HG1      VAL  43  -8.581   4.746   2.770
  349   HG13  VAL  43          3HG1      VAL  43  -9.260   5.382   4.267
  350   HG21  VAL  43          3HG2      VAL  43  -5.974   7.091   3.763
  351   HG22  VAL  43          1HG2      VAL  43  -7.712   7.385   3.889
  352   HG23  VAL  43          2HG2      VAL  43  -7.063   6.583   2.462
  353    H    GLU  44           H        GLU  44  -6.245   7.649   6.597
  354    HA   GLU  44           HA       GLU  44  -8.505   8.388   8.135
  355    HB2  GLU  44           2HB      GLU  44  -5.895   9.567   7.375
  356    HB3  GLU  44           1HB      GLU  44  -7.143  10.669   7.915
  357    HG2  GLU  44           2HG      GLU  44  -7.205   9.785  10.043
  358    HG3  GLU  44           1HG      GLU  44  -6.546   8.237   9.519
  359    H    ASP  45           H        ASP  45 -10.314   9.273   7.512
  360    HA   ASP  45           HA       ASP  45 -10.666  10.214   4.795
  361    HB2  ASP  45           2HB      ASP  45 -13.051  10.348   5.409
  362    HB3  ASP  45           1HB      ASP  45 -12.370   8.767   5.772
  363    H    GLY  46           H        GLY  46  -9.123  11.705   6.941
  364    HA2  GLY  46           2HA      GLY  46 -10.674  14.079   7.434
  365    HA3  GLY  46           1HA      GLY  46  -8.995  13.819   7.870
  366    H    GLY  47           H        GLY  47  -8.571  13.051   4.870
  367    HA2  GLY  47           2HA      GLY  47  -9.129  15.190   3.244
  368    HA3  GLY  47           1HA      GLY  47  -7.730  15.695   4.164
  369    HA   PRO  48           HA       PRO  48  -4.819  13.422   1.707
  370    HB2  PRO  48           2HB      PRO  48  -4.659  11.121   3.587
  371    HB3  PRO  48           1HB      PRO  48  -3.365  12.097   2.887
  372    HG2  PRO  48           2HG      PRO  48  -4.042  12.497   5.382
  373    HG3  PRO  48           1HG      PRO  48  -3.830  13.909   4.322
  374    HD2  PRO  48           2HD      PRO  48  -6.377  12.552   5.165
  375    HD3  PRO  48           1HD      PRO  48  -5.971  14.279   5.152
  376    H    ALA  49           H        ALA  49  -4.467  10.391   2.051
  377    HA   ALA  49           HA       ALA  49  -5.222   9.479  -0.333
  378    HB1  ALA  49           1HB      ALA  49  -4.210   7.665   0.383
  379    HB2  ALA  49           2HB      ALA  49  -5.533   7.292   1.493
  380    HB3  ALA  49           3HB      ALA  49  -4.209   8.334   2.022
  381    H    SER  50           H        SER  50  -7.440   9.437   2.472
  382    HA   SER  50           HA       SER  50  -9.380   7.794   1.238
  383    HB2  SER  50           2HB      SER  50  -9.228   9.491   3.613
  384    HB3  SER  50           1HB      SER  50 -10.844   9.364   2.926
  385    HG   SER  50           HG       SER  50  -9.984   6.942   2.875
  386    H    GLU  51           H        GLU  51  -9.430  11.323   1.675
  387    HA   GLU  51           HA       GLU  51 -11.717  11.739   0.077
  388    HB2  GLU  51           2HB      GLU  51  -9.530  13.720   0.710
  389    HB3  GLU  51           1HB      GLU  51 -11.177  14.097   0.216
  390    HG2  GLU  51           2HG      GLU  51 -11.495  12.472   2.423
  391    HG3  GLU  51           1HG      GLU  51 -10.117  13.489   2.836
  392    H    ALA  52           H        ALA  52  -8.429  11.249  -0.645
  393    HA   ALA  52           HA       ALA  52  -8.374  12.432  -3.232
  394    HB1  ALA  52           1HB      ALA  52  -6.582  10.164  -2.532
  395    HB2  ALA  52           2HB      ALA  52  -6.441  11.667  -1.621
  396    HB3  ALA  52           3HB      ALA  52  -6.216  11.671  -3.372
  397    H    GLY  53           H        GLY  53  -9.469   9.393  -1.954
  398    HA2  GLY  53           2HA      GLY  53 -11.167   8.440  -3.611
  399    HA3  GLY  53           1HA      GLY  53  -9.783   8.344  -4.681
  400    H    LEU  54           H        LEU  54  -8.286   7.701  -1.966
  401    HA   LEU  54           HA       LEU  54  -8.227   4.900  -2.443
  402    HB2  LEU  54           2HB      LEU  54  -6.431   6.542  -1.400
  403    HB3  LEU  54           1HB      LEU  54  -7.157   6.014   0.099
  404    HG   LEU  54           HG       LEU  54  -5.872   4.246  -1.979
  405   HD11  LEU  54          1HD1      LEU  54  -4.201   5.446  -0.749
  406   HD12  LEU  54          2HD1      LEU  54  -4.260   3.791  -0.137
  407   HD13  LEU  54          3HD1      LEU  54  -5.012   5.097   0.779
  408   HD21  LEU  54          3HD2      LEU  54  -6.980   3.492   0.698
  409   HD22  LEU  54          1HD2      LEU  54  -6.234   2.422  -0.487
  410   HD23  LEU  54          2HD2      LEU  54  -7.778   3.195  -0.843
  411    H    ARG  55           H        ARG  55  -9.660   3.519  -1.866
  412    HA   ARG  55           HA       ARG  55 -11.356   4.025   0.458
  413    HB2  ARG  55           2HB      ARG  55 -12.643   2.026  -0.379
  414    HB3  ARG  55           1HB      ARG  55 -12.626   3.409  -1.459
  415    HG2  ARG  55           2HG      ARG  55 -12.147   1.892  -3.026
  416    HG3  ARG  55           1HG      ARG  55 -10.505   2.001  -2.393
  417    HD2  ARG  55           2HD      ARG  55 -11.209  -0.324  -2.609
  418    HD3  ARG  55           1HD      ARG  55 -10.936   0.101  -0.922
  419    HE   ARG  55           HE       ARG  55 -13.415   0.330  -0.757
  420   HH11  ARG  55          1HH1      ARG  55 -12.026  -1.654  -3.295
  421   HH12  ARG  55          2HH1      ARG  55 -13.391  -2.721  -3.372
  422   HH21  ARG  55          1HH2      ARG  55 -15.220  -1.072  -0.883
  423   HH22  ARG  55          2HH2      ARG  55 -15.190  -2.400  -2.003
  424    H    GLN  56           H        GLN  56 -10.899   3.129   2.355
  425    HA   GLN  56           HA       GLN  56  -8.725   1.589   2.972
  426    HB2  GLN  56           2HB      GLN  56 -10.308   2.745   4.546
  427    HB3  GLN  56           1HB      GLN  56 -11.352   1.356   4.410
  428    HG2  GLN  56           2HG      GLN  56  -9.852   0.021   5.490
  429    HG3  GLN  56           1HG      GLN  56  -8.503   1.108   5.242
  430   HE21  GLN  56          1HE2      GLN  56  -9.754  -0.113   7.687
  431   HE22  GLN  56          2HE2      GLN  56 -10.062   1.233   8.732
  432    H    GLY  57           H        GLY  57  -8.249  -0.577   3.240
  433    HA2  GLY  57           2HA      GLY  57  -8.631  -2.884   3.196
  434    HA3  GLY  57           1HA      GLY  57 -10.267  -2.583   2.624
  435    H    ASP  58           H        ASP  58  -8.145  -0.764   0.812
  436    HA   ASP  58           HA       ASP  58  -8.414  -2.559  -1.456
  437    HB2  ASP  58           2HB      ASP  58  -8.598   0.113  -1.305
  438    HB3  ASP  58           1HB      ASP  58  -6.888  -0.025  -1.700
  439    H    LEU  59           H        LEU  59  -6.742  -3.468  -2.598
  440    HA   LEU  59           HA       LEU  59  -4.250  -3.782  -1.105
  441    HB2  LEU  59           2HB      LEU  59  -5.033  -5.877  -1.748
  442    HB3  LEU  59           1HB      LEU  59  -5.601  -5.303  -3.302
  443    HG   LEU  59           HG       LEU  59  -3.045  -4.969  -3.792
  444   HD11  LEU  59          1HD1      LEU  59  -2.231  -5.468  -1.571
  445   HD12  LEU  59          2HD1      LEU  59  -1.665  -6.690  -2.711
  446   HD13  LEU  59          3HD1      LEU  59  -3.000  -7.056  -1.618
  447   HD21  LEU  59          3HD2      LEU  59  -4.470  -7.619  -3.767
  448   HD22  LEU  59          1HD2      LEU  59  -2.949  -7.322  -4.608
  449   HD23  LEU  59          2HD2      LEU  59  -4.403  -6.442  -5.079
  450    H    ILE  60           H        ILE  60  -2.330  -3.009  -1.788
  451    HA   ILE  60           HA       ILE  60  -2.406  -1.173  -4.050
  452    HB   ILE  60           HB       ILE  60  -0.329  -1.582  -1.891
  453   HG12  ILE  60          2HG1      ILE  60  -0.969   0.863  -1.439
  454   HG13  ILE  60          1HG1      ILE  60  -2.373   0.562  -2.451
  455   HG21  ILE  60          1HG2      ILE  60   0.834   0.354  -2.841
  456   HG22  ILE  60          2HG2      ILE  60  -0.326   0.396  -4.171
  457   HG23  ILE  60          3HG2      ILE  60   0.759  -0.982  -3.990
  458   HD11  ILE  60          3HD1      ILE  60  -1.697  -0.972   0.047
  459   HD12  ILE  60          1HD1      ILE  60  -3.163  -1.117  -0.923
  460   HD13  ILE  60          2HD1      ILE  60  -2.836   0.377  -0.040
  461    H    THR  61           H        THR  61  -1.596  -1.674  -5.954
  462    HA   THR  61           HA       THR  61   0.015  -4.113  -6.199
  463    HB   THR  61           HB       THR  61  -0.617  -4.131  -8.543
  464    HG1  THR  61           1HG      THR  61  -0.767  -2.045  -9.182
  465   HG21  THR  61          3HG2      THR  61  -3.051  -3.482  -6.872
  466   HG22  THR  61          1HG2      THR  61  -2.218  -5.038  -6.862
  467   HG23  THR  61          2HG2      THR  61  -3.001  -4.470  -8.337
  468    H    HIS  62           H        HIS  62  -0.027  -0.684  -6.971
  469    HA   HIS  62           HA       HIS  62   2.860  -0.776  -7.476
  470    HB2  HIS  62           2HB      HIS  62   0.869   0.598  -9.291
  471    HB3  HIS  62           1HB      HIS  62   2.612   0.702  -9.430
  472    HD2  HIS  62           2HD      HIS  62   3.870  -1.637 -10.389
  473    HE1  HIS  62           1HE      HIS  62   0.253  -3.369 -11.729
  474    HE2  HIS  62           2HE      HIS  62   2.777  -3.381 -11.967
  475    H    VAL  63           H        VAL  63   3.897   1.285  -7.261
  476    HA   VAL  63           HA       VAL  63   2.303   3.475  -6.200
  477    HB   VAL  63           HB       VAL  63   3.001   2.210  -4.209
  478   HG11  VAL  63          1HG1      VAL  63   5.057   1.211  -5.090
  479   HG12  VAL  63          2HG1      VAL  63   5.331   2.037  -3.556
  480   HG13  VAL  63          3HG1      VAL  63   5.830   2.797  -5.066
  481   HG21  VAL  63          3HG2      VAL  63   4.457   4.197  -3.237
  482   HG22  VAL  63          1HG2      VAL  63   2.743   4.393  -3.614
  483   HG23  VAL  63          2HG2      VAL  63   3.965   4.964  -4.749
  484    H    ASN  64           H        ASN  64   2.875   5.273  -7.191
  485    HA   ASN  64           HA       ASN  64   4.021   6.777  -8.471
  486    HB2  ASN  64           2HB      ASN  64   5.495   6.493  -6.294
  487    HB3  ASN  64           1HB      ASN  64   6.631   5.753  -7.416
  488   HD21  ASN  64          1HD2      ASN  64   7.107   8.101  -5.956
  489   HD22  ASN  64          2HD2      ASN  64   7.273   9.415  -7.070
  490    H    GLY  65           H        GLY  65   3.593   4.020  -9.480
  491    HA2  GLY  65           2HA      GLY  65   4.007   2.963 -11.495
  492    HA3  GLY  65           1HA      GLY  65   5.187   4.212 -11.852
  493    H    GLU  66           H        GLU  66   5.057   2.022  -9.121
  494    HA   GLU  66           HA       GLU  66   7.315   0.505 -10.052
  495    HB2  GLU  66           2HB      GLU  66   7.871   2.673  -8.677
  496    HB3  GLU  66           1HB      GLU  66   7.408   1.679  -7.311
  497    HG2  GLU  66           2HG      GLU  66   9.820   1.649  -7.663
  498    HG3  GLU  66           1HG      GLU  66   9.103   0.049  -7.850
  499    HA   PRO  67           HA       PRO  67   4.318  -2.508  -8.427
  500    HB2  PRO  67           2HB      PRO  67   6.785  -4.120  -8.772
  501    HB3  PRO  67           1HB      PRO  67   5.148  -4.435  -9.349
  502    HG2  PRO  67           2HG      PRO  67   7.226  -3.479 -10.903
  503    HG3  PRO  67           1HG      PRO  67   5.507  -3.340 -11.294
  504    HD2  PRO  67           2HD      PRO  67   7.342  -1.250 -10.563
  505    HD3  PRO  67           1HD      PRO  67   5.665  -1.106 -11.070
  506    H    VAL  68           H        VAL  68   3.994  -2.926  -6.423
  507    HA   VAL  68           HA       VAL  68   6.045  -2.412  -4.433
  508    HB   VAL  68           HB       VAL  68   4.271  -2.599  -2.769
  509   HG11  VAL  68          1HG1      VAL  68   3.534  -0.889  -5.143
  510   HG12  VAL  68          2HG1      VAL  68   4.551  -0.431  -3.777
  511   HG13  VAL  68          3HG1      VAL  68   2.830  -0.722  -3.534
  512   HG21  VAL  68          3HG2      VAL  68   2.968  -4.372  -3.805
  513   HG22  VAL  68          1HG2      VAL  68   2.469  -3.270  -5.088
  514   HG23  VAL  68          2HG2      VAL  68   1.948  -2.984  -3.427
  515    H    HIS  69           H        HIS  69   4.824  -4.834  -6.161
  516    HA   HIS  69           HA       HIS  69   4.635  -7.065  -4.607
  517    HB2  HIS  69           2HB      HIS  69   5.348  -6.437  -7.442
  518    HB3  HIS  69           1HB      HIS  69   5.357  -8.074  -6.875
  519    HD2  HIS  69           2HD      HIS  69   2.570  -5.736  -5.585
  520    HE1  HIS  69           1HE      HIS  69   0.898  -8.438  -8.384
  521    HE2  HIS  69           2HE      HIS  69   0.395  -6.826  -6.501
  522    H    GLY  70           H        GLY  70   6.215  -7.331  -3.055
  523    HA2  GLY  70           2HA      GLY  70   8.212  -8.705  -2.736
  524    HA3  GLY  70           1HA      GLY  70   8.930  -7.861  -4.099
  525    H    LEU  71           H        LEU  71   7.520  -5.381  -2.766
  526    HA   LEU  71           HA       LEU  71   9.904  -4.474  -1.451
  527    HB2  LEU  71           2HB      LEU  71   7.170  -3.213  -1.683
  528    HB3  LEU  71           1HB      LEU  71   8.563  -2.424  -0.973
  529    HG   LEU  71           HG       LEU  71   8.159  -3.184  -3.866
  530   HD11  LEU  71          1HD1      LEU  71   7.059  -1.138  -3.185
  531   HD12  LEU  71          2HD1      LEU  71   8.450  -0.761  -4.201
  532   HD13  LEU  71          3HD1      LEU  71   8.550  -0.545  -2.451
  533   HD21  LEU  71          3HD2      LEU  71  10.454  -3.685  -3.360
  534   HD22  LEU  71          1HD2      LEU  71  10.642  -2.165  -2.484
  535   HD23  LEU  71          2HD2      LEU  71  10.397  -2.153  -4.230
  536    H    VAL  72           H        VAL  72  10.210  -4.031   0.734
  537    HA   VAL  72           HA       VAL  72   8.641  -5.647   2.532
  538    HB   VAL  72           HB       VAL  72  11.249  -4.951   2.523
  539   HG11  VAL  72          1HG1      VAL  72  10.571  -2.591   3.175
  540   HG12  VAL  72          2HG1      VAL  72  11.830  -3.361   4.137
  541   HG13  VAL  72          3HG1      VAL  72  10.184  -3.257   4.760
  542   HG21  VAL  72          3HG2      VAL  72   9.684  -5.617   5.010
  543   HG22  VAL  72          1HG2      VAL  72  11.402  -5.900   4.739
  544   HG23  VAL  72          2HG2      VAL  72  10.205  -6.774   3.785
  545    H    HIS  73           H        HIS  73   7.956  -4.634   4.687
  546    HA   HIS  73           HA       HIS  73   5.787  -3.006   4.424
  547    HB2  HIS  73           2HB      HIS  73   6.799  -4.296   6.490
  548    HB3  HIS  73           1HB      HIS  73   7.459  -2.726   6.888
  549    HD1  HIS  73           1HD      HIS  73   4.574  -4.727   7.532
  550    HD2  HIS  73           2HD      HIS  73   5.288  -0.680   6.962
  551    HE1  HIS  73           1HE      HIS  73   2.596  -3.518   8.529
  552    H    THR  74           H        THR  74   9.023  -1.940   5.353
  553    HA   THR  74           HA       THR  74   8.224   0.815   5.437
  554    HB   THR  74           HB       THR  74  10.415   1.256   6.248
  555    HG1  THR  74           1HG      THR  74  11.550  -1.203   6.053
  556   HG21  THR  74          3HG2      THR  74   9.002   0.110   7.846
  557   HG22  THR  74          1HG2      THR  74  10.657  -0.481   8.023
  558   HG23  THR  74          2HG2      THR  74   9.453  -1.462   7.174
  559    H    GLU  75           H        GLU  75   9.309  -1.259   2.964
  560    HA   GLU  75           HA       GLU  75  10.834   0.617   1.476
  561    HB2  GLU  75           2HB      GLU  75   9.650  -2.055   0.926
  562    HB3  GLU  75           1HB      GLU  75  10.142  -1.054  -0.430
  563    HG2  GLU  75           2HG      GLU  75  12.382  -0.831   0.791
  564    HG3  GLU  75           1HG      GLU  75  11.830  -2.201   1.752
  565    H    VAL  76           H        VAL  76   7.421  -0.399   1.366
  566    HA   VAL  76           HA       VAL  76   6.770   1.190  -0.887
  567    HB   VAL  76           HB       VAL  76   4.396   1.070   0.002
  568   HG11  VAL  76          1HG1      VAL  76   5.842  -1.537  -0.349
  569   HG12  VAL  76          2HG1      VAL  76   5.387  -0.449  -1.661
  570   HG13  VAL  76          3HG1      VAL  76   4.138  -1.215  -0.678
  571   HG21  VAL  76          3HG2      VAL  76   4.196   0.629   2.195
  572   HG22  VAL  76          1HG2      VAL  76   5.812  -0.090   2.281
  573   HG23  VAL  76          2HG2      VAL  76   4.452  -1.054   1.707
  574    H    VAL  77           H        VAL  77   6.545   1.726   2.570
  575    HA   VAL  77           HA       VAL  77   5.514   4.260   2.695
  576    HB   VAL  77           HB       VAL  77   7.667   3.037   4.393
  577   HG11  VAL  77          1HG1      VAL  77   6.030   5.513   4.796
  578   HG12  VAL  77          2HG1      VAL  77   7.783   5.340   4.845
  579   HG13  VAL  77          3HG1      VAL  77   6.793   4.658   6.136
  580   HG21  VAL  77          3HG2      VAL  77   6.010   2.179   5.766
  581   HG22  VAL  77          1HG2      VAL  77   5.346   1.937   4.153
  582   HG23  VAL  77          2HG2      VAL  77   4.785   3.284   5.143
  583    H    GLU  78           H        GLU  78   8.919   3.320   2.395
  584    HA   GLU  78           HA       GLU  78  10.010   5.884   2.219
  585    HB2  GLU  78           2HB      GLU  78  10.916   3.204   1.214
  586    HB3  GLU  78           1HB      GLU  78  11.866   4.656   0.920
  587    HG2  GLU  78           2HG      GLU  78  11.897   5.051   3.368
  588    HG3  GLU  78           1HG      GLU  78  11.098   3.495   3.584
  589    H    LEU  79           H        LEU  79   8.908   3.696  -0.335
  590    HA   LEU  79           HA       LEU  79   9.588   5.189  -2.573
  591    HB2  LEU  79           2HB      LEU  79   8.040   2.908  -2.024
  592    HB3  LEU  79           1HB      LEU  79   6.968   3.998  -2.880
  593    HG   LEU  79           HG       LEU  79   8.038   2.458  -4.427
  594   HD11  LEU  79          1HD1      LEU  79   7.527   4.750  -5.181
  595   HD12  LEU  79          2HD1      LEU  79   8.895   4.035  -6.031
  596   HD13  LEU  79          3HD1      LEU  79   9.174   5.230  -4.764
  597   HD21  LEU  79          3HD2      LEU  79  10.075   2.086  -3.048
  598   HD22  LEU  79          1HD2      LEU  79  10.669   3.660  -3.579
  599   HD23  LEU  79          2HD2      LEU  79  10.407   2.373  -4.755
  600    H    ILE  80           H        ILE  80   6.775   5.419  -0.473
  601    HA   ILE  80           HA       ILE  80   5.453   7.427  -1.990
  602    HB   ILE  80           HB       ILE  80   5.096   6.312   0.776
  603   HG12  ILE  80          2HG1      ILE  80   3.018   6.322  -1.361
  604   HG13  ILE  80          1HG1      ILE  80   4.399   5.247  -1.562
  605   HG21  ILE  80          1HG2      ILE  80   2.894   7.653   0.661
  606   HG22  ILE  80          2HG2      ILE  80   3.774   8.667  -0.484
  607   HG23  ILE  80          3HG2      ILE  80   4.376   8.467   1.158
  608   HD11  ILE  80          3HD1      ILE  80   2.581   4.069  -0.537
  609   HD12  ILE  80          1HD1      ILE  80   2.464   5.284   0.733
  610   HD13  ILE  80          2HD1      ILE  80   3.891   4.253   0.630
  611    H    LEU  81           H        LEU  81   7.325   7.476   1.051
  612    HA   LEU  81           HA       LEU  81   7.156  10.215   1.550
  613    HB2  LEU  81           2HB      LEU  81   9.418   8.328   2.199
  614    HB3  LEU  81           1HB      LEU  81   9.200   9.921   2.897
  615    HG   LEU  81           HG       LEU  81   7.265   7.628   3.233
  616   HD11  LEU  81          1HD1      LEU  81   9.394   7.182   4.345
  617   HD12  LEU  81          2HD1      LEU  81   8.116   7.502   5.517
  618   HD13  LEU  81          3HD1      LEU  81   9.307   8.749   5.147
  619   HD21  LEU  81          3HD2      LEU  81   7.411  10.383   4.437
  620   HD22  LEU  81          1HD2      LEU  81   6.356   9.099   5.027
  621   HD23  LEU  81          2HD2      LEU  81   6.143   9.738   3.397
  622    H    LYS  82           H        LYS  82   9.472   8.380  -0.370
  623    HA   LYS  82           HA       LYS  82  11.293  10.394  -0.981
  624    HB2  LYS  82           2HB      LYS  82  11.342   7.861  -1.401
  625    HB3  LYS  82           1HB      LYS  82  10.551   8.285  -2.891
  626    HG2  LYS  82           2HG      LYS  82  12.532   9.967  -3.137
  627    HG3  LYS  82           1HG      LYS  82  13.323   8.846  -2.029
  628    HD2  LYS  82           2HD      LYS  82  11.947   7.921  -4.530
  629    HD3  LYS  82           1HD      LYS  82  13.635   8.433  -4.528
  630    HE2  LYS  82           2HE      LYS  82  13.938   6.740  -2.623
  631    HE3  LYS  82           1HE      LYS  82  12.373   6.102  -3.118
  632    HZ1  LYS  82           3HZ      LYS  82  13.312   5.818  -5.372
  633    HZ2  LYS  82           1HZ      LYS  82  14.089   4.873  -4.206
  634    HZ3  LYS  82           2HZ      LYS  82  14.825   6.281  -4.779
  635    H    SER  83           H        SER  83   8.299   9.472  -2.535
  636    HA   SER  83           HA       SER  83   8.433  10.856  -4.906
  637    HB2  SER  83           2HB      SER  83   6.597   9.302  -4.084
  638    HB3  SER  83           1HB      SER  83   5.920  10.693  -3.239
  639    HG   SER  83           HG       SER  83   5.201  11.449  -5.068
  640    H    GLY  84           H        GLY  84   7.336  12.152  -1.754
  641    HA2  GLY  84           2HA      GLY  84   8.248  14.462  -1.381
  642    HA3  GLY  84           1HA      GLY  84   7.602  14.833  -2.964
  643    H    ASN  85           H        ASN  85   6.034  16.212  -2.676
  644    HA   ASN  85           HA       ASN  85   4.414  16.311  -0.327
  645    HB2  ASN  85           2HB      ASN  85   3.266  18.156  -1.435
  646    HB3  ASN  85           1HB      ASN  85   5.009  18.333  -1.583
  647   HD21  ASN  85          1HD2      ASN  85   5.983  18.090  -3.584
  648   HD22  ASN  85          2HD2      ASN  85   5.076  18.110  -5.055
  649    H    LYS  86           H        LYS  86   4.261  14.339  -3.001
  650    HA   LYS  86           HA       LYS  86   1.639  13.426  -2.294
  651    HB2  LYS  86           2HB      LYS  86   0.765  13.658  -4.566
  652    HB3  LYS  86           1HB      LYS  86   0.995  15.185  -3.781
  653    HG2  LYS  86           2HG      LYS  86   2.871  15.709  -5.103
  654    HG3  LYS  86           1HG      LYS  86   3.024  14.043  -5.670
  655    HD2  LYS  86           2HD      LYS  86   0.947  14.250  -6.911
  656    HD3  LYS  86           1HD      LYS  86   0.710  15.883  -6.287
  657    HE2  LYS  86           2HE      LYS  86   1.572  16.099  -8.489
  658    HE3  LYS  86           1HE      LYS  86   2.880  16.509  -7.382
  659    HZ1  LYS  86           3HZ      LYS  86   3.852  14.360  -7.725
  660    HZ2  LYS  86           1HZ      LYS  86   3.567  15.063  -9.236
  661    HZ3  LYS  86           2HZ      LYS  86   2.540  13.851  -8.662
  662    H    VAL  87           H        VAL  87   0.970  11.687  -3.949
  663    HA   VAL  87           HA       VAL  87   3.070  10.306  -5.319
  664    HB   VAL  87           HB       VAL  87   3.710   9.857  -2.972
  665   HG11  VAL  87          1HG1      VAL  87   1.029   8.503  -2.878
  666   HG12  VAL  87          2HG1      VAL  87   1.634   9.798  -1.842
  667   HG13  VAL  87          3HG1      VAL  87   2.318   8.178  -1.722
  668   HG21  VAL  87          3HG2      VAL  87   4.565   8.281  -4.433
  669   HG22  VAL  87          1HG2      VAL  87   2.974   7.606  -4.796
  670   HG23  VAL  87          2HG2      VAL  87   3.728   7.297  -3.234
  671    H    ALA  88           H        ALA  88   2.386   8.591  -6.531
  672    HA   ALA  88           HA       ALA  88  -0.501   8.303  -6.870
  673    HB1  ALA  88           1HB      ALA  88   0.774   8.795  -8.857
  674    HB2  ALA  88           2HB      ALA  88   0.089   7.173  -8.978
  675    HB3  ALA  88           3HB      ALA  88   1.796   7.385  -8.584
  676    H    ILE  89           H        ILE  89  -1.238   6.876  -5.350
  677    HA   ILE  89           HA       ILE  89   0.138   4.313  -5.066
  678    HB   ILE  89           HB       ILE  89  -0.493   5.257  -2.969
  679   HG12  ILE  89          2HG1      ILE  89  -2.612   3.182  -3.462
  680   HG13  ILE  89          1HG1      ILE  89  -0.900   2.771  -3.418
  681   HG21  ILE  89          1HG2      ILE  89  -2.233   6.778  -3.737
  682   HG22  ILE  89          2HG2      ILE  89  -2.783   5.817  -2.363
  683   HG23  ILE  89          3HG2      ILE  89  -3.319   5.413  -3.994
  684   HD11  ILE  89          3HD1      ILE  89  -2.211   2.469  -1.280
  685   HD12  ILE  89          1HD1      ILE  89  -2.262   4.226  -1.181
  686   HD13  ILE  89          2HD1      ILE  89  -0.711   3.386  -1.160
  687    H    SER  90           H        SER  90  -0.369   2.726  -6.444
  688    HA   SER  90           HA       SER  90  -2.958   2.789  -7.800
  689    HB2  SER  90           2HB      SER  90  -0.471   2.295  -8.738
  690    HB3  SER  90           1HB      SER  90  -1.002   0.648  -8.409
  691    HG   SER  90           HG       SER  90  -2.791   2.319  -9.751
  692    H    THR  91           H        THR  91  -4.598   1.780  -6.854
  693    HA   THR  91           HA       THR  91  -4.054  -0.669  -5.323
  694    HB   THR  91           HB       THR  91  -6.187  -0.280  -4.184
  695    HG1  THR  91           1HG      THR  91  -7.542   1.227  -4.796
  696   HG21  THR  91          3HG2      THR  91  -4.361   2.125  -4.158
  697   HG22  THR  91          1HG2      THR  91  -4.175   0.656  -3.196
  698   HG23  THR  91          2HG2      THR  91  -5.551   1.724  -2.914
  699    H    THR  92           H        THR  92  -6.224  -2.101  -5.296
  700    HA   THR  92           HA       THR  92  -6.731  -2.599  -8.151
  701    HB   THR  92           HB       THR  92  -5.631  -4.467  -7.181
  702    HG1  THR  92           1HG      THR  92  -8.286  -4.696  -7.912
  703   HG21  THR  92          3HG2      THR  92  -6.508  -5.681  -5.235
  704   HG22  THR  92          1HG2      THR  92  -7.757  -4.453  -5.041
  705   HG23  THR  92          2HG2      THR  92  -6.059  -4.025  -4.828
  706    HA   PRO  93           HA       PRO  93 -10.924  -1.045  -7.196
  707    HB2  PRO  93           2HB      PRO  93 -11.124  -1.835 -10.059
  708    HB3  PRO  93           1HB      PRO  93 -11.705  -0.372  -9.254
  709    HG2  PRO  93           2HG      PRO  93  -9.503  -0.318 -10.755
  710    HG3  PRO  93           1HG      PRO  93  -9.600   0.607  -9.251
  711    HD2  PRO  93           2HD      PRO  93  -8.119  -1.884  -9.832
  712    HD3  PRO  93           1HD      PRO  93  -7.713  -0.568  -8.727
  713    H    LEU  94           H        LEU  94 -13.076  -1.986  -7.633
  714    HA   LEU  94           HA       LEU  94 -13.235  -4.663  -6.789
  715    HB2  LEU  94           2HB      LEU  94 -15.682  -3.911  -8.011
  716    HB3  LEU  94           1HB      LEU  94 -15.308  -4.011  -6.316
  717    HG   LEU  94           HG       LEU  94 -14.340  -1.628  -6.604
  718   HD11  LEU  94          1HD1      LEU  94 -14.317  -1.279  -8.876
  719   HD12  LEU  94          2HD1      LEU  94 -15.818  -0.483  -8.396
  720   HD13  LEU  94          3HD1      LEU  94 -15.862  -2.094  -9.109
  721   HD21  LEU  94          3HD2      LEU  94 -16.285  -2.090  -5.266
  722   HD22  LEU  94          1HD2      LEU  94 -17.291  -2.222  -6.709
  723   HD23  LEU  94          2HD2      LEU  94 -16.589  -0.668  -6.263
  724    H    GLU  95           H        GLU  95 -14.272  -6.451  -7.929
  725    HA   GLU  95           HA       GLU  95 -14.449  -6.377 -10.791
  726    HB2  GLU  95           2HB      GLU  95 -12.649  -7.795 -11.352
  727    HB3  GLU  95           1HB      GLU  95 -11.960  -6.595 -10.271
  728    HG2  GLU  95           2HG      GLU  95 -12.890  -9.267  -9.270
  729    HG3  GLU  95           1HG      GLU  95 -11.284  -9.036  -9.954
  730    H    ASN  96           H        ASN  96 -15.077  -8.466 -11.698
  731    HA   ASN  96           HA       ASN  96 -16.868  -9.851  -9.906
  732    HB2  ASN  96           2HB      ASN  96 -17.877 -10.788 -11.806
  733    HB3  ASN  96           1HB      ASN  96 -17.379  -9.193 -12.349
  734   HD21  ASN  96          1HD2      ASN  96 -15.681  -9.003 -13.808
  735   HD22  ASN  96          2HD2      ASN  96 -15.112 -10.350 -14.737
  736    H1   SER 101           1HT      SER 101  -5.513 -16.561   3.153
  737    H2   SER 101           2HT      SER 101  -6.859 -15.857   3.895
  738    H3   SER 101           3HT      SER 101  -5.364 -15.853   4.679
  739    HA   SER 101           HA       SER 101  -5.931 -14.477   2.126
  740    HB2  SER 101           2HB      SER 101  -5.565 -13.205   4.842
  741    HB3  SER 101           1HB      SER 101  -6.089 -12.430   3.347
  742    HG   SER 101           HG       SER 101  -8.044 -13.381   3.515
  743    H    TRP 102           H        TRP 102  -3.764 -14.648   4.967
  744    HA   TRP 102           HA       TRP 102  -1.466 -14.603   3.192
  745    HB2  TRP 102           2HB      TRP 102  -0.352 -12.794   4.479
  746    HB3  TRP 102           1HB      TRP 102  -1.775 -12.226   3.616
  747    HD1  TRP 102           HD       TRP 102  -0.607 -13.057   7.200
  748    HE1  TRP 102           1HE      TRP 102  -2.096 -11.769   8.859
  749    HE3  TRP 102           3HE      TRP 102  -3.968 -11.076   3.902
  750    HZ2  TRP 102           2HZ      TRP 102  -4.379 -10.120   8.771
  751    HZ3  TRP 102           3HZ      TRP 102  -5.770  -9.652   4.781
  752    HH2  TRP 102           HH       TRP 102  -5.976  -9.189   7.159
  753    H    GLU 103           H        GLU 103   0.383 -15.519   4.141
  754    HA   GLU 103           HA       GLU 103  -0.230 -17.136   6.485
  755    HB2  GLU 103           2HB      GLU 103   1.959 -17.213   4.422
  756    HB3  GLU 103           1HB      GLU 103   2.054 -18.166   5.894
  757    HG2  GLU 103           2HG      GLU 103   1.209 -19.516   4.082
  758    HG3  GLU 103           1HG      GLU 103  -0.046 -19.283   5.297
  759    H    SER 104           H        SER 104   1.638 -14.376   5.601
  760    HA   SER 104           HA       SER 104   2.586 -14.171   8.366
  761    HB2  SER 104           2HB      SER 104   4.361 -13.291   6.108
  762    HB3  SER 104           1HB      SER 104   4.795 -13.674   7.772
  763    HG   SER 104           HG       SER 104   4.129 -15.899   7.190
  764    H    HIS 105           H        HIS 105   2.776 -12.054   9.137
  765    HA   HIS 105           HA       HIS 105   1.492 -10.018   7.431
  766    HB2  HIS 105           2HB      HIS 105   0.084 -10.745   9.309
  767    HB3  HIS 105           1HB      HIS 105   1.367 -10.337  10.439
  768    HD2  HIS 105           2HD      HIS 105  -1.391  -8.631   8.317
  769    HE1  HIS 105           1HE      HIS 105   0.363  -5.753  10.874
  770    HE2  HIS 105           2HE      HIS 105  -1.660  -6.321   9.460
  771    H    LYS 106           H        LYS 106   3.234  -9.896  10.519
  772    HA   LYS 106           HA       LYS 106   4.473  -7.458  10.114
  773    HB2  LYS 106           2HB      LYS 106   5.040  -9.808  11.874
  774    HB3  LYS 106           1HB      LYS 106   6.189  -8.480  11.820
  775    HG2  LYS 106           2HG      LYS 106   4.537  -6.930  12.585
  776    HG3  LYS 106           1HG      LYS 106   3.263  -8.143  12.441
  777    HD2  LYS 106           2HD      LYS 106   4.143  -9.411  14.245
  778    HD3  LYS 106           1HD      LYS 106   5.647  -8.489  14.246
  779    HE2  LYS 106           2HE      LYS 106   4.266  -7.804  16.105
  780    HE3  LYS 106           1HE      LYS 106   4.400  -6.488  14.940
  781    HZ1  LYS 106           3HZ      LYS 106   2.121  -8.279  14.641
  782    HZ2  LYS 106           1HZ      LYS 106   2.216  -6.600  14.424
  783    HZ3  LYS 106           2HZ      LYS 106   2.104  -7.252  15.981
  784    H    SER 107           H        SER 107   5.814  -6.892   8.569
  785    HA   SER 107           HA       SER 107   8.080  -8.628   7.923
  786    HB2  SER 107           2HB      SER 107   6.494  -7.254   5.746
  787    HB3  SER 107           1HB      SER 107   7.724  -8.507   5.574
  788    HG   SER 107           HG       SER 107   5.141  -8.814   6.748
  789    H    GLY 108           H        GLY 108   8.822  -6.839   9.459
  790    HA2  GLY 108           2HA      GLY 108  10.642  -5.248   9.130
  791    HA3  GLY 108           1HA      GLY 108   9.689  -4.519   7.843
  792    H    GLY 109           H        GLY 109   7.742  -5.449  10.392
  793    HA2  GLY 109           2HA      GLY 109   7.366  -4.208  12.457
  794    HA3  GLY 109           1HA      GLY 109   7.883  -2.763  11.600
  795    H    GLU 110           H        GLU 110   5.915  -1.774  12.251
  796    HA   GLU 110           HA       GLU 110   3.664  -2.445  10.478
  797    HB2  GLU 110           2HB      GLU 110   3.359  -1.641  13.386
  798    HB3  GLU 110           1HB      GLU 110   2.068  -2.051  12.268
  799    HG2  GLU 110           2HG      GLU 110   3.031  -4.345  12.108
  800    HG3  GLU 110           1HG      GLU 110   4.155  -3.899  13.389
  801    H    THR 111           H        THR 111   5.164  -0.672   9.523
  802    HA   THR 111           HA       THR 111   4.941   1.981  10.542
  803    HB   THR 111           HB       THR 111   5.578   1.555   7.675
  804    HG1  THR 111           1HG      THR 111   7.692   0.877   9.300
  805   HG21  THR 111          3HG2      THR 111   6.962   2.990   9.947
  806   HG22  THR 111          1HG2      THR 111   5.937   3.728   8.718
  807   HG23  THR 111          2HG2      THR 111   7.487   3.016   8.262
  808    H    ARG 112           H        ARG 112   4.186   3.717   8.819
  809    HA   ARG 112           HA       ARG 112   1.918   3.030   7.224
  810    HB2  ARG 112           2HB      ARG 112   0.324   4.484   8.510
  811    HB3  ARG 112           1HB      ARG 112   0.738   2.968   9.292
  812    HG2  ARG 112           2HG      ARG 112   2.518   4.369  10.536
  813    HG3  ARG 112           1HG      ARG 112   1.545   5.748  10.025
  814    HD2  ARG 112           2HD      ARG 112  -0.433   4.359  10.983
  815    HD3  ARG 112           1HD      ARG 112   0.829   3.489  11.849
  816    HE   ARG 112           HE       ARG 112   1.337   6.128  12.354
  817   HH11  ARG 112          1HH1      ARG 112  -1.379   3.967  12.797
  818   HH12  ARG 112          2HH1      ARG 112  -2.017   4.835  14.156
  819   HH21  ARG 112          1HH2      ARG 112   0.493   7.286  14.144
  820   HH22  ARG 112          2HH2      ARG 112  -0.951   6.723  14.920
  821    H    LEU 113           H        LEU 113   0.829   5.153   6.443
  822    HA   LEU 113           HA       LEU 113   2.986   7.087   5.948
  823    HB2  LEU 113           2HB      LEU 113   0.648   6.179   4.293
  824    HB3  LEU 113           1HB      LEU 113   1.442   7.704   3.968
  825    HG   LEU 113           HG       LEU 113   2.374   6.149   2.458
  826   HD11  LEU 113          1HD1      LEU 113   4.008   7.611   3.546
  827   HD12  LEU 113          2HD1      LEU 113   4.703   6.066   3.057
  828   HD13  LEU 113          3HD1      LEU 113   4.305   6.358   4.749
  829   HD21  LEU 113          3HD2      LEU 113   3.315   4.005   3.119
  830   HD22  LEU 113          1HD2      LEU 113   1.606   4.109   3.541
  831   HD23  LEU 113          2HD2      LEU 113   2.837   4.302   4.789
  Start of MODEL    7
    1    H1   GLY   1           1HT      GLY   1  -9.818 -11.983 -12.197
    2    H2   GLY   1           2HT      GLY   1  -9.359 -11.245 -13.647
    3    H3   GLY   1           3HT      GLY   1 -10.974 -11.212 -13.158
    4    HA2  GLY   1           1HA      GLY   1 -10.466  -9.816 -11.300
    5    HA3  GLY   1           2HA      GLY   1  -8.754  -9.931 -11.678
    6    H    GLY   2           H        GLY   2  -7.927  -8.275 -12.750
    7    HA2  GLY   2           2HA      GLY   2  -9.179  -7.081 -15.001
    8    HA3  GLY   2           1HA      GLY   2  -9.357  -6.057 -13.583
    9    H    SER   3           H        SER   3  -8.050  -4.802 -15.378
   10    HA   SER   3           HA       SER   3  -5.262  -4.937 -14.505
   11    HB2  SER   3           2HB      SER   3  -5.981  -5.918 -16.952
   12    HB3  SER   3           1HB      SER   3  -5.617  -4.238 -17.349
   13    HG   SER   3           HG       SER   3  -3.930  -6.192 -16.185
   14    H    MET   4           H        MET   4  -4.154  -2.888 -15.730
   15    HA   MET   4           HA       MET   4  -3.905  -0.636 -15.628
   16    HB2  MET   4           2HB      MET   4  -5.649  -0.939 -17.477
   17    HB3  MET   4           1HB      MET   4  -6.837  -0.433 -16.286
   18    HG2  MET   4           2HG      MET   4  -5.544   1.674 -15.988
   19    HG3  MET   4           1HG      MET   4  -4.509   1.167 -17.322
   20    HE1  MET   4           3HE      MET   4  -8.477   0.950 -16.782
   21    HE2  MET   4           1HE      MET   4  -8.911   2.451 -17.598
   22    HE3  MET   4           2HE      MET   4  -7.897   2.493 -16.157
   23    H    ARG   5           H        ARG   5  -3.693  -1.051 -13.267
   24    HA   ARG   5           HA       ARG   5  -5.866  -0.441 -11.526
   25    HB2  ARG   5           2HB      ARG   5  -2.886  -0.607 -11.059
   26    HB3  ARG   5           1HB      ARG   5  -4.043  -0.272  -9.779
   27    HG2  ARG   5           2HG      ARG   5  -3.716  -2.540  -9.564
   28    HG3  ARG   5           1HG      ARG   5  -5.174  -2.471 -10.559
   29    HD2  ARG   5           2HD      ARG   5  -3.732  -2.713 -12.569
   30    HD3  ARG   5           1HD      ARG   5  -2.346  -2.933 -11.503
   31    HE   ARG   5           HE       ARG   5  -4.275  -4.794 -10.758
   32   HH11  ARG   5          1HH1      ARG   5  -2.316  -4.068 -13.559
   33   HH12  ARG   5          2HH1      ARG   5  -2.181  -5.724 -14.054
   34   HH21  ARG   5          1HH2      ARG   5  -4.129  -6.978 -11.423
   35   HH22  ARG   5          2HH2      ARG   5  -3.235  -7.375 -12.856
   36    HA   PRO   6           HA       PRO   6  -5.395   3.971 -11.961
   37    HB2  PRO   6           2HB      PRO   6  -7.496   4.420 -10.083
   38    HB3  PRO   6           1HB      PRO   6  -7.614   4.392 -11.843
   39    HG2  PRO   6           2HG      PRO   6  -8.788   2.522 -10.183
   40    HG3  PRO   6           1HG      PRO   6  -8.381   2.240 -11.878
   41    HD2  PRO   6           2HD      PRO   6  -6.856   1.517  -9.402
   42    HD3  PRO   6           1HD      PRO   6  -7.217   0.536 -10.838
   43    HA   PRO   7           HA       PRO   7  -2.963   4.616  -8.161
   44    HB2  PRO   7           2HB      PRO   7  -1.835   6.849  -9.643
   45    HB3  PRO   7           1HB      PRO   7  -1.022   5.458  -8.933
   46    HG2  PRO   7           2HG      PRO   7  -1.282   5.784 -11.595
   47    HG3  PRO   7           1HG      PRO   7  -1.273   4.184 -10.831
   48    HD2  PRO   7           2HD      PRO   7  -3.596   5.791 -11.840
   49    HD3  PRO   7           1HD      PRO   7  -3.311   4.040 -11.939
   50    H    ILE   8           H        ILE   8  -3.814   5.660  -6.567
   51    HA   ILE   8           HA       ILE   8  -5.406   8.040  -6.998
   52    HB   ILE   8           HB       ILE   8  -4.822   6.844  -4.315
   53   HG12  ILE   8          2HG1      ILE   8  -7.042   5.829  -6.044
   54   HG13  ILE   8          1HG1      ILE   8  -5.455   5.123  -6.148
   55   HG21  ILE   8          1HG2      ILE   8  -6.169   8.947  -4.654
   56   HG22  ILE   8          2HG2      ILE   8  -6.977   7.654  -3.767
   57   HG23  ILE   8          3HG2      ILE   8  -7.365   7.932  -5.460
   58   HD11  ILE   8          3HD1      ILE   8  -6.849   5.380  -3.535
   59   HD12  ILE   8          1HD1      ILE   8  -5.530   4.302  -3.986
   60   HD13  ILE   8          2HD1      ILE   8  -7.154   4.019  -4.614
   61    H    ILE   9           H        ILE   9  -4.300   9.873  -7.161
   62    HA   ILE   9           HA       ILE   9  -1.695  10.147  -6.022
   63    HB   ILE   9           HB       ILE   9  -3.266  12.482  -7.030
   64   HG12  ILE   9          2HG1      ILE   9  -3.527  10.572  -8.648
   65   HG13  ILE   9          1HG1      ILE   9  -2.734  11.991  -9.312
   66   HG21  ILE   9          1HG2      ILE   9  -1.091  12.912  -6.063
   67   HG22  ILE   9          2HG2      ILE   9  -1.038  13.201  -7.801
   68   HG23  ILE   9          3HG2      ILE   9  -0.350  11.719  -7.132
   69   HD11  ILE   9          3HD1      ILE   9  -1.593  10.067 -10.098
   70   HD12  ILE   9          1HD1      ILE   9  -1.462   9.406  -8.468
   71   HD13  ILE   9          2HD1      ILE   9  -0.555  10.853  -8.909
   72    H    ILE  10           H        ILE  10  -1.685  10.135  -3.821
   73    HA   ILE  10           HA       ILE  10  -3.551  11.712  -2.284
   74    HB   ILE  10           HB       ILE  10  -0.884  10.611  -1.322
   75   HG12  ILE  10          2HG1      ILE  10  -3.258   9.209  -0.405
   76   HG13  ILE  10          1HG1      ILE  10  -2.974   9.018  -2.105
   77   HG21  ILE  10          1HG2      ILE  10  -2.275  10.603   0.871
   78   HG22  ILE  10          2HG2      ILE  10  -3.269  11.788   0.026
   79   HG23  ILE  10          3HG2      ILE  10  -1.555  12.106   0.295
   80   HD11  ILE  10          3HD1      ILE  10  -0.732   8.222  -1.670
   81   HD12  ILE  10          1HD1      ILE  10  -1.944   7.248  -0.836
   82   HD13  ILE  10          2HD1      ILE  10  -1.011   8.449   0.055
   83    H    HIS  11           H        HIS  11  -2.805  13.537  -0.950
   84    HA   HIS  11           HA       HIS  11  -0.397  14.855  -1.931
   85    HB2  HIS  11           2HB      HIS  11  -2.237  15.862  -3.211
   86    HB3  HIS  11           1HB      HIS  11  -3.130  16.167  -1.725
   87    HD2  HIS  11           2HD      HIS  11   0.587  17.154  -2.661
   88    HE1  HIS  11           1HE      HIS  11  -1.552  20.546  -1.318
   89    HE2  HIS  11           2HE      HIS  11   0.744  19.619  -1.863
   90    H    ARG  12           H        ARG  12   0.791  14.965  -0.170
   91    HA   ARG  12           HA       ARG  12  -0.226  14.797   2.451
   92    HB2  ARG  12           2HB      ARG  12   2.061  14.138   1.766
   93    HB3  ARG  12           1HB      ARG  12   2.455  15.835   1.523
   94    HG2  ARG  12           2HG      ARG  12   2.177  16.293   3.855
   95    HG3  ARG  12           1HG      ARG  12   1.597  14.651   4.148
   96    HD2  ARG  12           2HD      ARG  12   3.741  13.754   3.466
   97    HD3  ARG  12           1HD      ARG  12   4.319  15.377   3.105
   98    HE   ARG  12           HE       ARG  12   3.442  14.785   5.843
   99   HH11  ARG  12          1HH1      ARG  12   6.078  15.409   3.608
  100   HH12  ARG  12          2HH1      ARG  12   7.208  15.807   4.863
  101   HH21  ARG  12          1HH2      ARG  12   4.938  15.297   7.487
  102   HH22  ARG  12          2HH2      ARG  12   6.562  15.739   7.065
  103    H    ALA  13           H        ALA  13  -1.587  16.322   3.162
  104    HA   ALA  13           HA       ALA  13  -1.273  19.107   2.531
  105    HB1  ALA  13           1HB      ALA  13  -3.271  19.430   3.845
  106    HB2  ALA  13           2HB      ALA  13  -3.119  17.816   4.540
  107    HB3  ALA  13           3HB      ALA  13  -3.482  18.007   2.825
  108    H    GLY  14           H        GLY  14   1.067  18.422   3.635
  109    HA2  GLY  14           2HA      GLY  14   2.518  19.383   5.170
  110    HA3  GLY  14           1HA      GLY  14   1.133  20.010   6.052
  111    H    LYS  15           H        LYS  15  -0.222  17.535   6.380
  112    HA   LYS  15           HA       LYS  15   1.309  16.505   8.597
  113    HB2  LYS  15           2HB      LYS  15  -0.886  14.993   8.690
  114    HB3  LYS  15           1HB      LYS  15  -0.836  16.634   9.317
  115    HG2  LYS  15           2HG      LYS  15  -1.876  17.481   7.311
  116    HG3  LYS  15           1HG      LYS  15  -1.822  15.880   6.570
  117    HD2  LYS  15           2HD      LYS  15  -4.044  16.287   7.401
  118    HD3  LYS  15           1HD      LYS  15  -3.277  15.047   8.391
  119    HE2  LYS  15           2HE      LYS  15  -2.768  16.698  10.102
  120    HE3  LYS  15           1HE      LYS  15  -3.476  17.967   9.107
  121    HZ1  LYS  15           3HZ      LYS  15  -4.942  15.634  10.210
  122    HZ2  LYS  15           1HZ      LYS  15  -5.619  16.882   9.289
  123    HZ3  LYS  15           2HZ      LYS  15  -4.998  17.205  10.828
  124    H    LYS  16           H        LYS  16  -0.707  14.453   6.525
  125    HA   LYS  16           HA       LYS  16   1.602  12.983   5.571
  126    HB2  LYS  16           2HB      LYS  16   0.572  10.831   6.568
  127    HB3  LYS  16           1HB      LYS  16   1.534  11.864   7.608
  128    HG2  LYS  16           2HG      LYS  16  -0.589  12.887   8.431
  129    HG3  LYS  16           1HG      LYS  16  -1.462  11.667   7.503
  130    HD2  LYS  16           2HD      LYS  16  -0.949  10.011   8.946
  131    HD3  LYS  16           1HD      LYS  16   0.660  10.652   9.270
  132    HE2  LYS  16           2HE      LYS  16  -0.623  10.798  11.285
  133    HE3  LYS  16           1HE      LYS  16  -0.391  12.426  10.657
  134    HZ1  LYS  16           3HZ      LYS  16  -2.714  11.673  11.463
  135    HZ2  LYS  16           1HZ      LYS  16  -2.828  10.939   9.942
  136    HZ3  LYS  16           2HZ      LYS  16  -2.585  12.611  10.062
  137    H    TYR  17           H        TYR  17   0.549  10.693   4.673
  138    HA   TYR  17           HA       TYR  17  -1.367  11.622   2.682
  139    HB2  TYR  17           2HB      TYR  17  -0.044   8.910   2.806
  140    HB3  TYR  17           1HB      TYR  17  -0.829   9.664   1.400
  141    HD1  TYR  17           1HD      TYR  17   2.167   9.691   3.560
  142    HD2  TYR  17           2HD      TYR  17   0.311  11.352   0.117
  143    HE1  TYR  17           1HE      TYR  17   4.312  10.674   2.889
  144    HE2  TYR  17           2HE      TYR  17   2.455  12.344  -0.570
  145    HH   TYR  17           HH       TYR  17   4.576  12.796   0.086
  146    H    GLY  18           H        GLY  18  -1.549  10.484   5.660
  147    HA2  GLY  18           2HA      GLY  18  -3.156   9.550   6.956
  148    HA3  GLY  18           1HA      GLY  18  -4.249  10.124   5.731
  149    H    PHE  19           H        PHE  19  -1.911   7.468   5.737
  150    HA   PHE  19           HA       PHE  19  -3.976   5.523   6.027
  151    HB2  PHE  19           2HB      PHE  19  -4.036   4.503   3.926
  152    HB3  PHE  19           1HB      PHE  19  -4.179   6.196   3.613
  153    HD1  PHE  19           2HD      PHE  19  -1.952   7.435   3.006
  154    HD2  PHE  19           1HD      PHE  19  -2.514   3.226   2.810
  155    HE1  PHE  19           2HE      PHE  19  -0.044   7.251   1.451
  156    HE2  PHE  19           1HE      PHE  19  -0.616   3.033   1.262
  157    HZ   PHE  19           HZ       PHE  19   0.620   5.051   0.578
  158    H    THR  20           H        THR  20  -3.395   3.538   6.373
  159    HA   THR  20           HA       THR  20  -0.622   3.127   7.227
  160    HB   THR  20           HB       THR  20  -3.124   1.492   7.698
  161    HG1  THR  20           1HG      THR  20  -2.855   3.663   8.696
  162   HG21  THR  20          3HG2      THR  20  -1.931   0.152   9.241
  163   HG22  THR  20          1HG2      THR  20  -0.518   1.215   9.187
  164   HG23  THR  20          2HG2      THR  20  -0.923   0.214   7.793
  165    H    LEU  21           H        LEU  21   0.815   2.151   5.876
  166    HA   LEU  21           HA       LEU  21  -0.171   0.356   3.804
  167    HB2  LEU  21           2HB      LEU  21   1.836   2.189   3.695
  168    HB3  LEU  21           1HB      LEU  21   2.753   0.758   4.071
  169    HG   LEU  21           HG       LEU  21   2.567  -0.041   1.993
  170   HD11  LEU  21          1HD1      LEU  21   0.495   0.002   0.651
  171   HD12  LEU  21          2HD1      LEU  21  -0.290   0.919   1.934
  172   HD13  LEU  21          3HD1      LEU  21   0.265  -0.728   2.239
  173   HD21  LEU  21          3HD2      LEU  21   2.365   1.620   0.290
  174   HD22  LEU  21          1HD2      LEU  21   3.143   2.343   1.699
  175   HD23  LEU  21          2HD2      LEU  21   1.444   2.673   1.365
  176    H    ARG  22           H        ARG  22  -0.840  -1.328   5.173
  177    HA   ARG  22           HA       ARG  22   0.907  -2.655   6.995
  178    HB2  ARG  22           2HB      ARG  22  -1.746  -2.668   6.654
  179    HB3  ARG  22           1HB      ARG  22  -1.363  -4.114   5.740
  180    HG2  ARG  22           2HG      ARG  22  -1.796  -4.938   7.847
  181    HG3  ARG  22           1HG      ARG  22  -0.036  -4.809   7.842
  182    HD2  ARG  22           2HD      ARG  22  -0.084  -2.826   9.125
  183    HD3  ARG  22           1HD      ARG  22  -1.819  -2.619   8.872
  184    HE   ARG  22           HE       ARG  22  -1.387  -5.065  10.175
  185   HH11  ARG  22          1HH1      ARG  22  -1.107  -1.631  10.796
  186   HH12  ARG  22          2HH1      ARG  22  -1.370  -1.789  12.506
  187   HH21  ARG  22          1HH2      ARG  22  -1.786  -5.271  12.408
  188   HH22  ARG  22          2HH2      ARG  22  -1.785  -3.853  13.411
  189    H    ALA  23           H        ALA  23   2.495  -4.075   6.524
  190    HA   ALA  23           HA       ALA  23   2.865  -5.041   3.832
  191    HB1  ALA  23           1HB      ALA  23   4.436  -5.705   6.324
  192    HB2  ALA  23           2HB      ALA  23   4.777  -4.350   5.247
  193    HB3  ALA  23           3HB      ALA  23   4.927  -6.007   4.658
  194    H    ILE  24           H        ILE  24   2.575  -7.147   3.100
  195    HA   ILE  24           HA       ILE  24   1.701  -9.142   5.058
  196    HB   ILE  24           HB       ILE  24  -0.100  -9.853   3.389
  197   HG12  ILE  24          2HG1      ILE  24   0.038  -6.952   2.566
  198   HG13  ILE  24          1HG1      ILE  24   0.756  -8.244   1.609
  199   HG21  ILE  24          1HG2      ILE  24  -0.613  -8.965   5.572
  200   HG22  ILE  24          2HG2      ILE  24  -1.732  -8.292   4.384
  201   HG23  ILE  24          3HG2      ILE  24  -0.394  -7.314   4.986
  202   HD11  ILE  24          3HD1      ILE  24  -1.338  -9.184   1.124
  203   HD12  ILE  24          1HD1      ILE  24  -1.541  -7.444   0.924
  204   HD13  ILE  24          2HD1      ILE  24  -2.142  -8.240   2.378
  205    H    ARG  25           H        ARG  25   2.222 -11.207   4.586
  206    HA   ARG  25           HA       ARG  25   3.865 -11.614   2.184
  207    HB2  ARG  25           2HB      ARG  25   3.823 -13.315   4.677
  208    HB3  ARG  25           1HB      ARG  25   4.990 -13.384   3.370
  209    HG2  ARG  25           2HG      ARG  25   5.624 -11.021   3.994
  210    HG3  ARG  25           1HG      ARG  25   4.673 -11.274   5.460
  211    HD2  ARG  25           2HD      ARG  25   7.024 -12.918   4.538
  212    HD3  ARG  25           1HD      ARG  25   7.002 -11.778   5.876
  213    HE   ARG  25           HE       ARG  25   5.065 -13.899   6.109
  214   HH11  ARG  25          1HH1      ARG  25   8.365 -12.931   6.765
  215   HH12  ARG  25          2HH1      ARG  25   8.571 -14.065   8.062
  216   HH21  ARG  25          1HH2      ARG  25   5.335 -15.396   7.798
  217   HH22  ARG  25          2HH2      ARG  25   6.843 -15.473   8.653
  218    H    VAL  26           H        VAL  26   2.299 -12.204   0.709
  219    HA   VAL  26           HA       VAL  26   0.382 -14.263   1.368
  220    HB   VAL  26           HB       VAL  26  -0.107 -14.129  -1.159
  221   HG11  VAL  26          1HG1      VAL  26  -1.394 -12.016  -0.846
  222   HG12  VAL  26          2HG1      VAL  26  -0.556 -11.794   0.690
  223   HG13  VAL  26          3HG1      VAL  26  -1.604 -13.191   0.454
  224   HG21  VAL  26          3HG2      VAL  26   0.617 -12.179  -2.328
  225   HG22  VAL  26          1HG2      VAL  26   2.046 -13.001  -1.705
  226   HG23  VAL  26          2HG2      VAL  26   1.437 -11.559  -0.894
  227    H    TYR  27           H        TYR  27   1.280 -16.211   1.703
  228    HA   TYR  27           HA       TYR  27   3.444 -17.170   0.039
  229    HB2  TYR  27           2HB      TYR  27   1.977 -18.210   2.429
  230    HB3  TYR  27           1HB      TYR  27   2.875 -19.342   1.425
  231    HD1  TYR  27           2HD      TYR  27   3.181 -16.370   3.601
  232    HD2  TYR  27           1HD      TYR  27   5.245 -19.428   1.488
  233    HE1  TYR  27           2HE      TYR  27   5.255 -15.785   4.788
  234    HE2  TYR  27           1HE      TYR  27   7.321 -18.851   2.666
  235    HH   TYR  27           HH       TYR  27   8.328 -17.088   3.874
  236    H    MET  28           H        MET  28   3.284 -19.210  -1.139
  237    HA   MET  28           HA       MET  28   0.707 -19.375  -2.506
  238    HB2  MET  28           2HB      MET  28   3.384 -20.596  -3.189
  239    HB3  MET  28           1HB      MET  28   1.945 -20.723  -4.167
  240    HG2  MET  28           2HG      MET  28   3.362 -18.225  -3.479
  241    HG3  MET  28           1HG      MET  28   3.452 -19.060  -5.013
  242    HE1  MET  28           3HE      MET  28   0.530 -19.951  -5.635
  243    HE2  MET  28           1HE      MET  28   1.570 -19.116  -6.788
  244    HE3  MET  28           2HE      MET  28  -0.079 -18.550  -6.516
  245    H    GLY  29           H        GLY  29   0.245 -20.309  -0.146
  246    HA2  GLY  29           2HA      GLY  29  -0.637 -22.115   0.961
  247    HA3  GLY  29           1HA      GLY  29  -0.467 -23.027  -0.533
  248    H    ASP  30           H        ASP  30   0.652 -24.824  -0.181
  249    HA   ASP  30           HA       ASP  30   2.610 -24.982   1.944
  250    HB2  ASP  30           2HB      ASP  30   1.017 -26.854   1.359
  251    HB3  ASP  30           1HB      ASP  30   1.936 -27.083  -0.124
  252    H    SER  31           H        SER  31   3.861 -23.249   0.871
  253    HA   SER  31           HA       SER  31   6.104 -24.374  -0.516
  254    HB2  SER  31           2HB      SER  31   4.419 -22.268  -1.911
  255    HB3  SER  31           1HB      SER  31   5.988 -22.850  -2.458
  256    HG   SER  31           HG       SER  31   4.358 -24.939  -2.037
  257    H    ASP  32           H        ASP  32   7.910 -22.993  -0.438
  258    HA   ASP  32           HA       ASP  32   7.810 -21.081   1.705
  259    HB2  ASP  32           2HB      ASP  32   9.706 -22.684   1.357
  260    HB3  ASP  32           1HB      ASP  32  10.157 -21.759  -0.070
  261    H    VAL  33           H        VAL  33   7.348 -20.895  -1.604
  262    HA   VAL  33           HA       VAL  33   8.454 -18.296  -2.034
  263    HB   VAL  33           HB       VAL  33   8.304 -19.747  -3.935
  264   HG11  VAL  33          1HG1      VAL  33   5.311 -19.738  -3.629
  265   HG12  VAL  33          2HG1      VAL  33   6.364 -21.071  -3.166
  266   HG13  VAL  33          3HG1      VAL  33   6.253 -20.585  -4.856
  267   HG21  VAL  33          3HG2      VAL  33   7.248 -18.313  -5.541
  268   HG22  VAL  33          1HG2      VAL  33   7.991 -17.315  -4.292
  269   HG23  VAL  33          2HG2      VAL  33   6.247 -17.576  -4.290
  270    H    TYR  34           H        TYR  34   7.564 -16.414  -1.806
  271    HA   TYR  34           HA       TYR  34   4.693 -16.078  -1.563
  272    HB2  TYR  34           2HB      TYR  34   4.752 -14.993   0.587
  273    HB3  TYR  34           1HB      TYR  34   5.492 -16.580   0.755
  274    HD1  TYR  34           2HD      TYR  34   8.046 -16.711   0.772
  275    HD2  TYR  34           1HD      TYR  34   5.918 -13.049   1.225
  276    HE1  TYR  34           2HE      TYR  34  10.044 -15.668   1.766
  277    HE2  TYR  34           1HE      TYR  34   7.905 -12.009   2.226
  278    HH   TYR  34           HH       TYR  34  10.961 -13.295   2.012
  279    H    THR  35           H        THR  35   4.003 -13.956  -1.939
  280    HA   THR  35           HA       THR  35   6.097 -12.248  -3.078
  281    HB   THR  35           HB       THR  35   3.516 -11.181  -3.592
  282    HG1  THR  35           1HG      THR  35   3.661 -13.833  -4.578
  283   HG21  THR  35          3HG2      THR  35   5.448 -12.653  -5.386
  284   HG22  THR  35          1HG2      THR  35   5.495 -10.931  -5.011
  285   HG23  THR  35          2HG2      THR  35   4.141 -11.598  -5.925
  286    H    VAL  36           H        VAL  36   6.622 -10.389  -2.120
  287    HA   VAL  36           HA       VAL  36   5.344  -9.722   0.381
  288    HB   VAL  36           HB       VAL  36   7.503  -8.094  -0.937
  289   HG11  VAL  36          1HG1      VAL  36   8.100  -7.578   1.382
  290   HG12  VAL  36          2HG1      VAL  36   6.772  -8.592   1.944
  291   HG13  VAL  36          3HG1      VAL  36   6.434  -7.126   1.023
  292   HG21  VAL  36          3HG2      VAL  36   8.450 -10.238  -1.013
  293   HG22  VAL  36          1HG2      VAL  36   7.751 -10.696   0.542
  294   HG23  VAL  36          2HG2      VAL  36   9.071  -9.526   0.476
  295    H    HIS  37           H        HIS  37   3.353  -8.922   0.005
  296    HA   HIS  37           HA       HIS  37   3.116  -6.578  -1.758
  297    HB2  HIS  37           2HB      HIS  37   1.023  -8.563  -0.841
  298    HB3  HIS  37           1HB      HIS  37   0.646  -7.078  -1.701
  299    HD2  HIS  37           2HD      HIS  37   0.121 -10.178  -2.880
  300    HE1  HIS  37           1HE      HIS  37   3.026  -8.928  -5.686
  301    HE2  HIS  37           2HE      HIS  37   1.318 -10.709  -5.115
  302    H    HIS  38           H        HIS  38   0.900  -5.395  -0.866
  303    HA   HIS  38           HA       HIS  38   1.045  -5.034   2.010
  304    HB2  HIS  38           2HB      HIS  38   1.540  -2.725   0.104
  305    HB3  HIS  38           1HB      HIS  38   1.366  -2.594   1.849
  306    HD2  HIS  38           2HD      HIS  38   4.034  -3.195  -0.789
  307    HE1  HIS  38           1HE      HIS  38   5.769  -4.019   2.971
  308    HE2  HIS  38           2HE      HIS  38   6.150  -4.019   0.471
  309    H    MET  39           H        MET  39  -0.663  -3.451   2.715
  310    HA   MET  39           HA       MET  39  -2.852  -3.029   0.844
  311    HB2  MET  39           2HB      MET  39  -3.097  -5.392   1.797
  312    HB3  MET  39           1HB      MET  39  -3.340  -4.634   3.360
  313    HG2  MET  39           2HG      MET  39  -5.255  -3.383   2.373
  314    HG3  MET  39           1HG      MET  39  -5.062  -4.354   0.915
  315    HE1  MET  39           3HE      MET  39  -5.942  -7.938   2.113
  316    HE2  MET  39           1HE      MET  39  -4.356  -7.201   1.890
  317    HE3  MET  39           2HE      MET  39  -5.641  -6.897   0.720
  318    H    VAL  40           H        VAL  40  -4.084  -1.286   1.433
  319    HA   VAL  40           HA       VAL  40  -3.128   0.307   3.597
  320    HB   VAL  40           HB       VAL  40  -3.923   1.517   1.708
  321   HG11  VAL  40          1HG1      VAL  40  -6.154   1.390   0.829
  322   HG12  VAL  40          2HG1      VAL  40  -6.621   0.234   2.075
  323   HG13  VAL  40          3HG1      VAL  40  -5.442  -0.223   0.843
  324   HG21  VAL  40          3HG2      VAL  40  -4.469   2.307   4.088
  325   HG22  VAL  40          1HG2      VAL  40  -6.138   1.900   3.687
  326   HG23  VAL  40          2HG2      VAL  40  -5.272   3.106   2.735
  327    H    TRP  41           H        TRP  41  -3.420  -0.406   5.516
  328    HA   TRP  41           HA       TRP  41  -5.576  -2.033   6.369
  329    HB2  TRP  41           2HB      TRP  41  -3.106  -1.641   7.276
  330    HB3  TRP  41           1HB      TRP  41  -3.960  -0.544   8.349
  331    HD1  TRP  41           HD       TRP  41  -4.195  -1.763  10.554
  332    HE1  TRP  41           1HE      TRP  41  -5.034  -4.073  11.293
  333    HE3  TRP  41           3HE      TRP  41  -4.939  -3.842   5.954
  334    HZ2  TRP  41           2HZ      TRP  41  -5.928  -6.484  10.063
  335    HZ3  TRP  41           3HZ      TRP  41  -5.791  -6.139   5.805
  336    HH2  TRP  41           HH       TRP  41  -6.288  -7.430   7.833
  337    H    HIS  42           H        HIS  42  -4.761   1.333   6.786
  338    HA   HIS  42           HA       HIS  42  -7.550   1.956   7.308
  339    HB2  HIS  42           2HB      HIS  42  -6.079   1.446   9.486
  340    HB3  HIS  42           1HB      HIS  42  -5.645   3.130   9.257
  341    HD2  HIS  42           2HD      HIS  42  -7.946   4.905   9.231
  342    HE1  HIS  42           1HE      HIS  42 -10.247   2.184  11.507
  343    HE2  HIS  42           2HE      HIS  42  -9.984   4.601  10.808
  344    H    VAL  43           H        VAL  43  -8.035   3.784   6.333
  345    HA   VAL  43           HA       VAL  43  -5.867   5.686   5.839
  346    HB   VAL  43           HB       VAL  43  -6.245   4.567   3.757
  347   HG11  VAL  43          1HG1      VAL  43  -8.414   3.651   4.084
  348   HG12  VAL  43          2HG1      VAL  43  -8.448   4.668   2.643
  349   HG13  VAL  43          3HG1      VAL  43  -9.133   5.258   4.157
  350   HG21  VAL  43          3HG2      VAL  43  -5.849   6.988   3.678
  351   HG22  VAL  43          1HG2      VAL  43  -7.595   7.252   3.681
  352   HG23  VAL  43          2HG2      VAL  43  -6.838   6.417   2.327
  353    H    GLU  44           H        GLU  44  -6.199   7.598   6.505
  354    HA   GLU  44           HA       GLU  44  -8.487   8.341   7.966
  355    HB2  GLU  44           2HB      GLU  44  -6.166  10.002   7.012
  356    HB3  GLU  44           1HB      GLU  44  -7.273  10.403   8.304
  357    HG2  GLU  44           2HG      GLU  44  -6.509   8.346   9.499
  358    HG3  GLU  44           1HG      GLU  44  -5.273   8.178   8.252
  359    H    ASP  45           H        ASP  45 -10.318   9.088   7.210
  360    HA   ASP  45           HA       ASP  45 -10.508  10.170   4.526
  361    HB2  ASP  45           2HB      ASP  45 -12.955  10.134   4.953
  362    HB3  ASP  45           1HB      ASP  45 -12.193   8.566   5.177
  363    H    GLY  46           H        GLY  46  -9.090  11.691   6.494
  364    HA2  GLY  46           2HA      GLY  46 -10.861  13.921   7.114
  365    HA3  GLY  46           1HA      GLY  46  -9.195  13.739   7.639
  366    H    GLY  47           H        GLY  47  -8.484  13.069   4.720
  367    HA2  GLY  47           2HA      GLY  47  -9.068  15.247   3.100
  368    HA3  GLY  47           1HA      GLY  47  -7.686  15.707   4.067
  369    HA   PRO  48           HA       PRO  48  -4.732  13.488   1.645
  370    HB2  PRO  48           2HB      PRO  48  -4.591  11.209   3.556
  371    HB3  PRO  48           1HB      PRO  48  -3.294  12.191   2.872
  372    HG2  PRO  48           2HG      PRO  48  -4.015  12.629   5.341
  373    HG3  PRO  48           1HG      PRO  48  -3.828  14.029   4.260
  374    HD2  PRO  48           2HD      PRO  48  -6.346  12.596   5.062
  375    HD3  PRO  48           1HD      PRO  48  -5.990  14.334   5.066
  376    H    ALA  49           H        ALA  49  -4.373  10.444   2.043
  377    HA   ALA  49           HA       ALA  49  -5.081   9.525  -0.372
  378    HB1  ALA  49           1HB      ALA  49  -4.091   7.691   0.348
  379    HB2  ALA  49           2HB      ALA  49  -5.377   7.363   1.513
  380    HB3  ALA  49           3HB      ALA  49  -4.027   8.409   1.962
  381    H    SER  50           H        SER  50  -7.276   9.372   2.449
  382    HA   SER  50           HA       SER  50  -9.184   7.729   1.172
  383    HB2  SER  50           2HB      SER  50  -9.067   9.379   3.587
  384    HB3  SER  50           1HB      SER  50 -10.679   9.184   2.909
  385    HG   SER  50           HG       SER  50  -9.561   6.815   2.836
  386    H    GLU  51           H        GLU  51  -9.275  11.240   1.706
  387    HA   GLU  51           HA       GLU  51 -11.601  11.686   0.185
  388    HB2  GLU  51           2HB      GLU  51  -9.361  13.553   0.935
  389    HB3  GLU  51           1HB      GLU  51 -10.870  14.061   0.190
  390    HG2  GLU  51           2HG      GLU  51 -11.283  12.406   2.530
  391    HG3  GLU  51           1HG      GLU  51 -10.376  13.873   2.886
  392    H    ALA  52           H        ALA  52  -8.310  11.272  -0.646
  393    HA   ALA  52           HA       ALA  52  -8.373  12.447  -3.231
  394    HB1  ALA  52           1HB      ALA  52  -6.544  10.546  -1.822
  395    HB2  ALA  52           2HB      ALA  52  -6.235  12.198  -2.361
  396    HB3  ALA  52           3HB      ALA  52  -6.330  10.887  -3.539
  397    H    GLY  53           H        GLY  53  -9.401   9.409  -1.915
  398    HA2  GLY  53           2HA      GLY  53 -11.149   8.454  -3.530
  399    HA3  GLY  53           1HA      GLY  53  -9.778   8.320  -4.612
  400    H    LEU  54           H        LEU  54  -8.262   7.738  -1.903
  401    HA   LEU  54           HA       LEU  54  -8.225   4.930  -2.314
  402    HB2  LEU  54           2HB      LEU  54  -6.440   6.625  -1.283
  403    HB3  LEU  54           1HB      LEU  54  -7.126   6.023   0.206
  404    HG   LEU  54           HG       LEU  54  -5.893   4.329  -1.962
  405   HD11  LEU  54          1HD1      LEU  54  -4.172   5.565  -0.852
  406   HD12  LEU  54          2HD1      LEU  54  -4.149   3.910  -0.236
  407   HD13  LEU  54          3HD1      LEU  54  -4.866   5.201   0.727
  408   HD21  LEU  54          3HD2      LEU  54  -6.539   3.408   0.789
  409   HD22  LEU  54          1HD2      LEU  54  -6.312   2.472  -0.690
  410   HD23  LEU  54          2HD2      LEU  54  -7.781   3.420  -0.462
  411    H    ARG  55           H        ARG  55  -9.619   3.550  -1.689
  412    HA   ARG  55           HA       ARG  55 -11.265   4.065   0.673
  413    HB2  ARG  55           2HB      ARG  55 -12.577   2.050  -0.177
  414    HB3  ARG  55           1HB      ARG  55 -12.663   3.514  -1.144
  415    HG2  ARG  55           2HG      ARG  55 -12.247   2.147  -2.861
  416    HG3  ARG  55           1HG      ARG  55 -10.576   2.214  -2.310
  417    HD2  ARG  55           2HD      ARG  55 -11.318  -0.089  -2.685
  418    HD3  ARG  55           1HD      ARG  55 -10.881   0.207  -1.002
  419    HE   ARG  55           HE       ARG  55 -13.678   0.574  -1.475
  420   HH11  ARG  55          1HH1      ARG  55 -11.208  -1.838  -0.944
  421   HH12  ARG  55          2HH1      ARG  55 -12.299  -2.997  -0.260
  422   HH21  ARG  55          1HH2      ARG  55 -15.121  -0.941  -0.547
  423   HH22  ARG  55          2HH2      ARG  55 -14.527  -2.488  -0.035
  424    H    GLN  56           H        GLN  56 -10.854   3.062   2.523
  425    HA   GLN  56           HA       GLN  56  -8.654   1.498   3.055
  426    HB2  GLN  56           2HB      GLN  56 -10.169   2.637   4.702
  427    HB3  GLN  56           1HB      GLN  56 -11.272   1.300   4.535
  428    HG2  GLN  56           2HG      GLN  56  -9.655  -0.160   5.435
  429    HG3  GLN  56           1HG      GLN  56  -8.433   1.092   5.468
  430   HE21  GLN  56          1HE2      GLN  56  -9.552  -0.554   7.631
  431   HE22  GLN  56          2HE2      GLN  56 -10.171   0.568   8.797
  432    H    GLY  57           H        GLY  57  -8.201  -0.672   3.181
  433    HA2  GLY  57           2HA      GLY  57  -8.590  -2.971   3.016
  434    HA3  GLY  57           1HA      GLY  57 -10.267  -2.634   2.614
  435    H    ASP  58           H        ASP  58  -7.417  -1.323   1.008
  436    HA   ASP  58           HA       ASP  58  -8.159  -2.825  -1.424
  437    HB2  ASP  58           2HB      ASP  58  -8.414  -0.161  -1.236
  438    HB3  ASP  58           1HB      ASP  58  -6.716  -0.250  -1.705
  439    H    LEU  59           H        LEU  59  -6.534  -3.687  -2.629
  440    HA   LEU  59           HA       LEU  59  -4.003  -4.020  -1.229
  441    HB2  LEU  59           2HB      LEU  59  -4.950  -6.062  -1.963
  442    HB3  LEU  59           1HB      LEU  59  -5.310  -5.419  -3.551
  443    HG   LEU  59           HG       LEU  59  -2.743  -5.224  -3.812
  444   HD11  LEU  59          1HD1      LEU  59  -2.290  -5.697  -1.409
  445   HD12  LEU  59          2HD1      LEU  59  -1.430  -6.761  -2.523
  446   HD13  LEU  59          3HD1      LEU  59  -2.862  -7.344  -1.674
  447   HD21  LEU  59          3HD2      LEU  59  -4.230  -7.841  -3.804
  448   HD22  LEU  59          1HD2      LEU  59  -2.630  -7.624  -4.511
  449   HD23  LEU  59          2HD2      LEU  59  -4.007  -6.731  -5.157
  450    H    ILE  60           H        ILE  60  -2.185  -3.036  -1.823
  451    HA   ILE  60           HA       ILE  60  -2.271  -1.208  -4.074
  452    HB   ILE  60           HB       ILE  60  -0.141  -1.650  -1.970
  453   HG12  ILE  60          2HG1      ILE  60  -0.866   0.780  -1.439
  454   HG13  ILE  60          1HG1      ILE  60  -2.310   0.401  -2.368
  455   HG21  ILE  60          1HG2      ILE  60   0.922   0.373  -2.872
  456   HG22  ILE  60          2HG2      ILE  60  -0.271   0.414  -4.172
  457   HG23  ILE  60          3HG2      ILE  60   0.874  -0.925  -4.065
  458   HD11  ILE  60          3HD1      ILE  60  -2.938  -1.296  -0.820
  459   HD12  ILE  60          1HD1      ILE  60  -2.546   0.161   0.093
  460   HD13  ILE  60          2HD1      ILE  60  -1.394  -1.173   0.023
  461    H    THR  61           H        THR  61  -1.439  -1.613  -5.991
  462    HA   THR  61           HA       THR  61   0.160  -4.042  -6.325
  463    HB   THR  61           HB       THR  61  -0.513  -4.004  -8.649
  464    HG1  THR  61           1HG      THR  61  -0.647  -1.916  -9.270
  465   HG21  THR  61          3HG2      THR  61  -2.906  -3.335  -6.930
  466   HG22  THR  61          1HG2      THR  61  -2.114  -4.912  -6.977
  467   HG23  THR  61          2HG2      THR  61  -2.907  -4.281  -8.422
  468    H    HIS  62           H        HIS  62   0.092  -0.594  -7.100
  469    HA   HIS  62           HA       HIS  62   2.992  -0.684  -7.568
  470    HB2  HIS  62           2HB      HIS  62   1.021   0.770  -9.351
  471    HB3  HIS  62           1HB      HIS  62   2.769   0.789  -9.512
  472    HD2  HIS  62           2HD      HIS  62   3.884  -1.699 -10.379
  473    HE1  HIS  62           1HE      HIS  62   0.185  -3.085 -11.893
  474    HE2  HIS  62           2HE      HIS  62   2.704  -3.334 -12.008
  475    H    VAL  63           H        VAL  63   4.016   1.417  -7.387
  476    HA   VAL  63           HA       VAL  63   2.406   3.533  -6.210
  477    HB   VAL  63           HB       VAL  63   3.241   2.284  -4.281
  478   HG11  VAL  63          1HG1      VAL  63   5.260   1.337  -5.289
  479   HG12  VAL  63          2HG1      VAL  63   5.590   2.130  -3.749
  480   HG13  VAL  63          3HG1      VAL  63   6.009   2.933  -5.263
  481   HG21  VAL  63          3HG2      VAL  63   4.619   4.249  -3.284
  482   HG22  VAL  63          1HG2      VAL  63   2.939   4.508  -3.753
  483   HG23  VAL  63          2HG2      VAL  63   4.241   5.049  -4.812
  484    H    ASN  64           H        ASN  64   2.774   5.255  -7.365
  485    HA   ASN  64           HA       ASN  64   3.761   6.828  -8.680
  486    HB2  ASN  64           2HB      ASN  64   5.519   6.349  -6.508
  487    HB3  ASN  64           1HB      ASN  64   6.512   6.551  -7.948
  488   HD21  ASN  64          1HD2      ASN  64   7.320   8.530  -7.354
  489   HD22  ASN  64          2HD2      ASN  64   6.356   9.961  -7.285
  490    H    GLY  65           H        GLY  65   3.616   4.106  -9.701
  491    HA2  GLY  65           2HA      GLY  65   4.189   3.150 -11.731
  492    HA3  GLY  65           1HA      GLY  65   5.351   4.441 -11.960
  493    H    GLU  66           H        GLU  66   5.142   2.233  -9.262
  494    HA   GLU  66           HA       GLU  66   7.404   0.706 -10.141
  495    HB2  GLU  66           2HB      GLU  66   7.904   2.899  -8.726
  496    HB3  GLU  66           1HB      GLU  66   7.526   1.823  -7.394
  497    HG2  GLU  66           2HG      GLU  66   9.947   1.973  -7.930
  498    HG3  GLU  66           1HG      GLU  66   9.290   0.340  -7.964
  499    HA   PRO  67           HA       PRO  67   4.426  -2.224  -8.383
  500    HB2  PRO  67           2HB      PRO  67   6.413  -4.241  -8.626
  501    HB3  PRO  67           1HB      PRO  67   5.040  -3.956  -9.695
  502    HG2  PRO  67           2HG      PRO  67   7.864  -3.170 -10.006
  503    HG3  PRO  67           1HG      PRO  67   6.628  -3.446 -11.245
  504    HD2  PRO  67           2HD      PRO  67   7.494  -0.982 -10.564
  505    HD3  PRO  67           1HD      PRO  67   5.849  -1.273 -11.121
  506    H    VAL  68           H        VAL  68   4.171  -2.828  -6.422
  507    HA   VAL  68           HA       VAL  68   6.221  -2.216  -4.457
  508    HB   VAL  68           HB       VAL  68   4.466  -2.470  -2.777
  509   HG11  VAL  68          1HG1      VAL  68   3.730  -0.757  -5.150
  510   HG12  VAL  68          2HG1      VAL  68   4.659  -0.290  -3.723
  511   HG13  VAL  68          3HG1      VAL  68   2.939  -0.648  -3.575
  512   HG21  VAL  68          3HG2      VAL  68   3.209  -4.278  -3.801
  513   HG22  VAL  68          1HG2      VAL  68   2.680  -3.200  -5.092
  514   HG23  VAL  68          2HG2      VAL  68   2.149  -2.917  -3.434
  515    H    HIS  69           H        HIS  69   5.198  -4.665  -6.228
  516    HA   HIS  69           HA       HIS  69   5.079  -6.934  -4.720
  517    HB2  HIS  69           2HB      HIS  69   6.003  -6.308  -7.512
  518    HB3  HIS  69           1HB      HIS  69   5.817  -7.921  -6.914
  519    HD2  HIS  69           2HD      HIS  69   3.073  -5.453  -5.862
  520    HE1  HIS  69           1HE      HIS  69   1.569  -7.871  -8.993
  521    HE2  HIS  69           2HE      HIS  69   0.957  -6.324  -7.085
  522    H    GLY  70           H        GLY  70   6.648  -7.086  -3.101
  523    HA2  GLY  70           2HA      GLY  70   8.699  -8.372  -2.745
  524    HA3  GLY  70           1HA      GLY  70   9.395  -7.512  -4.111
  525    H    LEU  71           H        LEU  71   7.814  -5.108  -2.813
  526    HA   LEU  71           HA       LEU  71  10.133  -4.035  -1.499
  527    HB2  LEU  71           2HB      LEU  71   7.325  -2.963  -1.818
  528    HB3  LEU  71           1HB      LEU  71   8.623  -2.074  -1.049
  529    HG   LEU  71           HG       LEU  71   8.393  -2.852  -3.950
  530   HD11  LEU  71          1HD1      LEU  71   8.655  -0.184  -2.566
  531   HD12  LEU  71          2HD1      LEU  71   7.170  -0.856  -3.238
  532   HD13  LEU  71          3HD1      LEU  71   8.513  -0.446  -4.305
  533   HD21  LEU  71          3HD2      LEU  71  10.674  -3.238  -3.413
  534   HD22  LEU  71          1HD2      LEU  71  10.764  -1.764  -2.448
  535   HD23  LEU  71          2HD2      LEU  71  10.586  -1.663  -4.198
  536    H    VAL  72           H        VAL  72  10.492  -3.767   0.654
  537    HA   VAL  72           HA       VAL  72   8.912  -5.365   2.446
  538    HB   VAL  72           HB       VAL  72  11.525  -4.773   2.419
  539   HG11  VAL  72          1HG1      VAL  72  12.216  -3.150   3.936
  540   HG12  VAL  72          2HG1      VAL  72  10.615  -3.004   4.660
  541   HG13  VAL  72          3HG1      VAL  72  10.914  -2.359   3.048
  542   HG21  VAL  72          3HG2      VAL  72  10.318  -6.496   3.759
  543   HG22  VAL  72          1HG2      VAL  72  10.046  -5.267   4.994
  544   HG23  VAL  72          2HG2      VAL  72  11.689  -5.753   4.585
  545    H    HIS  73           H        HIS  73   8.312  -4.384   4.639
  546    HA   HIS  73           HA       HIS  73   6.153  -2.767   4.549
  547    HB2  HIS  73           2HB      HIS  73   7.351  -4.048   6.512
  548    HB3  HIS  73           1HB      HIS  73   8.026  -2.472   6.857
  549    HD1  HIS  73           1HD      HIS  73   5.322  -4.508   7.863
  550    HD2  HIS  73           2HD      HIS  73   5.767  -0.462   7.028
  551    HE1  HIS  73           1HE      HIS  73   3.409  -3.327   9.025
  552    H    THR  74           H        THR  74   9.445  -1.661   5.193
  553    HA   THR  74           HA       THR  74   8.614   1.093   5.333
  554    HB   THR  74           HB       THR  74  10.866   1.540   5.998
  555    HG1  THR  74           1HG      THR  74  12.327   0.432   4.903
  556   HG21  THR  74          3HG2      THR  74   9.513   0.479   7.697
  557   HG22  THR  74          1HG2      THR  74  11.157  -0.154   7.813
  558   HG23  THR  74          2HG2      THR  74   9.887  -1.122   7.051
  559    H    GLU  75           H        GLU  75   9.636  -0.978   2.804
  560    HA   GLU  75           HA       GLU  75  11.058   0.938   1.260
  561    HB2  GLU  75           2HB      GLU  75   9.881  -1.748   0.721
  562    HB3  GLU  75           1HB      GLU  75  10.386  -0.740  -0.623
  563    HG2  GLU  75           2HG      GLU  75  12.618  -0.537   0.617
  564    HG3  GLU  75           1HG      GLU  75  12.055  -1.912   1.561
  565    H    VAL  76           H        VAL  76   7.678  -0.171   1.265
  566    HA   VAL  76           HA       VAL  76   6.892   1.401  -0.952
  567    HB   VAL  76           HB       VAL  76   4.561   1.215   0.043
  568   HG11  VAL  76          1HG1      VAL  76   5.509  -0.270  -1.675
  569   HG12  VAL  76          2HG1      VAL  76   4.334  -1.074  -0.633
  570   HG13  VAL  76          3HG1      VAL  76   6.060  -1.349  -0.396
  571   HG21  VAL  76          3HG2      VAL  76   6.111   0.152   2.263
  572   HG22  VAL  76          1HG2      VAL  76   4.823  -0.934   1.740
  573   HG23  VAL  76          2HG2      VAL  76   4.435   0.725   2.222
  574    H    VAL  77           H        VAL  77   6.774   1.940   2.511
  575    HA   VAL  77           HA       VAL  77   5.673   4.458   2.631
  576    HB   VAL  77           HB       VAL  77   7.849   3.270   4.327
  577   HG11  VAL  77          1HG1      VAL  77   7.038   4.891   6.063
  578   HG12  VAL  77          2HG1      VAL  77   6.154   5.706   4.774
  579   HG13  VAL  77          3HG1      VAL  77   7.912   5.612   4.711
  580   HG21  VAL  77          3HG2      VAL  77   6.197   2.427   5.731
  581   HG22  VAL  77          1HG2      VAL  77   5.551   2.132   4.114
  582   HG23  VAL  77          2HG2      VAL  77   4.961   3.495   5.067
  583    H    GLU  78           H        GLU  78   9.082   3.550   2.275
  584    HA   GLU  78           HA       GLU  78  10.157   6.122   2.106
  585    HB2  GLU  78           2HB      GLU  78  11.040   3.435   1.179
  586    HB3  GLU  78           1HB      GLU  78  11.893   4.849   0.573
  587    HG2  GLU  78           2HG      GLU  78  11.946   5.486   3.120
  588    HG3  GLU  78           1HG      GLU  78  11.749   3.746   3.305
  589    H    LEU  79           H        LEU  79   9.133   3.920  -0.477
  590    HA   LEU  79           HA       LEU  79   9.707   5.467  -2.695
  591    HB2  LEU  79           2HB      LEU  79   8.295   3.111  -2.188
  592    HB3  LEU  79           1HB      LEU  79   7.131   4.155  -2.978
  593    HG   LEU  79           HG       LEU  79   8.222   2.752  -4.621
  594   HD11  LEU  79          1HD1      LEU  79   7.615   5.019  -5.302
  595   HD12  LEU  79          2HD1      LEU  79   9.046   4.444  -6.157
  596   HD13  LEU  79          3HD1      LEU  79   9.214   5.591  -4.828
  597   HD21  LEU  79          3HD2      LEU  79  10.290   2.320  -3.386
  598   HD22  LEU  79          1HD2      LEU  79  10.811   3.980  -3.674
  599   HD23  LEU  79          2HD2      LEU  79  10.619   2.870  -5.030
  600    H    ILE  80           H        ILE  80   6.867   5.580  -0.599
  601    HA   ILE  80           HA       ILE  80   5.451   7.501  -2.115
  602    HB   ILE  80           HB       ILE  80   5.239   6.474   0.698
  603   HG12  ILE  80          2HG1      ILE  80   3.092   6.393  -1.375
  604   HG13  ILE  80          1HG1      ILE  80   4.477   5.322  -1.559
  605   HG21  ILE  80          1HG2      ILE  80   2.994   7.770   0.631
  606   HG22  ILE  80          2HG2      ILE  80   3.834   8.791  -0.540
  607   HG23  ILE  80          3HG2      ILE  80   4.475   8.608   1.090
  608   HD11  ILE  80          3HD1      ILE  80   2.647   4.202  -0.449
  609   HD12  ILE  80          1HD1      ILE  80   2.624   5.443   0.802
  610   HD13  ILE  80          2HD1      ILE  80   4.020   4.378   0.645
  611    H    LEU  81           H        LEU  81   7.355   7.783   0.890
  612    HA   LEU  81           HA       LEU  81   7.155  10.561   1.182
  613    HB2  LEU  81           2HB      LEU  81   9.457   8.776   1.981
  614    HB3  LEU  81           1HB      LEU  81   9.126  10.375   2.617
  615    HG   LEU  81           HG       LEU  81   7.235   8.051   2.944
  616   HD11  LEU  81          1HD1      LEU  81   9.340   7.514   4.036
  617   HD12  LEU  81          2HD1      LEU  81   8.096   7.881   5.232
  618   HD13  LEU  81          3HD1      LEU  81   9.333   9.078   4.851
  619   HD21  LEU  81          3HD2      LEU  81   7.443  10.730   4.309
  620   HD22  LEU  81          1HD2      LEU  81   6.293   9.456   4.720
  621   HD23  LEU  81          2HD2      LEU  81   6.212  10.245   3.145
  622    H    LYS  82           H        LYS  82   9.393   8.586  -0.638
  623    HA   LYS  82           HA       LYS  82  11.297  10.483  -1.365
  624    HB2  LYS  82           2HB      LYS  82  11.258   7.945  -1.628
  625    HB3  LYS  82           1HB      LYS  82  10.423   8.291  -3.117
  626    HG2  LYS  82           2HG      LYS  82  12.392   9.795  -3.696
  627    HG3  LYS  82           1HG      LYS  82  13.225   8.966  -2.376
  628    HD2  LYS  82           2HD      LYS  82  11.878   7.547  -4.658
  629    HD3  LYS  82           1HD      LYS  82  13.594   7.968  -4.652
  630    HE2  LYS  82           2HE      LYS  82  13.732   6.708  -2.448
  631    HE3  LYS  82           1HE      LYS  82  12.126   6.091  -2.819
  632    HZ1  LYS  82           3HZ      LYS  82  13.845   4.550  -3.509
  633    HZ2  LYS  82           1HZ      LYS  82  14.546   5.732  -4.492
  634    HZ3  LYS  82           2HZ      LYS  82  13.008   5.136  -4.857
  635    H    SER  83           H        SER  83   8.279   9.566  -2.863
  636    HA   SER  83           HA       SER  83   8.448  10.872  -5.278
  637    HB2  SER  83           2HB      SER  83   6.599   9.402  -4.744
  638    HB3  SER  83           1HB      SER  83   6.032  10.508  -3.495
  639    HG   SER  83           HG       SER  83   5.079  11.661  -4.959
  640    H    GLY  84           H        GLY  84   7.311  12.256  -2.175
  641    HA2  GLY  84           2HA      GLY  84   8.316  14.614  -1.982
  642    HA3  GLY  84           1HA      GLY  84   7.418  14.906  -3.462
  643    H    ASN  85           H        ASN  85   5.872  16.284  -2.884
  644    HA   ASN  85           HA       ASN  85   4.538  16.118  -0.335
  645    HB2  ASN  85           2HB      ASN  85   3.243  18.055  -1.154
  646    HB3  ASN  85           1HB      ASN  85   4.977  18.299  -1.301
  647   HD21  ASN  85          1HD2      ASN  85   5.884  18.520  -3.305
  648   HD22  ASN  85          2HD2      ASN  85   4.957  18.656  -4.757
  649    H    LYS  86           H        LYS  86   4.225  14.336  -2.999
  650    HA   LYS  86           HA       LYS  86   1.593  13.436  -2.309
  651    HB2  LYS  86           2HB      LYS  86   0.784  13.684  -4.630
  652    HB3  LYS  86           1HB      LYS  86   0.953  15.191  -3.784
  653    HG2  LYS  86           2HG      LYS  86   2.633  15.922  -5.131
  654    HG3  LYS  86           1HG      LYS  86   3.249  14.296  -5.418
  655    HD2  LYS  86           2HD      LYS  86   1.333  13.846  -6.890
  656    HD3  LYS  86           1HD      LYS  86   0.760  15.494  -6.627
  657    HE2  LYS  86           2HE      LYS  86   1.960  15.329  -8.736
  658    HE3  LYS  86           1HE      LYS  86   2.822  16.368  -7.604
  659    HZ1  LYS  86           3HZ      LYS  86   4.347  14.590  -7.134
  660    HZ2  LYS  86           1HZ      LYS  86   4.285  14.833  -8.807
  661    HZ3  LYS  86           2HZ      LYS  86   3.481  13.520  -8.114
  662    H    VAL  87           H        VAL  87   0.955  11.698  -3.996
  663    HA   VAL  87           HA       VAL  87   3.083  10.334  -5.347
  664    HB   VAL  87           HB       VAL  87   3.699   9.850  -3.004
  665   HG11  VAL  87          1HG1      VAL  87   2.303   8.227  -1.737
  666   HG12  VAL  87          2HG1      VAL  87   1.038   8.452  -2.943
  667   HG13  VAL  87          3HG1      VAL  87   1.554   9.811  -1.945
  668   HG21  VAL  87          3HG2      VAL  87   2.911   7.582  -4.798
  669   HG22  VAL  87          1HG2      VAL  87   3.766   7.318  -3.278
  670   HG23  VAL  87          2HG2      VAL  87   4.508   8.289  -4.550
  671    H    ALA  88           H        ALA  88   2.424   8.594  -6.572
  672    HA   ALA  88           HA       ALA  88  -0.471   8.328  -6.927
  673    HB1  ALA  88           1HB      ALA  88   0.784   8.841  -8.915
  674    HB2  ALA  88           2HB      ALA  88   0.110   7.213  -9.045
  675    HB3  ALA  88           3HB      ALA  88   1.819   7.435  -8.663
  676    H    ILE  89           H        ILE  89  -1.101   6.905  -5.305
  677    HA   ILE  89           HA       ILE  89   0.266   4.342  -5.102
  678    HB   ILE  89           HB       ILE  89  -0.346   5.221  -2.983
  679   HG12  ILE  89          2HG1      ILE  89  -2.493   3.182  -3.527
  680   HG13  ILE  89          1HG1      ILE  89  -0.786   2.756  -3.463
  681   HG21  ILE  89          1HG2      ILE  89  -2.026   6.812  -3.599
  682   HG22  ILE  89          2HG2      ILE  89  -2.689   5.732  -2.371
  683   HG23  ILE  89          3HG2      ILE  89  -3.136   5.524  -4.064
  684   HD11  ILE  89          3HD1      ILE  89  -2.122   2.413  -1.356
  685   HD12  ILE  89          1HD1      ILE  89  -2.187   4.168  -1.223
  686   HD13  ILE  89          2HD1      ILE  89  -0.631   3.339  -1.191
  687    H    SER  90           H        SER  90  -0.231   2.748  -6.470
  688    HA   SER  90           HA       SER  90  -2.814   2.797  -7.818
  689    HB2  SER  90           2HB      SER  90  -0.327   2.282  -8.745
  690    HB3  SER  90           1HB      SER  90  -0.888   0.641  -8.426
  691    HG   SER  90           HG       SER  90  -2.785   2.141  -9.666
  692    H    THR  91           H        THR  91  -4.436   1.868  -6.836
  693    HA   THR  91           HA       THR  91  -3.998  -0.553  -5.233
  694    HB   THR  91           HB       THR  91  -6.338  -0.039  -4.402
  695    HG1  THR  91           1HG      THR  91  -7.374   1.478  -5.446
  696   HG21  THR  91          3HG2      THR  91  -4.343   2.190  -3.992
  697   HG22  THR  91          1HG2      THR  91  -4.264   0.626  -3.177
  698   HG23  THR  91          2HG2      THR  91  -5.632   1.701  -2.892
  699    H    THR  92           H        THR  92  -5.990  -2.127  -5.332
  700    HA   THR  92           HA       THR  92  -6.545  -2.476  -8.211
  701    HB   THR  92           HB       THR  92  -5.204  -4.289  -7.363
  702    HG1  THR  92           1HG      THR  92  -7.887  -4.820  -8.041
  703   HG21  THR  92          3HG2      THR  92  -7.407  -4.831  -5.378
  704   HG22  THR  92          1HG2      THR  92  -5.843  -4.110  -4.991
  705   HG23  THR  92          2HG2      THR  92  -5.927  -5.766  -5.593
  706    HA   PRO  93           HA       PRO  93 -10.766  -1.327  -7.001
  707    HB2  PRO  93           2HB      PRO  93 -11.103  -2.080  -9.863
  708    HB3  PRO  93           1HB      PRO  93 -11.714  -0.667  -8.992
  709    HG2  PRO  93           2HG      PRO  93  -9.611  -0.489 -10.646
  710    HG3  PRO  93           1HG      PRO  93  -9.686   0.456  -9.158
  711    HD2  PRO  93           2HD      PRO  93  -8.046  -1.906  -9.798
  712    HD3  PRO  93           1HD      PRO  93  -7.711  -0.572  -8.690
  713    H    LEU  94           H        LEU  94 -12.881  -2.405  -7.375
  714    HA   LEU  94           HA       LEU  94 -12.816  -5.084  -6.530
  715    HB2  LEU  94           2HB      LEU  94 -15.344  -4.344  -7.716
  716    HB3  LEU  94           1HB      LEU  94 -14.970  -4.709  -6.060
  717    HG   LEU  94           HG       LEU  94 -13.995  -2.255  -6.089
  718   HD11  LEU  94          1HD1      LEU  94 -14.309  -1.523  -8.220
  719   HD12  LEU  94          2HD1      LEU  94 -15.846  -1.020  -7.503
  720   HD13  LEU  94          3HD1      LEU  94 -15.754  -2.510  -8.441
  721   HD21  LEU  94          3HD2      LEU  94 -15.735  -3.053  -4.585
  722   HD22  LEU  94          1HD2      LEU  94 -16.926  -2.943  -5.882
  723   HD23  LEU  94          2HD2      LEU  94 -16.170  -1.481  -5.253
  724    H    GLU  95           H        GLU  95 -13.973  -6.877  -7.610
  725    HA   GLU  95           HA       GLU  95 -14.104  -6.855 -10.484
  726    HB2  GLU  95           2HB      GLU  95 -12.403  -8.469 -10.926
  727    HB3  GLU  95           1HB      GLU  95 -11.660  -7.198  -9.969
  728    HG2  GLU  95           2HG      GLU  95 -12.673  -9.762  -8.775
  729    HG3  GLU  95           1HG      GLU  95 -11.032  -9.564  -9.376
  730    H    ASN  96           H        ASN  96 -14.445  -9.298 -11.203
  731    HA   ASN  96           HA       ASN  96 -16.767 -10.190  -9.781
  732    HB2  ASN  96           2HB      ASN  96 -17.104 -11.708 -11.568
  733    HB3  ASN  96           1HB      ASN  96 -16.415 -10.270 -12.312
  734   HD21  ASN  96          1HD2      ASN  96 -14.326 -10.336 -13.118
  735   HD22  ASN  96          2HD2      ASN  96 -13.494 -11.828 -13.397
  736    H1   SER 101           1HT      SER 101  -6.824 -15.514   2.897
  737    H2   SER 101           2HT      SER 101  -7.867 -14.245   3.299
  738    H3   SER 101           3HT      SER 101  -6.409 -14.434   4.129
  739    HA   SER 101           HA       SER 101  -6.611 -13.874   1.238
  740    HB2  SER 101           2HB      SER 101  -5.854 -11.891   3.382
  741    HB3  SER 101           1HB      SER 101  -6.237 -11.572   1.691
  742    HG   SER 101           HG       SER 101  -8.211 -11.305   2.318
  743    H    TRP 102           H        TRP 102  -4.537 -13.478   4.127
  744    HA   TRP 102           HA       TRP 102  -2.321 -14.579   2.555
  745    HB2  TRP 102           2HB      TRP 102  -0.793 -12.912   3.314
  746    HB3  TRP 102           1HB      TRP 102  -2.200 -12.064   2.685
  747    HD1  TRP 102           HD       TRP 102  -0.356 -12.795   5.948
  748    HE1  TRP 102           1HE      TRP 102  -1.199 -11.174   7.764
  749    HE3  TRP 102           3HE      TRP 102  -4.226 -10.650   3.385
  750    HZ2  TRP 102           2HZ      TRP 102  -3.226  -9.248   8.061
  751    HZ3  TRP 102           3HZ      TRP 102  -5.563  -8.919   4.520
  752    HH2  TRP 102           HH       TRP 102  -5.064  -8.241   6.797
  753    H    GLU 103           H        GLU 103  -0.537 -15.352   3.932
  754    HA   GLU 103           HA       GLU 103  -1.472 -17.066   5.938
  755    HB2  GLU 103           2HB      GLU 103   1.228 -16.225   4.966
  756    HB3  GLU 103           1HB      GLU 103   1.111 -17.179   6.435
  757    HG2  GLU 103           2HG      GLU 103   1.527 -18.523   4.409
  758    HG3  GLU 103           1HG      GLU 103   0.056 -18.977   5.267
  759    H    SER 104           H        SER 104   1.019 -14.576   6.463
  760    HA   SER 104           HA       SER 104  -0.412 -13.465   8.688
  761    HB2  SER 104           2HB      SER 104   1.755 -14.017  10.141
  762    HB3  SER 104           1HB      SER 104   0.364 -15.099  10.081
  763    HG   SER 104           HG       SER 104   1.579 -16.543   9.178
  764    H    HIS 105           H        HIS 105   0.957 -11.839   9.853
  765    HA   HIS 105           HA       HIS 105   2.671 -10.439   7.916
  766    HB2  HIS 105           2HB      HIS 105   0.725  -9.137   8.396
  767    HB3  HIS 105           1HB      HIS 105   0.854  -9.448  10.120
  768    HD2  HIS 105           2HD      HIS 105   3.909  -8.089   8.084
  769    HE1  HIS 105           1HE      HIS 105   2.511  -5.107  10.736
  770    HE2  HIS 105           2HE      HIS 105   4.454  -5.870   9.307
  771    H    LYS 106           H        LYS 106   4.727 -10.914   8.378
  772    HA   LYS 106           HA       LYS 106   5.630 -10.549  11.152
  773    HB2  LYS 106           2HB      LYS 106   5.681 -12.970   9.630
  774    HB3  LYS 106           1HB      LYS 106   7.336 -12.429   9.864
  775    HG2  LYS 106           2HG      LYS 106   6.809 -13.890  11.649
  776    HG3  LYS 106           1HG      LYS 106   6.840 -12.256  12.310
  777    HD2  LYS 106           2HD      LYS 106   4.373 -12.176  12.101
  778    HD3  LYS 106           1HD      LYS 106   4.396 -13.855  11.559
  779    HE2  LYS 106           2HE      LYS 106   5.433 -14.512  13.679
  780    HE3  LYS 106           1HE      LYS 106   5.376 -12.838  14.224
  781    HZ1  LYS 106           3HZ      LYS 106   2.936 -12.941  13.982
  782    HZ2  LYS 106           1HZ      LYS 106   3.533 -14.025  15.134
  783    HZ3  LYS 106           2HZ      LYS 106   3.061 -14.587  13.615
  784    H    SER 107           H        SER 107   5.626  -8.942   8.595
  785    HA   SER 107           HA       SER 107   8.518  -8.427   8.489
  786    HB2  SER 107           2HB      SER 107   6.517  -8.121   6.237
  787    HB3  SER 107           1HB      SER 107   8.236  -7.737   6.146
  788    HG   SER 107           HG       SER 107   8.708  -9.908   6.455
  789    H    GLY 108           H        GLY 108   8.896  -6.616   9.568
  790    HA2  GLY 108           2HA      GLY 108   8.867  -4.327   9.953
  791    HA3  GLY 108           1HA      GLY 108   7.548  -4.183   8.802
  792    H    GLY 109           H        GLY 109   7.524  -2.740  11.133
  793    HA2  GLY 109           2HA      GLY 109   5.963  -4.118  13.136
  794    HA3  GLY 109           1HA      GLY 109   6.389  -2.411  13.127
  795    H    GLU 110           H        GLU 110   4.844  -0.999  12.673
  796    HA   GLU 110           HA       GLU 110   2.564  -1.782  11.011
  797    HB2  GLU 110           2HB      GLU 110   2.324  -0.635  13.810
  798    HB3  GLU 110           1HB      GLU 110   0.992  -0.755  12.673
  799    HG2  GLU 110           2HG      GLU 110   1.401  -3.242  12.635
  800    HG3  GLU 110           1HG      GLU 110   2.504  -2.995  13.987
  801    H    THR 111           H        THR 111   4.667  -0.260  10.267
  802    HA   THR 111           HA       THR 111   4.470   2.508  10.734
  803    HB   THR 111           HB       THR 111   5.513   1.239   8.199
  804    HG1  THR 111           1HG      THR 111   6.395   0.987  10.800
  805   HG21  THR 111          3HG2      THR 111   6.354   3.712   9.723
  806   HG22  THR 111          1HG2      THR 111   5.407   3.693   8.235
  807   HG23  THR 111          2HG2      THR 111   7.074   3.121   8.226
  808    H    ARG 112           H        ARG 112   3.574   4.164   9.463
  809    HA   ARG 112           HA       ARG 112   1.744   3.382   7.338
  810    HB2  ARG 112           2HB      ARG 112  -0.092   4.714   8.328
  811    HB3  ARG 112           1HB      ARG 112   0.330   3.306   9.290
  812    HG2  ARG 112           2HG      ARG 112   1.864   5.071  10.529
  813    HG3  ARG 112           1HG      ARG 112   0.655   6.188   9.896
  814    HD2  ARG 112           2HD      ARG 112  -0.024   5.493  12.089
  815    HD3  ARG 112           1HD      ARG 112  -1.111   4.763  10.905
  816    HE   ARG 112           HE       ARG 112   1.108   3.083  11.624
  817   HH11  ARG 112          1HH1      ARG 112  -2.150   4.043  12.460
  818   HH12  ARG 112          2HH1      ARG 112  -2.471   2.604  13.373
  819   HH21  ARG 112          1HH2      ARG 112   0.688   1.192  12.800
  820   HH22  ARG 112          2HH2      ARG 112  -0.854   0.983  13.579
  821    H    LEU 113           H        LEU 113   0.776   5.370   6.304
  822    HA   LEU 113           HA       LEU 113   2.896   7.380   6.026
  823    HB2  LEU 113           2HB      LEU 113   0.695   6.431   4.207
  824    HB3  LEU 113           1HB      LEU 113   1.548   7.928   3.906
  825    HG   LEU 113           HG       LEU 113   2.557   6.316   2.517
  826   HD11  LEU 113          1HD1      LEU 113   4.109   7.778   3.782
  827   HD12  LEU 113          2HD1      LEU 113   4.816   6.256   3.242
  828   HD13  LEU 113          3HD1      LEU 113   4.338   6.457   4.928
  829   HD21  LEU 113          3HD2      LEU 113   1.649   4.322   3.590
  830   HD22  LEU 113          1HD2      LEU 113   2.794   4.513   4.918
  831   HD23  LEU 113          2HD2      LEU 113   3.379   4.164   3.291
  Start of MODEL    8
    1    H1   GLY   1           1HT      GLY   1  -9.823 -12.152 -11.596
    2    H2   GLY   1           2HT      GLY   1  -9.945 -11.486 -13.144
    3    H3   GLY   1           3HT      GLY   1 -11.013 -10.998 -11.931
    4    HA2  GLY   1           1HA      GLY   1  -9.169 -10.034 -10.676
    5    HA3  GLY   1           2HA      GLY   1  -8.087 -10.514 -11.977
    6    H    GLY   2           H        GLY   2  -7.517  -8.261 -12.178
    7    HA2  GLY   2           2HA      GLY   2  -9.340  -6.893 -14.004
    8    HA3  GLY   2           1HA      GLY   2  -8.907  -6.038 -12.531
    9    H    SER   3           H        SER   3  -8.312  -4.861 -14.876
   10    HA   SER   3           HA       SER   3  -5.383  -5.042 -14.930
   11    HB2  SER   3           2HB      SER   3  -7.038  -4.619 -17.424
   12    HB3  SER   3           1HB      SER   3  -5.307  -4.928 -17.316
   13    HG   SER   3           HG       SER   3  -5.769  -7.027 -16.614
   14    H    MET   4           H        MET   4  -4.341  -3.074 -15.662
   15    HA   MET   4           HA       MET   4  -3.984  -0.840 -15.636
   16    HB2  MET   4           2HB      MET   4  -6.875  -0.768 -16.505
   17    HB3  MET   4           1HB      MET   4  -5.832   0.644 -16.458
   18    HG2  MET   4           2HG      MET   4  -4.350  -0.383 -18.096
   19    HG3  MET   4           1HG      MET   4  -5.369  -1.819 -18.124
   20    HE1  MET   4           3HE      MET   4  -6.527   2.000 -18.000
   21    HE2  MET   4           1HE      MET   4  -6.581   2.333 -19.730
   22    HE3  MET   4           2HE      MET   4  -5.044   1.951 -18.953
   23    H    ARG   5           H        ARG   5  -3.722  -1.150 -13.329
   24    HA   ARG   5           HA       ARG   5  -5.858  -0.511 -11.546
   25    HB2  ARG   5           2HB      ARG   5  -2.882  -0.810 -11.181
   26    HB3  ARG   5           1HB      ARG   5  -3.932  -0.313  -9.863
   27    HG2  ARG   5           2HG      ARG   5  -3.723  -2.596  -9.540
   28    HG3  ARG   5           1HG      ARG   5  -5.256  -2.465 -10.400
   29    HD2  ARG   5           2HD      ARG   5  -4.101  -2.986 -12.507
   30    HD3  ARG   5           1HD      ARG   5  -2.584  -3.146 -11.624
   31    HE   ARG   5           HE       ARG   5  -4.664  -4.856 -10.626
   32   HH11  ARG   5          1HH1      ARG   5  -2.156  -4.551 -13.056
   33   HH12  ARG   5          2HH1      ARG   5  -1.946  -6.264 -13.225
   34   HH21  ARG   5          1HH2      ARG   5  -4.413  -7.107 -10.895
   35   HH22  ARG   5          2HH2      ARG   5  -3.226  -7.708 -12.011
   36    HA   PRO   6           HA       PRO   6  -5.276   3.906 -11.930
   37    HB2  PRO   6           2HB      PRO   6  -7.392   4.415 -10.122
   38    HB3  PRO   6           1HB      PRO   6  -7.506   4.276 -11.877
   39    HG2  PRO   6           2HG      PRO   6  -8.644   2.502 -10.056
   40    HG3  PRO   6           1HG      PRO   6  -8.341   2.162 -11.760
   41    HD2  PRO   6           2HD      PRO   6  -6.709   1.476  -9.350
   42    HD3  PRO   6           1HD      PRO   6  -7.121   0.483 -10.762
   43    HA   PRO   7           HA       PRO   7  -2.945   4.647  -8.104
   44    HB2  PRO   7           2HB      PRO   7  -1.853   6.913  -9.552
   45    HB3  PRO   7           1HB      PRO   7  -1.024   5.510  -8.880
   46    HG2  PRO   7           2HG      PRO   7  -1.292   5.894 -11.536
   47    HG3  PRO   7           1HG      PRO   7  -1.285   4.277 -10.811
   48    HD2  PRO   7           2HD      PRO   7  -3.622   5.927 -11.729
   49    HD3  PRO   7           1HD      PRO   7  -3.320   4.187 -11.940
   50    H    ILE   8           H        ILE   8  -3.847   5.653  -6.503
   51    HA   ILE   8           HA       ILE   8  -5.426   8.042  -6.870
   52    HB   ILE   8           HB       ILE   8  -4.774   6.838  -4.209
   53   HG12  ILE   8          2HG1      ILE   8  -7.103   5.790  -5.656
   54   HG13  ILE   8          1HG1      ILE   8  -5.571   5.244  -6.233
   55   HG21  ILE   8          1HG2      ILE   8  -6.245   8.919  -4.766
   56   HG22  ILE   8          2HG2      ILE   8  -6.775   7.750  -3.554
   57   HG23  ILE   8          3HG2      ILE   8  -7.430   7.686  -5.189
   58   HD11  ILE   8          3HD1      ILE   8  -5.017   4.250  -4.168
   59   HD12  ILE   8          1HD1      ILE   8  -6.674   3.772  -4.539
   60   HD13  ILE   8          2HD1      ILE   8  -6.367   5.051  -3.365
   61    H    ILE   9           H        ILE   9  -4.338   9.897  -7.008
   62    HA   ILE   9           HA       ILE   9  -1.706  10.183  -5.910
   63    HB   ILE   9           HB       ILE   9  -3.289  12.510  -6.914
   64   HG12  ILE   9          2HG1      ILE   9  -3.631  10.575  -8.501
   65   HG13  ILE   9          1HG1      ILE   9  -2.845  11.982  -9.206
   66   HG21  ILE   9          1HG2      ILE   9  -1.074  12.925  -6.031
   67   HG22  ILE   9          2HG2      ILE   9  -1.073  13.183  -7.775
   68   HG23  ILE   9          3HG2      ILE   9  -0.384  11.704  -7.102
   69   HD11  ILE   9          3HD1      ILE   9  -1.789   9.976  -9.989
   70   HD12  ILE   9          1HD1      ILE   9  -1.518   9.427  -8.335
   71   HD13  ILE   9          2HD1      ILE   9  -0.674  10.852  -8.942
   72    H    ILE  10           H        ILE  10  -1.740  10.147  -3.692
   73    HA   ILE  10           HA       ILE  10  -3.598  11.759  -2.169
   74    HB   ILE  10           HB       ILE  10  -0.989  10.569  -1.162
   75   HG12  ILE  10          2HG1      ILE  10  -3.469   9.196  -0.440
   76   HG13  ILE  10          1HG1      ILE  10  -3.019   9.031  -2.116
   77   HG21  ILE  10          1HG2      ILE  10  -2.384  10.542   1.007
   78   HG22  ILE  10          2HG2      ILE  10  -3.413  11.707   0.176
   79   HG23  ILE  10          3HG2      ILE  10  -1.709  12.073   0.451
   80   HD11  ILE  10          3HD1      ILE  10  -0.968   8.037  -1.580
   81   HD12  ILE  10          1HD1      ILE  10  -2.180   7.268  -0.554
   82   HD13  ILE  10          2HD1      ILE  10  -1.120   8.510   0.112
   83    H    HIS  11           H        HIS  11  -2.783  13.526  -0.738
   84    HA   HIS  11           HA       HIS  11  -0.358  14.816  -1.726
   85    HB2  HIS  11           2HB      HIS  11  -2.237  15.890  -2.910
   86    HB3  HIS  11           1HB      HIS  11  -3.033  16.211  -1.373
   87    HD2  HIS  11           2HD      HIS  11   0.223  17.354  -3.272
   88    HE1  HIS  11           1HE      HIS  11  -0.930  20.318  -0.481
   89    HE2  HIS  11           2HE      HIS  11   0.595  19.780  -2.433
   90    H    ARG  12           H        ARG  12   0.885  14.978  -0.036
   91    HA   ARG  12           HA       ARG  12   0.060  14.659   2.627
   92    HB2  ARG  12           2HB      ARG  12   2.366  14.328   1.599
   93    HB3  ARG  12           1HB      ARG  12   2.572  16.067   1.743
   94    HG2  ARG  12           2HG      ARG  12   2.425  15.967   4.115
   95    HG3  ARG  12           1HG      ARG  12   1.934  14.271   4.066
   96    HD2  ARG  12           2HD      ARG  12   4.064  13.607   3.233
   97    HD3  ARG  12           1HD      ARG  12   4.565  15.281   3.013
   98    HE   ARG  12           HE       ARG  12   3.956  14.279   5.711
   99   HH11  ARG  12          1HH1      ARG  12   6.248  15.579   3.400
  100   HH12  ARG  12          2HH1      ARG  12   7.482  15.838   4.588
  101   HH21  ARG  12          1HH2      ARG  12   5.573  14.637   7.272
  102   HH22  ARG  12          2HH2      ARG  12   7.098  15.307   6.790
  103    H    ALA  13           H        ALA  13  -1.312  16.009   3.571
  104    HA   ALA  13           HA       ALA  13  -1.365  18.831   3.015
  105    HB1  ALA  13           1HB      ALA  13  -2.887  17.461   5.212
  106    HB2  ALA  13           2HB      ALA  13  -3.361  17.309   3.521
  107    HB3  ALA  13           3HB      ALA  13  -3.331  18.897   4.288
  108    H    GLY  14           H        GLY  14   1.123  18.411   3.907
  109    HA2  GLY  14           2HA      GLY  14   2.637  19.281   5.403
  110    HA3  GLY  14           1HA      GLY  14   1.292  20.118   6.162
  111    H    LYS  15           H        LYS  15   1.167  16.675   5.858
  112    HA   LYS  15           HA       LYS  15   2.252  16.233   8.498
  113    HB2  LYS  15           2HB      LYS  15   0.032  14.959   9.083
  114    HB3  LYS  15           1HB      LYS  15   0.185  16.682   9.386
  115    HG2  LYS  15           2HG      LYS  15  -1.170  17.238   7.555
  116    HG3  LYS  15           1HG      LYS  15  -1.037  15.623   6.857
  117    HD2  LYS  15           2HD      LYS  15  -3.151  15.581   7.795
  118    HD3  LYS  15           1HD      LYS  15  -2.166  14.855   9.064
  119    HE2  LYS  15           2HE      LYS  15  -2.119  16.912  10.291
  120    HE3  LYS  15           1HE      LYS  15  -2.896  17.779   8.964
  121    HZ1  LYS  15           3HZ      LYS  15  -4.119  15.632  10.612
  122    HZ2  LYS  15           1HZ      LYS  15  -4.866  16.394   9.299
  123    HZ3  LYS  15           2HZ      LYS  15  -4.490  17.279  10.687
  124    H    LYS  16           H        LYS  16  -0.111  14.286   6.682
  125    HA   LYS  16           HA       LYS  16   1.919  12.491   5.720
  126    HB2  LYS  16           2HB      LYS  16   0.970  10.524   6.940
  127    HB3  LYS  16           1HB      LYS  16   1.817  11.665   7.966
  128    HG2  LYS  16           2HG      LYS  16  -0.433  12.651   8.530
  129    HG3  LYS  16           1HG      LYS  16  -1.146  11.257   7.717
  130    HD2  LYS  16           2HD      LYS  16   0.377   9.859   9.251
  131    HD3  LYS  16           1HD      LYS  16   0.531  11.334  10.200
  132    HE2  LYS  16           2HE      LYS  16  -2.070   9.984   9.496
  133    HE3  LYS  16           1HE      LYS  16  -1.241   9.842  11.043
  134    HZ1  LYS  16           3HZ      LYS  16  -3.042  11.808  10.221
  135    HZ2  LYS  16           1HZ      LYS  16  -1.540  12.562  10.444
  136    HZ3  LYS  16           2HZ      LYS  16  -2.235  11.681  11.706
  137    H    TYR  17           H        TYR  17   0.687  10.379   4.888
  138    HA   TYR  17           HA       TYR  17  -1.433  11.394   3.158
  139    HB2  TYR  17           2HB      TYR  17  -0.189   8.648   3.009
  140    HB3  TYR  17           1HB      TYR  17  -1.007   9.545   1.722
  141    HD1  TYR  17           1HD      TYR  17   2.101   9.330   3.717
  142    HD2  TYR  17           2HD      TYR  17   0.166  11.182   0.428
  143    HE1  TYR  17           1HE      TYR  17   4.254  10.247   2.983
  144    HE2  TYR  17           2HE      TYR  17   2.313  12.129  -0.315
  145    HH   TYR  17           HH       TYR  17   4.499  12.541   0.359
  146    H    GLY  18           H        GLY  18  -1.308  10.278   6.086
  147    HA2  GLY  18           2HA      GLY  18  -2.783   9.533   7.610
  148    HA3  GLY  18           1HA      GLY  18  -4.022   9.756   6.409
  149    H    PHE  19           H        PHE  19  -2.584   7.701   4.734
  150    HA   PHE  19           HA       PHE  19  -4.118   5.536   5.862
  151    HB2  PHE  19           2HB      PHE  19  -4.082   4.454   3.810
  152    HB3  PHE  19           1HB      PHE  19  -4.213   6.133   3.426
  153    HD1  PHE  19           2HD      PHE  19  -1.989   7.360   2.857
  154    HD2  PHE  19           1HD      PHE  19  -2.485   3.140   2.837
  155    HE1  PHE  19           2HE      PHE  19  -0.011   7.133   1.399
  156    HE2  PHE  19           1HE      PHE  19  -0.518   2.901   1.389
  157    HZ   PHE  19           HZ       PHE  19   0.723   4.902   0.667
  158    H    THR  20           H        THR  20  -3.519   3.570   6.265
  159    HA   THR  20           HA       THR  20  -0.756   3.290   7.189
  160    HB   THR  20           HB       THR  20  -3.222   1.630   7.779
  161    HG1  THR  20           1HG      THR  20  -3.038   3.856   8.646
  162   HG21  THR  20          3HG2      THR  20  -0.593   1.516   9.253
  163   HG22  THR  20          1HG2      THR  20  -1.014   0.400   7.953
  164   HG23  THR  20          2HG2      THR  20  -1.987   0.443   9.425
  165    H    LEU  21           H        LEU  21   0.656   2.305   5.776
  166    HA   LEU  21           HA       LEU  21  -0.380   0.428   3.817
  167    HB2  LEU  21           2HB      LEU  21   1.598   2.183   3.506
  168    HB3  LEU  21           1HB      LEU  21   2.558   0.874   4.130
  169    HG   LEU  21           HG       LEU  21   2.504  -0.240   2.191
  170   HD11  LEU  21          1HD1      LEU  21  -0.369   0.584   1.804
  171   HD12  LEU  21          2HD1      LEU  21   0.188  -0.942   2.491
  172   HD13  LEU  21          3HD1      LEU  21   0.524  -0.561   0.802
  173   HD21  LEU  21          3HD2      LEU  21   2.988   2.100   1.558
  174   HD22  LEU  21          1HD2      LEU  21   1.295   2.286   1.109
  175   HD23  LEU  21          2HD2      LEU  21   2.312   1.132   0.247
  176    H    ARG  22           H        ARG  22  -1.053  -1.287   5.103
  177    HA   ARG  22           HA       ARG  22   0.608  -2.569   7.024
  178    HB2  ARG  22           2HB      ARG  22  -2.009  -2.677   6.550
  179    HB3  ARG  22           1HB      ARG  22  -1.542  -4.073   5.597
  180    HG2  ARG  22           2HG      ARG  22  -2.085  -4.962   7.662
  181    HG3  ARG  22           1HG      ARG  22  -0.324  -4.860   7.703
  182    HD2  ARG  22           2HD      ARG  22  -0.349  -3.012   9.129
  183    HD3  ARG  22           1HD      ARG  22  -2.035  -2.634   8.756
  184    HE   ARG  22           HE       ARG  22  -1.997  -5.158   9.919
  185   HH11  ARG  22          1HH1      ARG  22  -1.216  -1.880  10.849
  186   HH12  ARG  22          2HH1      ARG  22  -1.584  -2.131  12.529
  187   HH21  ARG  22          1HH2      ARG  22  -2.520  -5.488  12.101
  188   HH22  ARG  22          2HH2      ARG  22  -2.346  -4.184  13.232
  189    H    ALA  23           H        ALA  23   1.796  -4.518   6.812
  190    HA   ALA  23           HA       ALA  23   2.537  -5.192   4.046
  191    HB1  ALA  23           1HB      ALA  23   4.545  -6.275   5.203
  192    HB2  ALA  23           2HB      ALA  23   4.040  -5.381   6.636
  193    HB3  ALA  23           3HB      ALA  23   4.476  -4.513   5.164
  194    H    ILE  24           H        ILE  24   2.700  -7.350   3.389
  195    HA   ILE  24           HA       ILE  24   1.815  -9.440   5.223
  196    HB   ILE  24           HB       ILE  24   0.322 -10.322   3.299
  197   HG12  ILE  24          2HG1      ILE  24  -0.026  -7.397   2.694
  198   HG13  ILE  24          1HG1      ILE  24   1.142  -8.369   1.805
  199   HG21  ILE  24          1HG2      ILE  24  -0.531  -8.004   5.022
  200   HG22  ILE  24          2HG2      ILE  24  -0.544  -9.709   5.467
  201   HG23  ILE  24          3HG2      ILE  24  -1.627  -9.120   4.207
  202   HD11  ILE  24          3HD1      ILE  24  -0.995  -8.170   0.637
  203   HD12  ILE  24          1HD1      ILE  24  -1.802  -8.941   2.002
  204   HD13  ILE  24          2HD1      ILE  24  -0.623  -9.844   1.051
  205    H    ARG  25           H        ARG  25   1.858 -11.622   3.979
  206    HA   ARG  25           HA       ARG  25   3.887 -11.715   1.886
  207    HB2  ARG  25           2HB      ARG  25   4.187 -13.053   4.582
  208    HB3  ARG  25           1HB      ARG  25   5.093 -13.544   3.161
  209    HG2  ARG  25           2HG      ARG  25   6.206 -11.440   3.050
  210    HG3  ARG  25           1HG      ARG  25   5.165 -10.769   4.309
  211    HD2  ARG  25           2HD      ARG  25   6.721 -11.389   5.771
  212    HD3  ARG  25           1HD      ARG  25   6.232 -13.050   5.460
  213    HE   ARG  25           HE       ARG  25   8.000 -12.724   3.526
  214   HH11  ARG  25          1HH1      ARG  25   8.186 -11.711   6.868
  215   HH12  ARG  25          2HH1      ARG  25   9.913 -11.869   6.956
  216   HH21  ARG  25          1HH2      ARG  25  10.275 -12.937   3.620
  217   HH22  ARG  25          2HH2      ARG  25  11.099 -12.576   5.108
  218    H    VAL  26           H        VAL  26   2.202 -12.466   0.573
  219    HA   VAL  26           HA       VAL  26   0.602 -14.711   1.364
  220    HB   VAL  26           HB       VAL  26  -0.141 -14.648  -1.088
  221   HG11  VAL  26          1HG1      VAL  26  -1.483 -12.565  -0.694
  222   HG12  VAL  26          2HG1      VAL  26  -0.533 -12.307   0.771
  223   HG13  VAL  26          3HG1      VAL  26  -1.545 -13.743   0.618
  224   HG21  VAL  26          3HG2      VAL  26   1.853 -13.415  -1.900
  225   HG22  VAL  26          1HG2      VAL  26   1.277 -11.995  -1.026
  226   HG23  VAL  26          2HG2      VAL  26   0.319 -12.667  -2.344
  227    H    TYR  27           H        TYR  27   1.609 -16.564   1.619
  228    HA   TYR  27           HA       TYR  27   3.712 -17.453  -0.138
  229    HB2  TYR  27           2HB      TYR  27   2.395 -18.537   2.328
  230    HB3  TYR  27           1HB      TYR  27   3.356 -19.611   1.320
  231    HD1  TYR  27           2HD      TYR  27   3.558 -16.346   3.120
  232    HD2  TYR  27           1HD      TYR  27   5.647 -19.745   1.648
  233    HE1  TYR  27           2HE      TYR  27   5.601 -15.577   4.253
  234    HE2  TYR  27           1HE      TYR  27   7.695 -18.982   2.773
  235    HH   TYR  27           HH       TYR  27   8.683 -17.102   3.724
  236    H    MET  28           H        MET  28   3.529 -18.883  -1.794
  237    HA   MET  28           HA       MET  28   0.821 -19.669  -2.536
  238    HB2  MET  28           2HB      MET  28   3.453 -19.737  -4.005
  239    HB3  MET  28           1HB      MET  28   2.011 -20.489  -4.632
  240    HG2  MET  28           2HG      MET  28   2.355 -17.624  -4.006
  241    HG3  MET  28           1HG      MET  28   2.359 -18.331  -5.606
  242    HE1  MET  28           3HE      MET  28   0.687 -16.477  -6.226
  243    HE2  MET  28           1HE      MET  28   0.294 -15.840  -4.630
  244    HE3  MET  28           2HE      MET  28  -0.994 -16.395  -5.701
  245    H    GLY  29           H        GLY  29   0.510 -21.202  -0.883
  246    HA2  GLY  29           2HA      GLY  29   0.296 -23.441  -0.316
  247    HA3  GLY  29           1HA      GLY  29   1.445 -23.843  -1.587
  248    H    ASP  30           H        ASP  30   2.361 -25.313   0.028
  249    HA   ASP  30           HA       ASP  30   3.809 -24.010   2.205
  250    HB2  ASP  30           2HB      ASP  30   2.577 -26.125   2.659
  251    HB3  ASP  30           1HB      ASP  30   3.639 -26.956   1.528
  252    H    SER  31           H        SER  31   5.316 -22.867   0.972
  253    HA   SER  31           HA       SER  31   7.705 -24.303   0.362
  254    HB2  SER  31           2HB      SER  31   7.537 -23.139  -2.086
  255    HB3  SER  31           1HB      SER  31   7.110 -24.821  -1.773
  256    HG   SER  31           HG       SER  31   5.049 -23.143  -1.211
  257    H    ASP  32           H        ASP  32   9.264 -22.633  -0.877
  258    HA   ASP  32           HA       ASP  32   9.338 -20.318   0.834
  259    HB2  ASP  32           2HB      ASP  32  11.540 -20.028   0.151
  260    HB3  ASP  32           1HB      ASP  32  11.328 -21.769   0.015
  261    H    VAL  33           H        VAL  33   7.817 -20.934  -2.043
  262    HA   VAL  33           HA       VAL  33   8.260 -18.393  -3.304
  263    HB   VAL  33           HB       VAL  33   7.769 -20.059  -4.855
  264   HG11  VAL  33          1HG1      VAL  33   5.732 -21.476  -4.763
  265   HG12  VAL  33          2HG1      VAL  33   5.395 -20.816  -3.162
  266   HG13  VAL  33          3HG1      VAL  33   6.857 -21.766  -3.437
  267   HG21  VAL  33          3HG2      VAL  33   6.593 -17.950  -5.281
  268   HG22  VAL  33          1HG2      VAL  33   5.171 -18.588  -4.459
  269   HG23  VAL  33          2HG2      VAL  33   5.734 -19.335  -5.954
  270    H    TYR  34           H        TYR  34   7.400 -16.603  -2.729
  271    HA   TYR  34           HA       TYR  34   4.634 -16.364  -2.023
  272    HB2  TYR  34           2HB      TYR  34   4.867 -15.514   0.190
  273    HB3  TYR  34           1HB      TYR  34   5.742 -17.036   0.143
  274    HD1  TYR  34           2HD      TYR  34   8.262 -16.981   0.011
  275    HD2  TYR  34           1HD      TYR  34   5.943 -13.500   0.793
  276    HE1  TYR  34           2HE      TYR  34  10.250 -15.872   0.937
  277    HE2  TYR  34           1HE      TYR  34   7.926 -12.387   1.726
  278    HH   TYR  34           HH       TYR  34  11.036 -13.477   1.268
  279    H    THR  35           H        THR  35   3.894 -14.220  -2.148
  280    HA   THR  35           HA       THR  35   5.869 -12.389  -3.336
  281    HB   THR  35           HB       THR  35   3.131 -11.539  -3.646
  282    HG1  THR  35           1HG      THR  35   3.828 -14.189  -4.397
  283   HG21  THR  35          3HG2      THR  35   5.006 -10.734  -4.991
  284   HG22  THR  35          1HG2      THR  35   3.776 -11.478  -6.014
  285   HG23  THR  35          2HG2      THR  35   5.253 -12.360  -5.628
  286    H    VAL  36           H        VAL  36   6.318 -10.535  -2.352
  287    HA   VAL  36           HA       VAL  36   5.049  -9.997   0.203
  288    HB   VAL  36           HB       VAL  36   7.205  -8.289  -1.011
  289   HG11  VAL  36          1HG1      VAL  36   7.780  -7.907   1.343
  290   HG12  VAL  36          2HG1      VAL  36   6.459  -8.969   1.831
  291   HG13  VAL  36          3HG1      VAL  36   6.110  -7.456   0.996
  292   HG21  VAL  36          3HG2      VAL  36   8.157 -10.440  -1.205
  293   HG22  VAL  36          1HG2      VAL  36   7.500 -10.954   0.348
  294   HG23  VAL  36          2HG2      VAL  36   8.803  -9.766   0.290
  295    H    HIS  37           H        HIS  37   3.058  -9.212  -0.212
  296    HA   HIS  37           HA       HIS  37   2.825  -6.843  -1.930
  297    HB2  HIS  37           2HB      HIS  37   0.731  -8.771  -0.902
  298    HB3  HIS  37           1HB      HIS  37   0.348  -7.290  -1.765
  299    HD2  HIS  37           2HD      HIS  37   0.054 -10.642  -2.703
  300    HE1  HIS  37           1HE      HIS  37   2.260  -9.054  -5.951
  301    HE2  HIS  37           2HE      HIS  37   0.686 -10.900  -5.208
  302    H    HIS  38           H        HIS  38   0.694  -5.585  -0.975
  303    HA   HIS  38           HA       HIS  38   0.896  -5.213   1.894
  304    HB2  HIS  38           2HB      HIS  38   1.572  -2.983  -0.050
  305    HB3  HIS  38           1HB      HIS  38   1.286  -2.757   1.672
  306    HD2  HIS  38           2HD      HIS  38   4.110  -3.451  -0.714
  307    HE1  HIS  38           1HE      HIS  38   5.494  -4.516   3.130
  308    HE2  HIS  38           2HE      HIS  38   6.083  -4.408   0.674
  309    H    MET  39           H        MET  39  -0.746  -3.573   2.618
  310    HA   MET  39           HA       MET  39  -2.930  -3.089   0.753
  311    HB2  MET  39           2HB      MET  39  -3.081  -5.047   3.030
  312    HB3  MET  39           1HB      MET  39  -4.504  -4.134   2.563
  313    HG2  MET  39           2HG      MET  39  -3.276  -5.316   0.255
  314    HG3  MET  39           1HG      MET  39  -3.585  -6.536   1.485
  315    HE1  MET  39           3HE      MET  39  -6.080  -6.844   2.627
  316    HE2  MET  39           1HE      MET  39  -7.469  -5.890   2.112
  317    HE3  MET  39           2HE      MET  39  -6.122  -5.109   2.935
  318    H    VAL  40           H        VAL  40  -4.156  -1.344   1.363
  319    HA   VAL  40           HA       VAL  40  -3.172   0.235   3.531
  320    HB   VAL  40           HB       VAL  40  -3.878   1.511   1.690
  321   HG11  VAL  40          1HG1      VAL  40  -6.712   0.693   1.690
  322   HG12  VAL  40          2HG1      VAL  40  -5.558  -0.477   1.052
  323   HG13  VAL  40          3HG1      VAL  40  -5.655   1.136   0.350
  324   HG21  VAL  40          3HG2      VAL  40  -4.579   2.304   3.995
  325   HG22  VAL  40          1HG2      VAL  40  -6.209   1.783   3.570
  326   HG23  VAL  40          2HG2      VAL  40  -5.412   3.042   2.625
  327    H    TRP  41           H        TRP  41  -3.531  -0.360   5.473
  328    HA   TRP  41           HA       TRP  41  -5.680  -1.987   6.361
  329    HB2  TRP  41           2HB      TRP  41  -3.240  -1.535   7.285
  330    HB3  TRP  41           1HB      TRP  41  -4.080  -0.335   8.251
  331    HD1  TRP  41           HD       TRP  41  -4.547  -1.254  10.555
  332    HE1  TRP  41           1HE      TRP  41  -5.240  -3.520  11.542
  333    HE3  TRP  41           3HE      TRP  41  -4.744  -3.983   6.237
  334    HZ2  TRP  41           2HZ      TRP  41  -5.826  -6.130  10.597
  335    HZ3  TRP  41           3HZ      TRP  41  -5.386  -6.353   6.361
  336    HH2  TRP  41           HH       TRP  41  -5.915  -7.401   8.501
  337    H    HIS  42           H        HIS  42  -4.899   1.413   6.744
  338    HA   HIS  42           HA       HIS  42  -7.694   2.075   7.215
  339    HB2  HIS  42           2HB      HIS  42  -6.292   1.524   9.412
  340    HB3  HIS  42           1HB      HIS  42  -5.746   3.170   9.188
  341    HD2  HIS  42           2HD      HIS  42  -7.890   5.104   9.189
  342    HE1  HIS  42           1HE      HIS  42 -10.352   2.576  11.519
  343    HE2  HIS  42           2HE      HIS  42 -10.104   4.893  10.523
  344    H    VAL  43           H        VAL  43  -8.143   4.026   6.352
  345    HA   VAL  43           HA       VAL  43  -5.874   5.810   5.864
  346    HB   VAL  43           HB       VAL  43  -6.336   4.853   3.749
  347   HG11  VAL  43          1HG1      VAL  43  -8.485   3.916   4.091
  348   HG12  VAL  43          2HG1      VAL  43  -8.574   5.012   2.713
  349   HG13  VAL  43          3HG1      VAL  43  -9.208   5.513   4.281
  350   HG21  VAL  43          3HG2      VAL  43  -5.889   7.198   3.613
  351   HG22  VAL  43          1HG2      VAL  43  -7.571   7.586   3.975
  352   HG23  VAL  43          2HG2      VAL  43  -7.157   6.806   2.451
  353    H    GLU  44           H        GLU  44  -6.090   7.788   6.498
  354    HA   GLU  44           HA       GLU  44  -8.262   8.603   8.082
  355    HB2  GLU  44           2HB      GLU  44  -5.933  10.120   6.925
  356    HB3  GLU  44           1HB      GLU  44  -7.045  10.761   8.110
  357    HG2  GLU  44           2HG      GLU  44  -6.373   8.580   9.424
  358    HG3  GLU  44           1HG      GLU  44  -4.934   8.715   8.416
  359    H    ASP  45           H        ASP  45 -10.133   9.357   7.480
  360    HA   ASP  45           HA       ASP  45 -10.610  10.265   4.764
  361    HB2  ASP  45           2HB      ASP  45 -12.999  10.282   5.489
  362    HB3  ASP  45           1HB      ASP  45 -12.215   8.719   5.686
  363    H    GLY  46           H        GLY  46  -9.146  11.848   6.927
  364    HA2  GLY  46           2HA      GLY  46 -10.929  14.155   7.122
  365    HA3  GLY  46           1HA      GLY  46  -9.442  13.925   8.019
  366    H    GLY  47           H        GLY  47  -8.815  13.156   4.796
  367    HA2  GLY  47           2HA      GLY  47  -8.749  15.496   3.416
  368    HA3  GLY  47           1HA      GLY  47  -7.397  15.653   4.514
  369    HA   PRO  48           HA       PRO  48  -4.619  13.320   2.037
  370    HB2  PRO  48           2HB      PRO  48  -4.742  10.895   3.741
  371    HB3  PRO  48           1HB      PRO  48  -3.349  11.833   3.209
  372    HG2  PRO  48           2HG      PRO  48  -4.181  12.071   5.684
  373    HG3  PRO  48           1HG      PRO  48  -3.755  13.532   4.764
  374    HD2  PRO  48           2HD      PRO  48  -6.471  12.385   5.324
  375    HD3  PRO  48           1HD      PRO  48  -5.897  14.055   5.461
  376    H    ALA  49           H        ALA  49  -4.488  10.294   2.151
  377    HA   ALA  49           HA       ALA  49  -5.248   9.631  -0.333
  378    HB1  ALA  49           1HB      ALA  49  -4.446   7.623   0.166
  379    HB2  ALA  49           2HB      ALA  49  -5.550   7.391   1.527
  380    HB3  ALA  49           3HB      ALA  49  -4.072   8.331   1.739
  381    H    SER  50           H        SER  50  -7.494   9.524   2.440
  382    HA   SER  50           HA       SER  50  -9.445   7.949   1.156
  383    HB2  SER  50           2HB      SER  50  -9.365   9.788   3.481
  384    HB3  SER  50           1HB      SER  50 -10.947   9.397   2.818
  385    HG   SER  50           HG       SER  50 -10.072   7.113   2.954
  386    H    GLU  51           H        GLU  51  -9.251  11.477   1.534
  387    HA   GLU  51           HA       GLU  51 -11.515  12.062  -0.041
  388    HB2  GLU  51           2HB      GLU  51  -9.126  13.745   0.694
  389    HB3  GLU  51           1HB      GLU  51 -10.564  14.364  -0.107
  390    HG2  GLU  51           2HG      GLU  51 -10.836  12.880   2.464
  391    HG3  GLU  51           1HG      GLU  51 -10.309  14.564   2.474
  392    H    ALA  52           H        ALA  52  -8.272  11.308  -0.801
  393    HA   ALA  52           HA       ALA  52  -8.199  12.420  -3.420
  394    HB1  ALA  52           1HB      ALA  52  -6.127  12.060  -2.348
  395    HB2  ALA  52           2HB      ALA  52  -6.206  10.872  -3.651
  396    HB3  ALA  52           3HB      ALA  52  -6.522  10.381  -1.985
  397    H    GLY  53           H        GLY  53  -9.456   9.497  -2.047
  398    HA2  GLY  53           2HA      GLY  53 -11.156   8.488  -3.611
  399    HA3  GLY  53           1HA      GLY  53  -9.833   8.402  -4.755
  400    H    LEU  54           H        LEU  54  -8.303   7.787  -2.000
  401    HA   LEU  54           HA       LEU  54  -8.159   4.981  -2.479
  402    HB2  LEU  54           2HB      LEU  54  -6.347   6.546  -1.525
  403    HB3  LEU  54           1HB      LEU  54  -7.151   6.325   0.008
  404    HG   LEU  54           HG       LEU  54  -6.116   4.023  -1.639
  405   HD11  LEU  54          1HD1      LEU  54  -4.261   5.525  -1.048
  406   HD12  LEU  54          2HD1      LEU  54  -4.177   3.985  -0.192
  407   HD13  LEU  54          3HD1      LEU  54  -4.743   5.430   0.646
  408   HD21  LEU  54          3HD2      LEU  54  -6.195   2.912   0.577
  409   HD22  LEU  54          1HD2      LEU  54  -7.766   3.390  -0.065
  410   HD23  LEU  54          2HD2      LEU  54  -7.003   4.348   1.202
  411    H    ARG  55           H        ARG  55  -9.648   3.603  -1.946
  412    HA   ARG  55           HA       ARG  55 -11.408   4.124   0.304
  413    HB2  ARG  55           2HB      ARG  55 -12.621   2.097  -0.471
  414    HB3  ARG  55           1HB      ARG  55 -12.485   3.331  -1.712
  415    HG2  ARG  55           2HG      ARG  55 -11.818   1.667  -3.042
  416    HG3  ARG  55           1HG      ARG  55 -10.277   1.782  -2.191
  417    HD2  ARG  55           2HD      ARG  55 -11.022  -0.525  -2.245
  418    HD3  ARG  55           1HD      ARG  55 -11.064   0.078  -0.590
  419    HE   ARG  55           HE       ARG  55 -13.587   0.430  -1.810
  420   HH11  ARG  55          1HH1      ARG  55 -11.524  -2.065  -0.490
  421   HH12  ARG  55          2HH1      ARG  55 -12.842  -3.121  -0.088
  422   HH21  ARG  55          1HH2      ARG  55 -15.334  -0.954  -1.261
  423   HH22  ARG  55          2HH2      ARG  55 -15.001  -2.490  -0.527
  424    H    GLN  56           H        GLN  56 -10.953   3.390   2.285
  425    HA   GLN  56           HA       GLN  56  -8.801   1.880   3.049
  426    HB2  GLN  56           2HB      GLN  56 -10.286   3.097   4.582
  427    HB3  GLN  56           1HB      GLN  56 -11.493   1.855   4.387
  428    HG2  GLN  56           2HG      GLN  56 -10.255   0.347   5.533
  429    HG3  GLN  56           1HG      GLN  56  -8.747   1.198   5.307
  430   HE21  GLN  56          1HE2      GLN  56 -10.212   0.215   7.726
  431   HE22  GLN  56          2HE2      GLN  56 -10.293   1.594   8.763
  432    H    GLY  57           H        GLY  57  -8.230  -0.193   3.041
  433    HA2  GLY  57           2HA      GLY  57  -8.499  -2.520   2.984
  434    HA3  GLY  57           1HA      GLY  57 -10.221  -2.289   2.706
  435    H    ASP  58           H        ASP  58  -7.123  -1.668   1.103
  436    HA   ASP  58           HA       ASP  58  -8.144  -2.857  -1.357
  437    HB2  ASP  58           2HB      ASP  58  -8.391  -0.203  -1.192
  438    HB3  ASP  58           1HB      ASP  58  -6.699  -0.273  -1.674
  439    H    LEU  59           H        LEU  59  -6.519  -3.605  -2.725
  440    HA   LEU  59           HA       LEU  59  -3.974  -4.022  -1.356
  441    HB2  LEU  59           2HB      LEU  59  -4.907  -6.047  -2.137
  442    HB3  LEU  59           1HB      LEU  59  -5.309  -5.356  -3.694
  443    HG   LEU  59           HG       LEU  59  -2.723  -5.106  -3.957
  444   HD11  LEU  59          1HD1      LEU  59  -2.225  -5.747  -1.632
  445   HD12  LEU  59          2HD1      LEU  59  -1.449  -6.809  -2.811
  446   HD13  LEU  59          3HD1      LEU  59  -2.891  -7.351  -1.952
  447   HD21  LEU  59          3HD2      LEU  59  -4.188  -7.730  -4.151
  448   HD22  LEU  59          1HD2      LEU  59  -2.619  -7.404  -4.888
  449   HD23  LEU  59          2HD2      LEU  59  -4.042  -6.495  -5.401
  450    H    ILE  60           H        ILE  60  -2.169  -3.034  -1.926
  451    HA   ILE  60           HA       ILE  60  -2.247  -1.153  -4.135
  452    HB   ILE  60           HB       ILE  60  -0.131  -1.656  -2.030
  453   HG12  ILE  60          2HG1      ILE  60  -0.839   0.768  -1.446
  454   HG13  ILE  60          1HG1      ILE  60  -2.282   0.415  -2.385
  455   HG21  ILE  60          1HG2      ILE  60   0.959   0.372  -2.873
  456   HG22  ILE  60          2HG2      ILE  60  -0.227   0.462  -4.177
  457   HG23  ILE  60          3HG2      ILE  60   0.901  -0.893  -4.100
  458   HD11  ILE  60          3HD1      ILE  60  -1.367  -1.193  -0.016
  459   HD12  ILE  60          1HD1      ILE  60  -2.895  -1.340  -0.886
  460   HD13  ILE  60          2HD1      ILE  60  -2.551   0.114   0.055
  461    H    THR  61           H        THR  61  -1.450  -1.580  -6.066
  462    HA   THR  61           HA       THR  61   0.200  -3.979  -6.396
  463    HB   THR  61           HB       THR  61  -0.446  -3.925  -8.741
  464    HG1  THR  61           1HG      THR  61  -0.702  -1.857  -9.345
  465   HG21  THR  61          3HG2      THR  61  -2.869  -3.429  -7.003
  466   HG22  THR  61          1HG2      THR  61  -1.997  -4.961  -7.103
  467   HG23  THR  61          2HG2      THR  61  -2.828  -4.327  -8.523
  468    H    HIS  62           H        HIS  62   0.064  -0.534  -7.102
  469    HA   HIS  62           HA       HIS  62   2.957  -0.545  -7.605
  470    HB2  HIS  62           2HB      HIS  62   0.922   0.886  -9.329
  471    HB3  HIS  62           1HB      HIS  62   2.663   1.010  -9.492
  472    HD2  HIS  62           2HD      HIS  62   3.905  -1.452 -10.358
  473    HE1  HIS  62           1HE      HIS  62   0.299  -2.852 -12.070
  474    HE2  HIS  62           2HE      HIS  62   2.772  -3.317 -11.761
  475    H    VAL  63           H        VAL  63   3.975   1.470  -7.230
  476    HA   VAL  63           HA       VAL  63   2.329   3.564  -6.031
  477    HB   VAL  63           HB       VAL  63   3.161   2.317  -4.133
  478   HG11  VAL  63          1HG1      VAL  63   5.092   1.245  -5.170
  479   HG12  VAL  63          2HG1      VAL  63   5.529   2.043  -3.659
  480   HG13  VAL  63          3HG1      VAL  63   5.935   2.794  -5.203
  481   HG21  VAL  63          3HG2      VAL  63   4.827   4.256  -3.305
  482   HG22  VAL  63          1HG2      VAL  63   3.075   4.443  -3.393
  483   HG23  VAL  63          2HG2      VAL  63   4.092   5.052  -4.698
  484    H    ASN  64           H        ASN  64   2.649   5.287  -7.214
  485    HA   ASN  64           HA       ASN  64   3.612   6.893  -8.508
  486    HB2  ASN  64           2HB      ASN  64   5.264   6.543  -6.278
  487    HB3  ASN  64           1HB      ASN  64   6.358   6.599  -7.657
  488   HD21  ASN  64          1HD2      ASN  64   7.215   8.586  -7.308
  489   HD22  ASN  64          2HD2      ASN  64   6.302  10.055  -7.348
  490    H    GLY  65           H        GLY  65   3.507   4.219  -9.537
  491    HA2  GLY  65           2HA      GLY  65   4.134   3.220 -11.517
  492    HA3  GLY  65           1HA      GLY  65   5.269   4.533 -11.762
  493    H    GLU  66           H        GLU  66   5.091   2.303  -9.051
  494    HA   GLU  66           HA       GLU  66   7.447   0.885  -9.920
  495    HB2  GLU  66           2HB      GLU  66   7.824   3.022  -8.422
  496    HB3  GLU  66           1HB      GLU  66   7.398   1.913  -7.133
  497    HG2  GLU  66           2HG      GLU  66   9.767   1.926  -7.312
  498    HG3  GLU  66           1HG      GLU  66   9.183   0.379  -7.922
  499    HA   PRO  67           HA       PRO  67   4.559  -2.304  -8.442
  500    HB2  PRO  67           2HB      PRO  67   6.816  -4.077  -8.674
  501    HB3  PRO  67           1HB      PRO  67   5.362  -4.017  -9.669
  502    HG2  PRO  67           2HG      PRO  67   8.019  -2.949 -10.211
  503    HG3  PRO  67           1HG      PRO  67   6.668  -3.211 -11.326
  504    HD2  PRO  67           2HD      PRO  67   7.528  -0.751 -10.511
  505    HD3  PRO  67           1HD      PRO  67   5.884  -1.074 -11.051
  506    H    VAL  68           H        VAL  68   4.218  -2.827  -6.483
  507    HA   VAL  68           HA       VAL  68   6.201  -2.299  -4.424
  508    HB   VAL  68           HB       VAL  68   4.371  -2.653  -2.820
  509   HG11  VAL  68          1HG1      VAL  68   3.729  -0.769  -5.088
  510   HG12  VAL  68          2HG1      VAL  68   4.703  -0.421  -3.657
  511   HG13  VAL  68          3HG1      VAL  68   2.974  -0.720  -3.493
  512   HG21  VAL  68          3HG2      VAL  68   2.664  -3.141  -5.254
  513   HG22  VAL  68          1HG2      VAL  68   2.085  -3.009  -3.595
  514   HG23  VAL  68          2HG2      VAL  68   3.133  -4.350  -4.059
  515    H    HIS  69           H        HIS  69   5.165  -4.691  -6.288
  516    HA   HIS  69           HA       HIS  69   4.983  -6.994  -4.847
  517    HB2  HIS  69           2HB      HIS  69   5.887  -6.252  -7.602
  518    HB3  HIS  69           1HB      HIS  69   5.840  -7.901  -7.079
  519    HD2  HIS  69           2HD      HIS  69   2.970  -5.520  -6.032
  520    HE1  HIS  69           1HE      HIS  69   1.528  -8.217  -8.960
  521    HE2  HIS  69           2HE      HIS  69   0.876  -6.548  -7.174
  522    H    GLY  70           H        GLY  70   6.488  -7.279  -3.215
  523    HA2  GLY  70           2HA      GLY  70   8.489  -8.595  -2.808
  524    HA3  GLY  70           1HA      GLY  70   9.245  -7.759  -4.154
  525    H    LEU  71           H        LEU  71   7.707  -5.318  -2.828
  526    HA   LEU  71           HA       LEU  71  10.053  -4.349  -1.478
  527    HB2  LEU  71           2HB      LEU  71   7.294  -3.142  -1.726
  528    HB3  LEU  71           1HB      LEU  71   8.686  -2.324  -1.051
  529    HG   LEU  71           HG       LEU  71   8.204  -3.096  -3.917
  530   HD11  LEU  71          1HD1      LEU  71   7.229  -0.995  -3.084
  531   HD12  LEU  71          2HD1      LEU  71   8.469  -0.724  -4.309
  532   HD13  LEU  71          3HD1      LEU  71   8.838  -0.457  -2.605
  533   HD21  LEU  71          3HD2      LEU  71  10.474  -3.692  -3.575
  534   HD22  LEU  71          1HD2      LEU  71  10.775  -2.259  -2.594
  535   HD23  LEU  71          2HD2      LEU  71  10.483  -2.096  -4.326
  536    H    VAL  72           H        VAL  72  10.378  -4.085   0.694
  537    HA   VAL  72           HA       VAL  72   8.684  -5.624   2.445
  538    HB   VAL  72           HB       VAL  72  11.326  -5.142   2.498
  539   HG11  VAL  72          1HG1      VAL  72  12.044  -3.540   4.011
  540   HG12  VAL  72          2HG1      VAL  72  10.441  -3.343   4.719
  541   HG13  VAL  72          3HG1      VAL  72  10.778  -2.705   3.112
  542   HG21  VAL  72          3HG2      VAL  72  11.387  -6.086   4.700
  543   HG22  VAL  72          1HG2      VAL  72  10.061  -6.821   3.803
  544   HG23  VAL  72          2HG2      VAL  72   9.728  -5.582   5.011
  545    H    HIS  73           H        HIS  73   8.059  -4.554   4.616
  546    HA   HIS  73           HA       HIS  73   6.014  -2.791   4.365
  547    HB2  HIS  73           2HB      HIS  73   6.799  -4.076   6.428
  548    HB3  HIS  73           1HB      HIS  73   7.871  -2.734   6.731
  549    HD1  HIS  73           1HD      HIS  73   4.119  -3.297   6.316
  550    HD2  HIS  73           2HD      HIS  73   6.821  -0.764   8.181
  551    HE1  HIS  73           1HE      HIS  73   2.762  -1.823   7.850
  552    H    THR  74           H        THR  74   9.281  -1.902   5.353
  553    HA   THR  74           HA       THR  74   8.723   0.877   5.410
  554    HB   THR  74           HB       THR  74  11.028   1.126   6.033
  555    HG1  THR  74           1HG      THR  74  12.207  -0.133   4.665
  556   HG21  THR  74          3HG2      THR  74   9.731   0.227   7.803
  557   HG22  THR  74          1HG2      THR  74  11.205  -0.741   7.762
  558   HG23  THR  74          2HG2      THR  74   9.707  -1.384   7.069
  559    H    GLU  75           H        GLU  75   9.679  -1.264   2.883
  560    HA   GLU  75           HA       GLU  75  11.083   0.624   1.314
  561    HB2  GLU  75           2HB      GLU  75   9.883  -2.062   0.792
  562    HB3  GLU  75           1HB      GLU  75  10.445  -1.075  -0.545
  563    HG2  GLU  75           2HG      GLU  75  12.650  -0.905   0.680
  564    HG3  GLU  75           1HG      GLU  75  12.043  -2.175   1.738
  565    H    VAL  76           H        VAL  76   7.680  -0.432   1.384
  566    HA   VAL  76           HA       VAL  76   6.927   1.147  -0.849
  567    HB   VAL  76           HB       VAL  76   4.595   0.959   0.021
  568   HG11  VAL  76          1HG1      VAL  76   6.163  -1.589  -0.227
  569   HG12  VAL  76          2HG1      VAL  76   5.511  -0.627  -1.554
  570   HG13  VAL  76          3HG1      VAL  76   4.419  -1.431  -0.427
  571   HG21  VAL  76          3HG2      VAL  76   5.971  -0.009   2.398
  572   HG22  VAL  76          1HG2      VAL  76   4.679  -1.076   1.849
  573   HG23  VAL  76          2HG2      VAL  76   4.325   0.621   2.217
  574    H    VAL  77           H        VAL  77   6.723   1.681   2.630
  575    HA   VAL  77           HA       VAL  77   5.634   4.199   2.721
  576    HB   VAL  77           HB       VAL  77   7.874   3.228   4.476
  577   HG11  VAL  77          1HG1      VAL  77   7.281   5.626   4.683
  578   HG12  VAL  77          2HG1      VAL  77   7.011   4.699   6.160
  579   HG13  VAL  77          3HG1      VAL  77   5.649   5.137   5.130
  580   HG21  VAL  77          3HG2      VAL  77   6.129   1.541   4.384
  581   HG22  VAL  77          1HG2      VAL  77   4.910   2.755   4.770
  582   HG23  VAL  77          2HG2      VAL  77   6.139   2.325   5.963
  583    H    GLU  78           H        GLU  78   9.048   3.306   2.354
  584    HA   GLU  78           HA       GLU  78  10.020   5.947   2.178
  585    HB2  GLU  78           2HB      GLU  78  11.113   3.266   1.423
  586    HB3  GLU  78           1HB      GLU  78  11.981   4.735   0.991
  587    HG2  GLU  78           2HG      GLU  78  11.726   5.371   3.447
  588    HG3  GLU  78           1HG      GLU  78  11.324   3.673   3.699
  589    H    LEU  79           H        LEU  79   9.080   3.582  -0.259
  590    HA   LEU  79           HA       LEU  79   9.742   4.947  -2.575
  591    HB2  LEU  79           2HB      LEU  79   8.259   2.670  -1.911
  592    HB3  LEU  79           1HB      LEU  79   7.131   3.688  -2.782
  593    HG   LEU  79           HG       LEU  79   8.122   2.200  -4.357
  594   HD11  LEU  79          1HD1      LEU  79   7.823   4.559  -5.062
  595   HD12  LEU  79          2HD1      LEU  79   9.087   3.705  -5.945
  596   HD13  LEU  79          3HD1      LEU  79   9.521   4.848  -4.675
  597   HD21  LEU  79          3HD2      LEU  79  10.135   1.751  -2.881
  598   HD22  LEU  79          1HD2      LEU  79  10.858   3.189  -3.601
  599   HD23  LEU  79          2HD2      LEU  79  10.430   1.813  -4.618
  600    H    ILE  80           H        ILE  80   6.934   5.274  -0.481
  601    HA   ILE  80           HA       ILE  80   5.560   7.153  -2.101
  602    HB   ILE  80           HB       ILE  80   5.304   6.279   0.766
  603   HG12  ILE  80          2HG1      ILE  80   3.171   6.105  -1.317
  604   HG13  ILE  80          1HG1      ILE  80   4.547   5.012  -1.431
  605   HG21  ILE  80          1HG2      ILE  80   3.801   8.448  -0.664
  606   HG22  ILE  80          2HG2      ILE  80   4.654   8.540   0.876
  607   HG23  ILE  80          3HG2      ILE  80   3.161   7.611   0.750
  608   HD11  ILE  80          3HD1      ILE  80   2.721   3.961  -0.270
  609   HD12  ILE  80          1HD1      ILE  80   2.667   5.280   0.894
  610   HD13  ILE  80          2HD1      ILE  80   4.071   4.217   0.836
  611    H    LEU  81           H        LEU  81   7.471   7.487   0.896
  612    HA   LEU  81           HA       LEU  81   7.378  10.271   1.091
  613    HB2  LEU  81           2HB      LEU  81   9.586   8.389   1.944
  614    HB3  LEU  81           1HB      LEU  81   9.436  10.059   2.458
  615    HG   LEU  81           HG       LEU  81   7.367   7.941   3.035
  616   HD11  LEU  81          1HD1      LEU  81   9.384   7.318   4.168
  617   HD12  LEU  81          2HD1      LEU  81   8.276   8.026   5.344
  618   HD13  LEU  81          3HD1      LEU  81   9.631   8.972   4.729
  619   HD21  LEU  81          3HD2      LEU  81   7.776  10.755   4.036
  620   HD22  LEU  81          1HD2      LEU  81   6.631   9.603   4.727
  621   HD23  LEU  81          2HD2      LEU  81   6.432  10.153   3.065
  622    H    LYS  82           H        LYS  82   9.394   8.163  -0.814
  623    HA   LYS  82           HA       LYS  82  11.404   9.885  -1.643
  624    HB2  LYS  82           2HB      LYS  82  11.077   7.380  -2.029
  625    HB3  LYS  82           1HB      LYS  82  10.156   7.885  -3.416
  626    HG2  LYS  82           2HG      LYS  82  12.285   9.278  -3.982
  627    HG3  LYS  82           1HG      LYS  82  13.068   8.098  -2.932
  628    HD2  LYS  82           2HD      LYS  82  11.318   7.340  -5.263
  629    HD3  LYS  82           1HD      LYS  82  13.070   7.527  -5.382
  630    HE2  LYS  82           2HE      LYS  82  13.352   5.802  -3.652
  631    HE3  LYS  82           1HE      LYS  82  11.602   5.603  -3.581
  632    HZ1  LYS  82           3HZ      LYS  82  13.264   5.130  -5.993
  633    HZ2  LYS  82           1HZ      LYS  82  11.603   4.860  -5.856
  634    HZ3  LYS  82           2HZ      LYS  82  12.690   3.920  -4.965
  635    H    SER  83           H        SER  83   8.189   9.366  -2.922
  636    HA   SER  83           HA       SER  83   8.383  10.863  -5.254
  637    HB2  SER  83           2HB      SER  83   6.475   9.394  -4.660
  638    HB3  SER  83           1HB      SER  83   5.956  10.587  -3.470
  639    HG   SER  83           HG       SER  83   5.002  11.595  -5.019
  640    H    GLY  84           H        GLY  84   7.155  11.973  -2.064
  641    HA2  GLY  84           2HA      GLY  84   8.324  14.175  -1.469
  642    HA3  GLY  84           1HA      GLY  84   7.657  14.722  -2.994
  643    H    ASN  85           H        ASN  85   6.080  16.070  -2.626
  644    HA   ASN  85           HA       ASN  85   4.555  16.084  -0.205
  645    HB2  ASN  85           2HB      ASN  85   3.399  18.002  -1.188
  646    HB3  ASN  85           1HB      ASN  85   5.144  18.162  -1.351
  647   HD21  ASN  85          1HD2      ASN  85   6.085  17.973  -3.373
  648   HD22  ASN  85          2HD2      ASN  85   5.161  18.102  -4.829
  649    H    LYS  86           H        LYS  86   4.273  14.198  -2.875
  650    HA   LYS  86           HA       LYS  86   1.625  13.364  -2.169
  651    HB2  LYS  86           2HB      LYS  86   0.741  13.628  -4.421
  652    HB3  LYS  86           1HB      LYS  86   1.056  15.158  -3.667
  653    HG2  LYS  86           2HG      LYS  86   3.093  15.404  -4.971
  654    HG3  LYS  86           1HG      LYS  86   2.824  13.817  -5.695
  655    HD2  LYS  86           2HD      LYS  86   0.607  14.717  -6.526
  656    HD3  LYS  86           1HD      LYS  86   1.177  16.314  -6.038
  657    HE2  LYS  86           2HE      LYS  86   1.677  16.114  -8.338
  658    HE3  LYS  86           1HE      LYS  86   3.204  15.894  -7.488
  659    HZ1  LYS  86           3HZ      LYS  86   2.910  13.481  -7.725
  660    HZ2  LYS  86           1HZ      LYS  86   2.984  14.261  -9.224
  661    HZ3  LYS  86           2HZ      LYS  86   1.496  13.741  -8.618
  662    H    VAL  87           H        VAL  87   0.928  11.646  -3.830
  663    HA   VAL  87           HA       VAL  87   3.019  10.227  -5.175
  664    HB   VAL  87           HB       VAL  87   3.624   9.727  -2.841
  665   HG11  VAL  87          1HG1      VAL  87   0.845   8.608  -2.749
  666   HG12  VAL  87          2HG1      VAL  87   1.629   9.729  -1.635
  667   HG13  VAL  87          3HG1      VAL  87   2.106   8.031  -1.660
  668   HG21  VAL  87          3HG2      VAL  87   3.682   7.223  -3.092
  669   HG22  VAL  87          1HG2      VAL  87   4.330   8.145  -4.449
  670   HG23  VAL  87          2HG2      VAL  87   2.721   7.430  -4.556
  671    H    ALA  88           H        ALA  88   2.322   8.569  -6.435
  672    HA   ALA  88           HA       ALA  88  -0.573   8.320  -6.783
  673    HB1  ALA  88           1HB      ALA  88   0.722   8.867  -8.751
  674    HB2  ALA  88           2HB      ALA  88   0.001   7.266  -8.926
  675    HB3  ALA  88           3HB      ALA  88   1.710   7.425  -8.528
  676    H    ILE  89           H        ILE  89  -1.178   6.894  -5.154
  677    HA   ILE  89           HA       ILE  89   0.158   4.307  -5.004
  678    HB   ILE  89           HB       ILE  89  -0.397   5.161  -2.868
  679   HG12  ILE  89          2HG1      ILE  89  -2.601   3.184  -3.424
  680   HG13  ILE  89          1HG1      ILE  89  -0.906   2.718  -3.352
  681   HG21  ILE  89          1HG2      ILE  89  -3.249   5.469  -3.775
  682   HG22  ILE  89          2HG2      ILE  89  -2.092   6.785  -3.581
  683   HG23  ILE  89          3HG2      ILE  89  -2.608   5.850  -2.178
  684   HD11  ILE  89          3HD1      ILE  89  -2.240   2.377  -1.253
  685   HD12  ILE  89          1HD1      ILE  89  -2.304   4.134  -1.108
  686   HD13  ILE  89          2HD1      ILE  89  -0.750   3.302  -1.071
  687    H    SER  90           H        SER  90  -0.374   2.777  -6.416
  688    HA   SER  90           HA       SER  90  -3.003   2.848  -7.677
  689    HB2  SER  90           2HB      SER  90  -0.631   2.495  -8.797
  690    HB3  SER  90           1HB      SER  90  -0.931   0.814  -8.369
  691    HG   SER  90           HG       SER  90  -3.094   2.019  -9.529
  692    H    THR  91           H        THR  91  -4.611   1.756  -6.801
  693    HA   THR  91           HA       THR  91  -4.007  -0.711  -5.326
  694    HB   THR  91           HB       THR  91  -6.131  -0.407  -4.159
  695    HG1  THR  91           1HG      THR  91  -7.571   0.989  -4.803
  696   HG21  THR  91          3HG2      THR  91  -4.414   2.075  -4.105
  697   HG22  THR  91          1HG2      THR  91  -4.139   0.594  -3.186
  698   HG23  THR  91          2HG2      THR  91  -5.558   1.585  -2.853
  699    H    THR  92           H        THR  92  -6.135  -2.195  -5.339
  700    HA   THR  92           HA       THR  92  -6.646  -2.578  -8.211
  701    HB   THR  92           HB       THR  92  -5.479  -4.445  -7.283
  702    HG1  THR  92           1HG      THR  92  -8.069  -4.700  -8.182
  703   HG21  THR  92          3HG2      THR  92  -6.129  -4.100  -4.917
  704   HG22  THR  92          1HG2      THR  92  -6.274  -5.776  -5.445
  705   HG23  THR  92          2HG2      THR  92  -7.716  -4.775  -5.286
  706    HA   PRO  93           HA       PRO  93 -10.864  -1.150  -7.273
  707    HB2  PRO  93           2HB      PRO  93 -11.035  -2.045 -10.112
  708    HB3  PRO  93           1HB      PRO  93 -11.675  -0.578  -9.361
  709    HG2  PRO  93           2HG      PRO  93  -9.468  -0.501 -10.853
  710    HG3  PRO  93           1HG      PRO  93  -9.599   0.471  -9.383
  711    HD2  PRO  93           2HD      PRO  93  -8.036  -1.980  -9.878
  712    HD3  PRO  93           1HD      PRO  93  -7.684  -0.627  -8.801
  713    H    LEU  94           H        LEU  94 -13.006  -2.152  -7.697
  714    HA   LEU  94           HA       LEU  94 -13.075  -4.824  -6.787
  715    HB2  LEU  94           2HB      LEU  94 -15.572  -4.170  -7.935
  716    HB3  LEU  94           1HB      LEU  94 -15.142  -4.202  -6.252
  717    HG   LEU  94           HG       LEU  94 -14.288  -1.798  -6.630
  718   HD11  LEU  94          1HD1      LEU  94 -14.315  -1.467  -8.901
  719   HD12  LEU  94          2HD1      LEU  94 -15.875  -0.776  -8.435
  720   HD13  LEU  94          3HD1      LEU  94 -15.795  -2.401  -9.113
  721   HD21  LEU  94          3HD2      LEU  94 -16.242  -2.411  -5.280
  722   HD22  LEU  94          1HD2      LEU  94 -17.235  -2.417  -6.737
  723   HD23  LEU  94          2HD2      LEU  94 -16.504  -0.914  -6.174
  724    H    GLU  95           H        GLU  95 -14.135  -6.630  -7.871
  725    HA   GLU  95           HA       GLU  95 -14.354  -6.570 -10.741
  726    HB2  GLU  95           2HB      GLU  95 -12.657  -8.148 -11.263
  727    HB3  GLU  95           1HB      GLU  95 -11.892  -6.923 -10.264
  728    HG2  GLU  95           2HG      GLU  95 -12.939  -9.459  -9.071
  729    HG3  GLU  95           1HG      GLU  95 -11.352  -9.391  -9.831
  730    H    ASN  96           H        ASN  96 -15.146  -8.634 -11.592
  731    HA   ASN  96           HA       ASN  96 -17.129  -9.724  -9.824
  732    HB2  ASN  96           2HB      ASN  96 -17.985 -10.892 -11.746
  733    HB3  ASN  96           1HB      ASN  96 -17.565  -9.259 -12.243
  734   HD21  ASN  96          1HD2      ASN  96 -15.960  -8.944 -13.733
  735   HD22  ASN  96          2HD2      ASN  96 -15.199 -10.240 -14.589
  736    H1   SER 101           1HT      SER 101   2.069 -16.876   5.409
  737    H2   SER 101           2HT      SER 101   1.251 -15.647   6.240
  738    H3   SER 101           3HT      SER 101   2.248 -15.264   4.925
  739    HA   SER 101           HA       SER 101   0.812 -16.252   3.385
  740    HB2  SER 101           2HB      SER 101  -0.851 -17.168   5.741
  741    HB3  SER 101           1HB      SER 101  -1.141 -17.534   4.041
  742    HG   SER 101           HG       SER 101   0.210 -19.126   4.210
  743    H    TRP 102           H        TRP 102  -1.750 -15.697   5.655
  744    HA   TRP 102           HA       TRP 102  -1.896 -12.870   4.892
  745    HB2  TRP 102           2HB      TRP 102  -3.567 -14.909   3.841
  746    HB3  TRP 102           1HB      TRP 102  -4.545 -13.981   4.973
  747    HD1  TRP 102           HD       TRP 102  -3.854 -14.043   1.475
  748    HE1  TRP 102           1HE      TRP 102  -4.177 -11.747   0.360
  749    HE3  TRP 102           3HE      TRP 102  -3.860 -11.105   5.657
  750    HZ2  TRP 102           2HZ      TRP 102  -4.402  -9.052   1.149
  751    HZ3  TRP 102           3HZ      TRP 102  -4.128  -8.675   5.390
  752    HH2  TRP 102           HH       TRP 102  -4.392  -7.672   3.181
  753    H    GLU 103           H        GLU 103  -1.052 -14.135   7.300
  754    HA   GLU 103           HA       GLU 103  -3.174 -14.073   9.218
  755    HB2  GLU 103           2HB      GLU 103  -0.228 -13.877   9.829
  756    HB3  GLU 103           1HB      GLU 103  -1.505 -14.515  10.853
  757    HG2  GLU 103           2HG      GLU 103  -0.676 -16.489  10.152
  758    HG3  GLU 103           1HG      GLU 103  -1.742 -16.188   8.781
  759    H    SER 104           H        SER 104  -0.204 -12.121   9.177
  760    HA   SER 104           HA       SER 104  -1.687  -9.657   9.368
  761    HB2  SER 104           2HB      SER 104   0.015 -10.599  11.691
  762    HB3  SER 104           1HB      SER 104  -0.678  -8.986  11.533
  763    HG   SER 104           HG       SER 104  -2.580 -10.873  11.191
  764    H    HIS 105           H        HIS 105   0.456  -8.128  10.446
  765    HA   HIS 105           HA       HIS 105   2.064  -7.854   8.109
  766    HB2  HIS 105           2HB      HIS 105   3.272  -6.118   9.617
  767    HB3  HIS 105           1HB      HIS 105   1.623  -5.802   9.103
  768    HD2  HIS 105           2HD      HIS 105  -0.338  -6.152  11.150
  769    HE1  HIS 105           1HE      HIS 105   2.535  -5.912  14.247
  770    HE2  HIS 105           2HE      HIS 105   0.064  -6.051  13.712
  771    H    LYS 106           H        LYS 106   3.075  -9.903   8.010
  772    HA   LYS 106           HA       LYS 106   5.078 -10.481  10.054
  773    HB2  LYS 106           2HB      LYS 106   3.905 -12.040   7.779
  774    HB3  LYS 106           1HB      LYS 106   5.424 -12.543   8.504
  775    HG2  LYS 106           2HG      LYS 106   4.275 -12.591  10.715
  776    HG3  LYS 106           1HG      LYS 106   2.756 -12.289   9.867
  777    HD2  LYS 106           2HD      LYS 106   2.916 -14.346   8.686
  778    HD3  LYS 106           1HD      LYS 106   4.577 -14.601   9.225
  779    HE2  LYS 106           2HE      LYS 106   3.790 -14.813  11.532
  780    HE3  LYS 106           1HE      LYS 106   2.134 -14.552  10.992
  781    HZ1  LYS 106           3HZ      LYS 106   2.281 -16.572   9.674
  782    HZ2  LYS 106           1HZ      LYS 106   2.593 -16.891  11.309
  783    HZ3  LYS 106           2HZ      LYS 106   3.871 -16.822  10.205
  784    H    SER 107           H        SER 107   5.082  -8.387   7.754
  785    HA   SER 107           HA       SER 107   7.856  -8.924   6.954
  786    HB2  SER 107           2HB      SER 107   6.820  -7.364   4.909
  787    HB3  SER 107           1HB      SER 107   7.108  -9.102   4.839
  788    HG   SER 107           HG       SER 107   4.973  -8.717   4.283
  789    H    GLY 108           H        GLY 108   6.502  -7.284   9.089
  790    HA2  GLY 108           2HA      GLY 108   8.213  -5.153   9.251
  791    HA3  GLY 108           1HA      GLY 108   6.841  -4.534   8.348
  792    H    GLY 109           H        GLY 109   5.518  -3.419   9.598
  793    HA2  GLY 109           2HA      GLY 109   4.491  -4.579  12.036
  794    HA3  GLY 109           1HA      GLY 109   5.471  -3.140  12.280
  795    H    GLU 110           H        GLU 110   4.162  -1.483  12.680
  796    HA   GLU 110           HA       GLU 110   1.748  -1.206  11.008
  797    HB2  GLU 110           2HB      GLU 110   2.175  -0.175  13.821
  798    HB3  GLU 110           1HB      GLU 110   0.715   0.014  12.862
  799    HG2  GLU 110           2HG      GLU 110   0.692  -2.562  12.803
  800    HG3  GLU 110           1HG      GLU 110   1.815  -2.441  14.157
  801    H    THR 111           H        THR 111   4.381  -0.215  10.326
  802    HA   THR 111           HA       THR 111   4.492   2.585  10.895
  803    HB   THR 111           HB       THR 111   5.875   1.120   8.638
  804    HG1  THR 111           1HG      THR 111   6.480   0.142  10.562
  805   HG21  THR 111          3HG2      THR 111   6.615   3.674  10.079
  806   HG22  THR 111          1HG2      THR 111   5.866   3.594   8.485
  807   HG23  THR 111          2HG2      THR 111   7.481   2.935   8.732
  808    H    ARG 112           H        ARG 112   2.595   3.526  10.326
  809    HA   ARG 112           HA       ARG 112   1.455   3.142   7.705
  810    HB2  ARG 112           2HB      ARG 112  -0.297   4.627   8.458
  811    HB3  ARG 112           1HB      ARG 112   0.049   3.447   9.715
  812    HG2  ARG 112           2HG      ARG 112   1.491   5.188  10.805
  813    HG3  ARG 112           1HG      ARG 112   0.856   6.341   9.633
  814    HD2  ARG 112           2HD      ARG 112  -0.618   6.696  11.332
  815    HD3  ARG 112           1HD      ARG 112  -1.456   5.385  10.502
  816    HE   ARG 112           HE       ARG 112  -0.768   3.893  12.198
  817   HH11  ARG 112          1HH1      ARG 112   0.230   7.192  12.810
  818   HH12  ARG 112          2HH1      ARG 112   0.511   6.932  14.500
  819   HH21  ARG 112          1HH2      ARG 112  -0.382   3.540  14.435
  820   HH22  ARG 112          2HH2      ARG 112   0.178   4.854  15.423
  821    H    LEU 113           H        LEU 113   0.740   5.297   6.569
  822    HA   LEU 113           HA       LEU 113   3.226   6.739   6.068
  823    HB2  LEU 113           2HB      LEU 113   0.779   6.124   4.512
  824    HB3  LEU 113           1HB      LEU 113   1.573   7.640   4.157
  825    HG   LEU 113           HG       LEU 113   2.314   5.922   2.620
  826   HD11  LEU 113          1HD1      LEU 113   4.448   6.685   4.599
  827   HD12  LEU 113          2HD1      LEU 113   3.919   7.627   3.207
  828   HD13  LEU 113          3HD1      LEU 113   4.731   6.079   2.969
  829   HD21  LEU 113          3HD2      LEU 113   1.902   4.018   4.176
  830   HD22  LEU 113          1HD2      LEU 113   3.401   4.439   5.005
  831   HD23  LEU 113          2HD2      LEU 113   3.437   3.934   3.314
  Start of MODEL    9
    1    H1   GLY   1           1HT      GLY   1  -9.402 -11.547 -10.678
    2    H2   GLY   1           2HT      GLY   1  -8.561 -11.393 -12.136
    3    H3   GLY   1           3HT      GLY   1 -10.229 -11.125 -12.089
    4    HA2  GLY   1           1HA      GLY   1  -9.854  -9.221 -10.591
    5    HA3  GLY   1           2HA      GLY   1  -8.130  -9.463 -10.822
    6    H    GLY   2           H        GLY   2  -8.362  -7.169 -11.580
    7    HA2  GLY   2           2HA      GLY   2  -9.254  -7.099 -14.393
    8    HA3  GLY   2           1HA      GLY   2  -9.221  -5.702 -13.327
    9    H    SER   3           H        SER   3  -8.038  -4.878 -15.275
   10    HA   SER   3           HA       SER   3  -5.163  -5.281 -14.859
   11    HB2  SER   3           2HB      SER   3  -6.451  -4.979 -17.588
   12    HB3  SER   3           1HB      SER   3  -4.738  -5.233 -17.252
   13    HG   SER   3           HG       SER   3  -6.884  -7.032 -17.086
   14    H    MET   4           H        MET   4  -3.879  -3.447 -15.340
   15    HA   MET   4           HA       MET   4  -3.348  -1.246 -15.339
   16    HB2  MET   4           2HB      MET   4  -5.932  -1.075 -16.889
   17    HB3  MET   4           1HB      MET   4  -4.899   0.318 -16.600
   18    HG2  MET   4           2HG      MET   4  -3.133  -0.619 -17.869
   19    HG3  MET   4           1HG      MET   4  -3.928  -2.191 -17.940
   20    HE1  MET   4           3HE      MET   4  -5.531   1.438 -18.550
   21    HE2  MET   4           1HE      MET   4  -5.222   1.569 -20.280
   22    HE3  MET   4           2HE      MET   4  -3.872   1.480 -19.146
   23    H    ARG   5           H        ARG   5  -3.580  -1.361 -13.038
   24    HA   ARG   5           HA       ARG   5  -6.005  -0.574 -11.765
   25    HB2  ARG   5           2HB      ARG   5  -3.173  -0.782 -10.736
   26    HB3  ARG   5           1HB      ARG   5  -4.545  -0.364  -9.721
   27    HG2  ARG   5           2HG      ARG   5  -4.378  -2.609  -9.322
   28    HG3  ARG   5           1HG      ARG   5  -5.533  -2.601 -10.655
   29    HD2  ARG   5           2HD      ARG   5  -3.732  -3.052 -12.232
   30    HD3  ARG   5           1HD      ARG   5  -2.561  -3.023 -10.916
   31    HE   ARG   5           HE       ARG   5  -4.686  -4.948 -10.597
   32   HH11  ARG   5          1HH1      ARG   5  -1.480  -4.346 -11.867
   33   HH12  ARG   5          2HH1      ARG   5  -1.020  -6.019 -11.867
   34   HH21  ARG   5          1HH2      ARG   5  -4.086  -7.153 -10.572
   35   HH22  ARG   5          2HH2      ARG   5  -2.504  -7.617 -11.116
   36    HA   PRO   6           HA       PRO   6  -5.314   3.820 -12.006
   37    HB2  PRO   6           2HB      PRO   6  -7.449   4.393 -10.267
   38    HB3  PRO   6           1HB      PRO   6  -7.558   4.147 -12.010
   39    HG2  PRO   6           2HG      PRO   6  -8.671   2.473 -10.060
   40    HG3  PRO   6           1HG      PRO   6  -8.425   2.058 -11.756
   41    HD2  PRO   6           2HD      PRO   6  -6.726   1.457  -9.371
   42    HD3  PRO   6           1HD      PRO   6  -7.166   0.421 -10.743
   43    HA   PRO   7           HA       PRO   7  -3.038   4.515  -8.120
   44    HB2  PRO   7           2HB      PRO   7  -1.821   6.716  -9.570
   45    HB3  PRO   7           1HB      PRO   7  -1.066   5.298  -8.849
   46    HG2  PRO   7           2HG      PRO   7  -1.248   5.655 -11.518
   47    HG3  PRO   7           1HG      PRO   7  -1.298   4.046 -10.772
   48    HD2  PRO   7           2HD      PRO   7  -3.557   5.737 -11.790
   49    HD3  PRO   7           1HD      PRO   7  -3.307   3.985 -11.945
   50    H    ILE   8           H        ILE   8  -3.990   5.563  -6.568
   51    HA   ILE   8           HA       ILE   8  -5.480   7.973  -7.024
   52    HB   ILE   8           HB       ILE   8  -4.838   6.881  -4.319
   53   HG12  ILE   8          2HG1      ILE   8  -7.215   5.798  -5.558
   54   HG13  ILE   8          1HG1      ILE   8  -5.780   5.319  -6.396
   55   HG21  ILE   8          1HG2      ILE   8  -6.187   8.975  -4.775
   56   HG22  ILE   8          2HG2      ILE   8  -6.965   7.745  -3.778
   57   HG23  ILE   8          3HG2      ILE   8  -7.396   7.900  -5.480
   58   HD11  ILE   8          3HD1      ILE   8  -6.564   3.746  -4.617
   59   HD12  ILE   8          1HD1      ILE   8  -6.126   4.987  -3.447
   60   HD13  ILE   8          2HD1      ILE   8  -4.885   4.272  -4.475
   61    H    ILE   9           H        ILE   9  -4.342   9.788  -7.269
   62    HA   ILE   9           HA       ILE   9  -1.722  10.098  -6.164
   63    HB   ILE   9           HB       ILE   9  -3.259  12.408  -7.257
   64   HG12  ILE   9          2HG1      ILE   9  -3.737  10.487  -8.775
   65   HG13  ILE   9          1HG1      ILE   9  -2.818  11.774  -9.542
   66   HG21  ILE   9          1HG2      ILE   9  -1.046  12.865  -6.482
   67   HG22  ILE   9          2HG2      ILE   9  -1.016  12.917  -8.243
   68   HG23  ILE   9          3HG2      ILE   9  -0.384  11.505  -7.390
   69   HD11  ILE   9          3HD1      ILE   9  -1.973   9.624 -10.207
   70   HD12  ILE   9          1HD1      ILE   9  -1.725   9.169  -8.522
   71   HD13  ILE   9          2HD1      ILE   9  -0.768  10.468  -9.234
   72    H    ILE  10           H        ILE  10  -1.792  10.144  -3.943
   73    HA   ILE  10           HA       ILE  10  -3.647  11.840  -2.516
   74    HB   ILE  10           HB       ILE  10  -1.068  10.649  -1.438
   75   HG12  ILE  10          2HG1      ILE  10  -3.583   9.381  -0.652
   76   HG13  ILE  10          1HG1      ILE  10  -3.139   9.106  -2.315
   77   HG21  ILE  10          1HG2      ILE  10  -2.256  10.827   0.742
   78   HG22  ILE  10          2HG2      ILE  10  -3.542  11.704  -0.083
   79   HG23  ILE  10          3HG2      ILE  10  -1.914  12.381  -0.019
   80   HD11  ILE  10          3HD1      ILE  10  -1.110   8.094  -1.715
   81   HD12  ILE  10          1HD1      ILE  10  -2.341   7.415  -0.651
   82   HD13  ILE  10          2HD1      ILE  10  -1.253   8.667  -0.054
   83    H    HIS  11           H        HIS  11  -2.893  13.681  -1.217
   84    HA   HIS  11           HA       HIS  11  -0.415  14.907  -2.165
   85    HB2  HIS  11           2HB      HIS  11  -2.368  15.859  -3.440
   86    HB3  HIS  11           1HB      HIS  11  -3.044  16.403  -1.907
   87    HD2  HIS  11           2HD      HIS  11   0.198  17.072  -4.041
   88    HE1  HIS  11           1HE      HIS  11  -0.729  20.465  -1.687
   89    HE2  HIS  11           2HE      HIS  11   0.938  19.447  -3.308
   90    H    ARG  12           H        ARG  12   0.753  15.098  -0.391
   91    HA   ARG  12           HA       ARG  12  -0.289  14.942   2.212
   92    HB2  ARG  12           2HB      ARG  12   2.008  14.311   1.566
   93    HB3  ARG  12           1HB      ARG  12   2.387  16.011   1.324
   94    HG2  ARG  12           2HG      ARG  12   1.992  16.463   3.667
   95    HG3  ARG  12           1HG      ARG  12   1.525  14.779   3.926
   96    HD2  ARG  12           2HD      ARG  12   3.708  14.023   3.345
   97    HD3  ARG  12           1HD      ARG  12   4.199  15.649   2.880
   98    HE   ARG  12           HE       ARG  12   3.361  15.196   5.649
   99   HH11  ARG  12          1HH1      ARG  12   5.972  15.740   3.376
  100   HH12  ARG  12          2HH1      ARG  12   7.075  16.297   4.592
  101   HH21  ARG  12          1HH2      ARG  12   4.797  15.942   7.234
  102   HH22  ARG  12          2HH2      ARG  12   6.408  16.406   6.788
  103    H    ALA  13           H        ALA  13  -1.570  16.402   3.047
  104    HA   ALA  13           HA       ALA  13  -1.333  19.215   2.452
  105    HB1  ALA  13           1HB      ALA  13  -3.272  19.405   4.028
  106    HB2  ALA  13           2HB      ALA  13  -3.185  17.656   4.256
  107    HB3  ALA  13           3HB      ALA  13  -3.548  18.323   2.664
  108    H    GLY  14           H        GLY  14   1.013  18.575   3.467
  109    HA2  GLY  14           2HA      GLY  14   2.487  19.477   5.012
  110    HA3  GLY  14           1HA      GLY  14   1.114  20.043   5.952
  111    H    LYS  15           H        LYS  15  -0.252  17.800   6.506
  112    HA   LYS  15           HA       LYS  15   1.309  16.622   8.568
  113    HB2  LYS  15           2HB      LYS  15  -0.868  15.098   8.639
  114    HB3  LYS  15           1HB      LYS  15  -0.856  16.742   9.256
  115    HG2  LYS  15           2HG      LYS  15  -1.880  17.559   7.231
  116    HG3  LYS  15           1HG      LYS  15  -1.778  15.961   6.494
  117    HD2  LYS  15           2HD      LYS  15  -4.032  16.373   7.293
  118    HD3  LYS  15           1HD      LYS  15  -3.278  15.082   8.232
  119    HE2  LYS  15           2HE      LYS  15  -2.851  16.583  10.058
  120    HE3  LYS  15           1HE      LYS  15  -3.389  17.968   9.105
  121    HZ1  LYS  15           3HZ      LYS  15  -5.137  15.689   9.849
  122    HZ2  LYS  15           1HZ      LYS  15  -5.610  17.142   9.126
  123    HZ3  LYS  15           2HZ      LYS  15  -5.051  17.134  10.721
  124    H    LYS  16           H        LYS  16  -0.694  14.543   6.559
  125    HA   LYS  16           HA       LYS  16   1.545  13.159   5.412
  126    HB2  LYS  16           2HB      LYS  16   0.934  10.977   6.528
  127    HB3  LYS  16           1HB      LYS  16   1.724  12.158   7.550
  128    HG2  LYS  16           2HG      LYS  16  -0.606  12.823   8.320
  129    HG3  LYS  16           1HG      LYS  16  -1.158  11.339   7.541
  130    HD2  LYS  16           2HD      LYS  16   0.805  10.276   8.950
  131    HD3  LYS  16           1HD      LYS  16   0.549  11.703   9.952
  132    HE2  LYS  16           2HE      LYS  16  -1.581   9.711   9.188
  133    HE3  LYS  16           1HE      LYS  16  -0.746   9.771  10.738
  134    HZ1  LYS  16           3HZ      LYS  16  -3.013  10.881  10.577
  135    HZ2  LYS  16           1HZ      LYS  16  -2.232  12.100   9.702
  136    HZ3  LYS  16           2HZ      LYS  16  -1.761  11.779  11.290
  137    H    TYR  17           H        TYR  17   0.456  10.770   4.749
  138    HA   TYR  17           HA       TYR  17  -1.669  11.588   2.937
  139    HB2  TYR  17           2HB      TYR  17  -0.310   8.894   3.016
  140    HB3  TYR  17           1HB      TYR  17  -1.187   9.625   1.668
  141    HD1  TYR  17           1HD      TYR  17   1.952   9.773   3.631
  142    HD2  TYR  17           2HD      TYR  17  -0.142  11.217   0.230
  143    HE1  TYR  17           1HE      TYR  17   4.025  10.790   2.796
  144    HE2  TYR  17           2HE      TYR  17   1.926  12.233  -0.624
  145    HH   TYR  17           HH       TYR  17   4.898  11.471   0.353
  146    H    GLY  18           H        GLY  18  -1.459  10.513   5.936
  147    HA2  GLY  18           2HA      GLY  18  -2.894   9.762   7.494
  148    HA3  GLY  18           1HA      GLY  18  -4.162  10.033   6.334
  149    H    PHE  19           H        PHE  19  -2.600   7.894   4.679
  150    HA   PHE  19           HA       PHE  19  -4.253   5.782   5.760
  151    HB2  PHE  19           2HB      PHE  19  -4.160   4.660   3.723
  152    HB3  PHE  19           1HB      PHE  19  -4.301   6.335   3.326
  153    HD1  PHE  19           2HD      PHE  19  -2.048   7.571   2.827
  154    HD2  PHE  19           1HD      PHE  19  -2.574   3.356   2.745
  155    HE1  PHE  19           2HE      PHE  19  -0.047   7.351   1.404
  156    HE2  PHE  19           1HE      PHE  19  -0.578   3.122   1.330
  157    HZ   PHE  19           HZ       PHE  19   0.690   5.125   0.657
  158    H    THR  20           H        THR  20  -3.701   3.807   6.218
  159    HA   THR  20           HA       THR  20  -1.012   3.500   7.315
  160    HB   THR  20           HB       THR  20  -3.514   1.841   7.691
  161    HG1  THR  20           1HG      THR  20  -3.139   4.161   8.591
  162   HG21  THR  20          3HG2      THR  20  -1.037   1.725   9.399
  163   HG22  THR  20          1HG2      THR  20  -1.310   0.632   8.042
  164   HG23  THR  20          2HG2      THR  20  -2.427   0.634   9.408
  165    H    LEU  21           H        LEU  21   0.511   2.483   6.028
  166    HA   LEU  21           HA       LEU  21  -0.389   0.538   4.056
  167    HB2  LEU  21           2HB      LEU  21   1.637   2.369   3.917
  168    HB3  LEU  21           1HB      LEU  21   2.518   0.941   4.370
  169    HG   LEU  21           HG       LEU  21   2.358   0.048   2.328
  170   HD11  LEU  21          1HD1      LEU  21   0.330   0.130   0.912
  171   HD12  LEU  21          2HD1      LEU  21  -0.463   1.097   2.154
  172   HD13  LEU  21          3HD1      LEU  21   0.032  -0.560   2.507
  173   HD21  LEU  21          3HD2      LEU  21   1.381   2.800   1.627
  174   HD22  LEU  21          1HD2      LEU  21   2.166   1.661   0.535
  175   HD23  LEU  21          2HD2      LEU  21   3.062   2.342   1.895
  176    H    ARG  22           H        ARG  22  -1.085  -1.076   5.534
  177    HA   ARG  22           HA       ARG  22   0.687  -2.281   7.423
  178    HB2  ARG  22           2HB      ARG  22  -2.020  -2.403   6.906
  179    HB3  ARG  22           1HB      ARG  22  -1.464  -3.977   6.363
  180    HG2  ARG  22           2HG      ARG  22  -2.082  -4.270   8.600
  181    HG3  ARG  22           1HG      ARG  22  -0.319  -4.193   8.611
  182    HD2  ARG  22           2HD      ARG  22  -0.291  -2.076   9.558
  183    HD3  ARG  22           1HD      ARG  22  -1.934  -1.711   9.029
  184    HE   ARG  22           HE       ARG  22  -1.882  -3.873  10.879
  185   HH11  ARG  22          1HH1      ARG  22  -1.674  -0.385  10.698
  186   HH12  ARG  22          2HH1      ARG  22  -2.358  -0.134  12.270
  187   HH21  ARG  22          1HH2      ARG  22  -2.774  -3.544  12.959
  188   HH22  ARG  22          2HH2      ARG  22  -2.978  -1.928  13.552
  189    H    ALA  23           H        ALA  23   2.109  -3.947   7.143
  190    HA   ALA  23           HA       ALA  23   2.441  -4.982   4.413
  191    HB1  ALA  23           1HB      ALA  23   4.407  -5.132   6.690
  192    HB2  ALA  23           2HB      ALA  23   4.366  -3.836   5.496
  193    HB3  ALA  23           3HB      ALA  23   4.705  -5.489   4.988
  194    H    ILE  24           H        ILE  24   2.466  -7.141   3.970
  195    HA   ILE  24           HA       ILE  24   2.238  -9.066   6.149
  196    HB   ILE  24           HB       ILE  24   0.327 -10.175   4.798
  197   HG12  ILE  24          2HG1      ILE  24  -0.642  -7.485   4.104
  198   HG13  ILE  24          1HG1      ILE  24   0.709  -8.049   3.124
  199   HG21  ILE  24          1HG2      ILE  24  -1.356  -8.956   6.095
  200   HG22  ILE  24          2HG2      ILE  24  -0.167  -7.700   6.437
  201   HG23  ILE  24          3HG2      ILE  24   0.074  -9.333   7.056
  202   HD11  ILE  24          3HD1      ILE  24  -0.531 -10.007   2.476
  203   HD12  ILE  24          1HD1      ILE  24  -1.480  -8.559   2.140
  204   HD13  ILE  24          2HD1      ILE  24  -1.859  -9.556   3.545
  205    H    ARG  25           H        ARG  25   1.701 -11.322   4.811
  206    HA   ARG  25           HA       ARG  25   3.316 -11.472   2.408
  207    HB2  ARG  25           2HB      ARG  25   4.609 -13.435   3.428
  208    HB3  ARG  25           1HB      ARG  25   5.098 -11.809   3.867
  209    HG2  ARG  25           2HG      ARG  25   3.272 -12.426   5.817
  210    HG3  ARG  25           1HG      ARG  25   4.078 -13.969   5.528
  211    HD2  ARG  25           2HD      ARG  25   5.480 -11.360   6.092
  212    HD3  ARG  25           1HD      ARG  25   5.175 -12.620   7.282
  213    HE   ARG  25           HE       ARG  25   6.636 -14.074   5.985
  214   HH11  ARG  25          1HH1      ARG  25   6.822 -10.627   5.328
  215   HH12  ARG  25          2HH1      ARG  25   8.426 -10.717   4.670
  216   HH21  ARG  25          1HH2      ARG  25   8.757 -14.173   5.131
  217   HH22  ARG  25          2HH2      ARG  25   9.520 -12.722   4.565
  218    H    VAL  26           H        VAL  26   2.239 -12.626   1.059
  219    HA   VAL  26           HA       VAL  26   0.173 -14.461   1.931
  220    HB   VAL  26           HB       VAL  26  -0.222 -14.762  -0.541
  221   HG11  VAL  26          1HG1      VAL  26  -0.295 -11.941   0.523
  222   HG12  VAL  26          2HG1      VAL  26  -1.532 -13.175   0.757
  223   HG13  VAL  26          3HG1      VAL  26  -1.217 -12.537  -0.856
  224   HG21  VAL  26          3HG2      VAL  26   1.961 -14.263  -1.387
  225   HG22  VAL  26          1HG2      VAL  26   1.891 -12.633  -0.719
  226   HG23  VAL  26          2HG2      VAL  26   0.815 -13.092  -2.039
  227    H    TYR  27           H        TYR  27   0.207 -16.399  -0.007
  228    HA   TYR  27           HA       TYR  27   2.796 -17.642  -0.197
  229    HB2  TYR  27           2HB      TYR  27   1.004 -18.364   1.965
  230    HB3  TYR  27           1HB      TYR  27   1.249 -19.732   0.882
  231    HD1  TYR  27           2HD      TYR  27   2.916 -17.355   3.135
  232    HD2  TYR  27           1HD      TYR  27   3.380 -20.843   0.749
  233    HE1  TYR  27           2HE      TYR  27   5.088 -17.788   4.202
  234    HE2  TYR  27           1HE      TYR  27   5.556 -21.284   1.808
  235    HH   TYR  27           HH       TYR  27   7.334 -20.011   2.981
  236    H    MET  28           H        MET  28   2.862 -19.003  -1.955
  237    HA   MET  28           HA       MET  28   0.278 -19.442  -3.308
  238    HB2  MET  28           2HB      MET  28   2.930 -18.850  -4.626
  239    HB3  MET  28           1HB      MET  28   1.410 -19.110  -5.436
  240    HG2  MET  28           2HG      MET  28   2.051 -16.880  -3.614
  241    HG3  MET  28           1HG      MET  28   1.984 -16.785  -5.358
  242    HE1  MET  28           3HE      MET  28   0.299 -14.799  -5.427
  243    HE2  MET  28           1HE      MET  28   0.417 -14.702  -3.669
  244    HE3  MET  28           2HE      MET  28  -1.166 -14.715  -4.445
  245    H    GLY  29           H        GLY  29  -0.198 -21.527  -3.270
  246    HA2  GLY  29           2HA      GLY  29  -0.033 -23.751  -3.873
  247    HA3  GLY  29           1HA      GLY  29   1.576 -23.429  -4.493
  248    H    ASP  30           H        ASP  30   2.201 -25.447  -3.618
  249    HA   ASP  30           HA       ASP  30   2.273 -25.709  -0.714
  250    HB2  ASP  30           2HB      ASP  30   2.860 -27.539  -3.017
  251    HB3  ASP  30           1HB      ASP  30   3.534 -27.903  -1.434
  252    H    SER  31           H        SER  31   4.243 -24.675  -3.297
  253    HA   SER  31           HA       SER  31   6.784 -25.168  -2.119
  254    HB2  SER  31           2HB      SER  31   5.953 -23.189  -4.255
  255    HB3  SER  31           1HB      SER  31   7.617 -23.598  -3.849
  256    HG   SER  31           HG       SER  31   6.752 -25.882  -4.282
  257    H    ASP  32           H        ASP  32   8.268 -23.433  -1.391
  258    HA   ASP  32           HA       ASP  32   6.933 -21.808   0.577
  259    HB2  ASP  32           2HB      ASP  32   9.337 -23.067   0.553
  260    HB3  ASP  32           1HB      ASP  32   9.826 -21.411   0.202
  261    H    VAL  33           H        VAL  33   6.742 -21.140  -2.377
  262    HA   VAL  33           HA       VAL  33   8.083 -18.602  -2.573
  263    HB   VAL  33           HB       VAL  33   7.862 -19.813  -4.625
  264   HG11  VAL  33          1HG1      VAL  33   4.960 -19.922  -3.927
  265   HG12  VAL  33          2HG1      VAL  33   6.049 -21.234  -4.377
  266   HG13  VAL  33          3HG1      VAL  33   5.502 -20.086  -5.597
  267   HG21  VAL  33          3HG2      VAL  33   6.028 -17.424  -4.571
  268   HG22  VAL  33          1HG2      VAL  33   6.675 -18.162  -6.037
  269   HG23  VAL  33          2HG2      VAL  33   7.767 -17.423  -4.866
  270    H    TYR  34           H        TYR  34   7.285 -16.702  -2.103
  271    HA   TYR  34           HA       TYR  34   4.427 -16.303  -1.791
  272    HB2  TYR  34           2HB      TYR  34   4.618 -15.375   0.455
  273    HB3  TYR  34           1HB      TYR  34   5.164 -17.044   0.432
  274    HD1  TYR  34           1HD      TYR  34   6.190 -13.545   0.829
  275    HD2  TYR  34           2HD      TYR  34   7.482 -17.603   0.835
  276    HE1  TYR  34           1HE      TYR  34   8.287 -12.870   1.912
  277    HE2  TYR  34           2HE      TYR  34   9.583 -16.934   1.923
  278    HH   TYR  34           HH       TYR  34  10.955 -15.053   2.296
  279    H    THR  35           H        THR  35   3.822 -14.053  -1.693
  280    HA   THR  35           HA       THR  35   5.950 -12.303  -2.732
  281    HB   THR  35           HB       THR  35   3.476 -11.158  -3.385
  282    HG1  THR  35           1HG      THR  35   3.454 -13.753  -4.475
  283   HG21  THR  35          3HG2      THR  35   5.496 -10.980  -4.720
  284   HG22  THR  35          1HG2      THR  35   4.183 -11.629  -5.700
  285   HG23  THR  35          2HG2      THR  35   5.436 -12.705  -5.083
  286    H    VAL  36           H        VAL  36   6.396 -10.508  -1.629
  287    HA   VAL  36           HA       VAL  36   4.946  -9.965   0.805
  288    HB   VAL  36           HB       VAL  36   7.164  -8.276  -0.345
  289   HG11  VAL  36          1HG1      VAL  36   5.951  -7.311   1.532
  290   HG12  VAL  36          2HG1      VAL  36   7.592  -7.746   2.009
  291   HG13  VAL  36          3HG1      VAL  36   6.234  -8.768   2.482
  292   HG21  VAL  36          3HG2      VAL  36   8.023 -10.512  -0.335
  293   HG22  VAL  36          1HG2      VAL  36   7.393 -10.800   1.286
  294   HG23  VAL  36          2HG2      VAL  36   8.708  -9.649   1.042
  295    H    HIS  37           H        HIS  37   3.006  -9.072   0.491
  296    HA   HIS  37           HA       HIS  37   2.791  -6.784  -1.348
  297    HB2  HIS  37           2HB      HIS  37   0.623  -8.608  -0.269
  298    HB3  HIS  37           1HB      HIS  37   0.330  -7.190  -1.265
  299    HD2  HIS  37           2HD      HIS  37   1.092 -10.888  -1.611
  300    HE1  HIS  37           1HE      HIS  37   1.499  -9.146  -5.444
  301    HE2  HIS  37           2HE      HIS  37   1.557 -11.312  -4.124
  302    H    HIS  38           H        HIS  38   0.687  -5.472  -0.507
  303    HA   HIS  38           HA       HIS  38   0.836  -4.957   2.351
  304    HB2  HIS  38           2HB      HIS  38   1.413  -2.795   0.299
  305    HB3  HIS  38           1HB      HIS  38   1.209  -2.533   2.026
  306    HD2  HIS  38           2HD      HIS  38   3.913  -3.253  -0.496
  307    HE1  HIS  38           1HE      HIS  38   5.544  -4.061   3.314
  308    HE2  HIS  38           2HE      HIS  38   5.988  -4.094   0.827
  309    H    MET  39           H        MET  39  -0.823  -3.209   2.904
  310    HA   MET  39           HA       MET  39  -2.958  -2.879   0.982
  311    HB2  MET  39           2HB      MET  39  -2.982  -5.067   2.856
  312    HB3  MET  39           1HB      MET  39  -4.288  -3.951   3.233
  313    HG2  MET  39           2HG      MET  39  -5.091  -4.117   0.932
  314    HG3  MET  39           1HG      MET  39  -3.785  -5.241   0.559
  315    HE1  MET  39           3HE      MET  39  -3.589  -7.203   2.979
  316    HE2  MET  39           1HE      MET  39  -3.646  -7.654   1.274
  317    HE3  MET  39           2HE      MET  39  -4.710  -8.449   2.433
  318    H    VAL  40           H        VAL  40  -4.171  -1.110   1.441
  319    HA   VAL  40           HA       VAL  40  -3.301   0.560   3.586
  320    HB   VAL  40           HB       VAL  40  -3.924   1.760   1.659
  321   HG11  VAL  40          1HG1      VAL  40  -6.751   1.035   1.511
  322   HG12  VAL  40          2HG1      VAL  40  -5.644  -0.277   1.116
  323   HG13  VAL  40          3HG1      VAL  40  -5.557   1.242   0.229
  324   HG21  VAL  40          3HG2      VAL  40  -4.784   2.545   3.965
  325   HG22  VAL  40          1HG2      VAL  40  -6.379   2.143   3.331
  326   HG23  VAL  40          2HG2      VAL  40  -5.385   3.348   2.512
  327    H    TRP  41           H        TRP  41  -3.714  -0.116   5.486
  328    HA   TRP  41           HA       TRP  41  -5.954  -1.655   6.282
  329    HB2  TRP  41           2HB      TRP  41  -3.499  -1.269   7.257
  330    HB3  TRP  41           1HB      TRP  41  -4.385  -0.161   8.294
  331    HD1  TRP  41           HD       TRP  41  -4.765  -1.318  10.493
  332    HE1  TRP  41           1HE      TRP  41  -5.559  -3.640  11.247
  333    HE3  TRP  41           3HE      TRP  41  -5.159  -3.545   5.918
  334    HZ2  TRP  41           2HZ      TRP  41  -6.277  -6.113  10.035
  335    HZ3  TRP  41           3HZ      TRP  41  -5.911  -5.880   5.799
  336    HH2  TRP  41           HH       TRP  41  -6.459  -7.133   7.819
  337    H    HIS  42           H        HIS  42  -5.092   1.720   6.671
  338    HA   HIS  42           HA       HIS  42  -7.872   2.413   7.130
  339    HB2  HIS  42           2HB      HIS  42  -6.503   1.816   9.334
  340    HB3  HIS  42           1HB      HIS  42  -5.963   3.470   9.153
  341    HD2  HIS  42           2HD      HIS  42  -8.324   5.289   8.844
  342    HE1  HIS  42           1HE      HIS  42 -10.482   2.862  11.554
  343    HE2  HIS  42           2HE      HIS  42 -10.486   5.034  10.249
  344    H    VAL  43           H        VAL  43  -8.254   4.247   6.117
  345    HA   VAL  43           HA       VAL  43  -5.992   6.066   5.711
  346    HB   VAL  43           HB       VAL  43  -6.461   5.180   3.580
  347   HG11  VAL  43          1HG1      VAL  43  -8.544   4.143   3.920
  348   HG12  VAL  43          2HG1      VAL  43  -8.739   5.296   2.599
  349   HG13  VAL  43          3HG1      VAL  43  -9.337   5.689   4.211
  350   HG21  VAL  43          3HG2      VAL  43  -6.101   7.523   3.448
  351   HG22  VAL  43          1HG2      VAL  43  -7.775   7.861   3.894
  352   HG23  VAL  43          2HG2      VAL  43  -7.414   7.121   2.336
  353    H    GLU  44           H        GLU  44  -6.189   8.023   6.373
  354    HA   GLU  44           HA       GLU  44  -8.300   8.805   8.059
  355    HB2  GLU  44           2HB      GLU  44  -5.755   9.857   7.166
  356    HB3  GLU  44           1HB      GLU  44  -6.949  11.122   7.371
  357    HG2  GLU  44           2HG      GLU  44  -7.241  10.626   9.642
  358    HG3  GLU  44           1HG      GLU  44  -6.440   9.064   9.486
  359    H    ASP  45           H        ASP  45 -10.249   9.356   7.466
  360    HA   ASP  45           HA       ASP  45 -10.841  10.367   4.823
  361    HB2  ASP  45           2HB      ASP  45 -13.183  10.199   5.522
  362    HB3  ASP  45           1HB      ASP  45 -12.318   8.713   5.893
  363    H    GLY  46           H        GLY  46  -9.201  12.123   6.273
  364    HA2  GLY  46           2HA      GLY  46 -11.074  14.351   6.765
  365    HA3  GLY  46           1HA      GLY  46  -9.614  14.121   7.707
  366    H    GLY  47           H        GLY  47  -9.126  13.404   4.395
  367    HA2  GLY  47           2HA      GLY  47  -8.917  15.755   3.098
  368    HA3  GLY  47           1HA      GLY  47  -7.559  15.835   4.197
  369    HA   PRO  48           HA       PRO  48  -4.851  13.592   1.592
  370    HB2  PRO  48           2HB      PRO  48  -4.774  11.237   3.399
  371    HB3  PRO  48           1HB      PRO  48  -3.459  12.227   2.764
  372    HG2  PRO  48           2HG      PRO  48  -4.183  12.522   5.262
  373    HG3  PRO  48           1HG      PRO  48  -3.895  13.968   4.265
  374    HD2  PRO  48           2HD      PRO  48  -6.507  12.666   4.983
  375    HD3  PRO  48           1HD      PRO  48  -6.030  14.370   5.072
  376    H    ALA  49           H        ALA  49  -4.596  10.570   1.852
  377    HA   ALA  49           HA       ALA  49  -5.391   9.747  -0.562
  378    HB1  ALA  49           1HB      ALA  49  -4.542   7.787   0.041
  379    HB2  ALA  49           2HB      ALA  49  -5.639   7.603   1.415
  380    HB3  ALA  49           3HB      ALA  49  -4.176   8.579   1.577
  381    H    SER  50           H        SER  50  -7.578   9.804   2.241
  382    HA   SER  50           HA       SER  50  -9.552   8.126   1.153
  383    HB2  SER  50           2HB      SER  50  -9.359  10.041   3.361
  384    HB3  SER  50           1HB      SER  50 -10.977   9.889   2.686
  385    HG   SER  50           HG       SER  50 -10.530   7.514   2.878
  386    H    GLU  51           H        GLU  51  -9.501  11.681   1.253
  387    HA   GLU  51           HA       GLU  51 -11.763  12.008  -0.408
  388    HB2  GLU  51           2HB      GLU  51  -9.506  13.954   0.077
  389    HB3  GLU  51           1HB      GLU  51 -11.114  14.347  -0.518
  390    HG2  GLU  51           2HG      GLU  51 -11.502  12.957   1.874
  391    HG3  GLU  51           1HG      GLU  51 -10.181  14.085   2.173
  392    H    ALA  52           H        ALA  52  -8.385  11.604  -1.009
  393    HA   ALA  52           HA       ALA  52  -8.249  12.486  -3.666
  394    HB1  ALA  52           1HB      ALA  52  -6.275  12.054  -2.303
  395    HB2  ALA  52           2HB      ALA  52  -6.216  11.121  -3.801
  396    HB3  ALA  52           3HB      ALA  52  -6.654  10.333  -2.283
  397    H    GLY  53           H        GLY  53  -9.459   9.531  -2.242
  398    HA2  GLY  53           2HA      GLY  53 -11.169   8.496  -3.796
  399    HA3  GLY  53           1HA      GLY  53  -9.843   8.418  -4.940
  400    H    LEU  54           H        LEU  54  -8.242   7.835  -2.251
  401    HA   LEU  54           HA       LEU  54  -8.052   5.038  -2.694
  402    HB2  LEU  54           2HB      LEU  54  -6.282   6.623  -1.732
  403    HB3  LEU  54           1HB      LEU  54  -7.124   6.456  -0.213
  404    HG   LEU  54           HG       LEU  54  -6.009   4.109  -1.736
  405   HD11  LEU  54          1HD1      LEU  54  -4.199   5.652  -1.134
  406   HD12  LEU  54          2HD1      LEU  54  -4.133   4.152  -0.208
  407   HD13  LEU  54          3HD1      LEU  54  -4.748   5.624   0.541
  408   HD21  LEU  54          3HD2      LEU  54  -6.963   4.500   1.077
  409   HD22  LEU  54          1HD2      LEU  54  -6.177   3.041   0.474
  410   HD23  LEU  54          2HD2      LEU  54  -7.733   3.546  -0.189
  411    H    ARG  55           H        ARG  55  -9.518   3.609  -2.159
  412    HA   ARG  55           HA       ARG  55 -11.333   4.127   0.045
  413    HB2  ARG  55           2HB      ARG  55 -12.491   2.063  -0.724
  414    HB3  ARG  55           1HB      ARG  55 -12.372   3.301  -1.963
  415    HG2  ARG  55           2HG      ARG  55 -11.702   1.614  -3.270
  416    HG3  ARG  55           1HG      ARG  55 -10.144   1.835  -2.472
  417    HD2  ARG  55           2HD      ARG  55 -10.726  -0.502  -2.425
  418    HD3  ARG  55           1HD      ARG  55 -10.805   0.148  -0.791
  419    HE   ARG  55           HE       ARG  55 -13.349   0.369  -1.578
  420   HH11  ARG  55          1HH1      ARG  55 -11.103  -2.296  -1.840
  421   HH12  ARG  55          2HH1      ARG  55 -12.322  -3.516  -1.675
  422   HH21  ARG  55          1HH2      ARG  55 -14.972  -1.243  -1.362
  423   HH22  ARG  55          2HH2      ARG  55 -14.519  -2.919  -1.410
  424    H    GLN  56           H        GLN  56 -10.944   3.424   2.031
  425    HA   GLN  56           HA       GLN  56  -8.786   1.953   2.885
  426    HB2  GLN  56           2HB      GLN  56 -10.342   3.239   4.318
  427    HB3  GLN  56           1HB      GLN  56 -11.510   1.954   4.164
  428    HG2  GLN  56           2HG      GLN  56 -10.213   0.524   5.390
  429    HG3  GLN  56           1HG      GLN  56  -8.764   1.489   5.225
  430   HE21  GLN  56          1HE2      GLN  56 -10.264   0.468   7.606
  431   HE22  GLN  56          2HE2      GLN  56 -10.543   1.869   8.579
  432    H    GLY  57           H        GLY  57  -8.282  -0.170   3.147
  433    HA2  GLY  57           2HA      GLY  57  -8.592  -2.480   3.176
  434    HA3  GLY  57           1HA      GLY  57 -10.296  -2.225   2.827
  435    H    ASP  58           H        ASP  58  -7.379  -1.230   1.099
  436    HA   ASP  58           HA       ASP  58  -8.246  -2.810  -1.234
  437    HB2  ASP  58           2HB      ASP  58  -8.500  -0.162  -1.249
  438    HB3  ASP  58           1HB      ASP  58  -6.789  -0.250  -1.663
  439    H    LEU  59           H        LEU  59  -6.608  -3.606  -2.539
  440    HA   LEU  59           HA       LEU  59  -4.087  -3.994  -1.116
  441    HB2  LEU  59           2HB      LEU  59  -5.070  -6.034  -1.798
  442    HB3  LEU  59           1HB      LEU  59  -5.439  -5.418  -3.394
  443    HG   LEU  59           HG       LEU  59  -2.931  -5.333  -3.795
  444   HD11  LEU  59          1HD1      LEU  59  -2.277  -5.477  -1.422
  445   HD12  LEU  59          2HD1      LEU  59  -1.532  -6.731  -2.414
  446   HD13  LEU  59          3HD1      LEU  59  -2.899  -7.127  -1.373
  447   HD21  LEU  59          3HD2      LEU  59  -4.304  -7.975  -3.337
  448   HD22  LEU  59          1HD2      LEU  59  -2.816  -7.756  -4.257
  449   HD23  LEU  59          2HD2      LEU  59  -4.313  -7.014  -4.816
  450    H    ILE  60           H        ILE  60  -2.280  -3.000  -1.696
  451    HA   ILE  60           HA       ILE  60  -2.329  -1.220  -3.981
  452    HB   ILE  60           HB       ILE  60  -0.220  -1.684  -1.860
  453   HG12  ILE  60          2HG1      ILE  60  -0.850   0.790  -1.407
  454   HG13  ILE  60          1HG1      ILE  60  -2.300   0.439  -2.337
  455   HG21  ILE  60          1HG2      ILE  60   0.926   0.277  -2.790
  456   HG22  ILE  60          2HG2      ILE  60  -0.238   0.319  -4.116
  457   HG23  ILE  60          3HG2      ILE  60   0.857  -1.053  -3.944
  458   HD11  ILE  60          3HD1      ILE  60  -1.473  -1.136   0.078
  459   HD12  ILE  60          1HD1      ILE  60  -3.028  -1.157  -0.752
  460   HD13  ILE  60          2HD1      ILE  60  -2.527   0.278   0.147
  461    H    THR  61           H        THR  61  -1.570  -1.700  -5.904
  462    HA   THR  61           HA       THR  61   0.026  -4.130  -6.229
  463    HB   THR  61           HB       THR  61  -0.602  -4.035  -8.580
  464    HG1  THR  61           1HG      THR  61  -0.747  -1.922  -9.112
  465   HG21  THR  61          3HG2      THR  61  -3.002  -3.494  -6.821
  466   HG22  THR  61          1HG2      THR  61  -2.200  -5.055  -7.000
  467   HG23  THR  61          2HG2      THR  61  -3.017  -4.322  -8.380
  468    H    HIS  62           H        HIS  62   0.001  -0.683  -6.938
  469    HA   HIS  62           HA       HIS  62   2.898  -0.762  -7.378
  470    HB2  HIS  62           2HB      HIS  62   0.914   0.565  -9.240
  471    HB3  HIS  62           1HB      HIS  62   2.656   0.759  -9.328
  472    HD2  HIS  62           2HD      HIS  62   4.051  -1.382 -10.422
  473    HE1  HIS  62           1HE      HIS  62   0.591  -3.514 -11.586
  474    HE2  HIS  62           2HE      HIS  62   3.117  -3.428 -11.715
  475    H    VAL  63           H        VAL  63   3.925   1.299  -7.108
  476    HA   VAL  63           HA       VAL  63   2.266   3.452  -6.040
  477    HB   VAL  63           HB       VAL  63   3.050   2.252  -4.068
  478   HG11  VAL  63          1HG1      VAL  63   5.050   1.206  -5.015
  479   HG12  VAL  63          2HG1      VAL  63   5.411   2.062  -3.515
  480   HG13  VAL  63          3HG1      VAL  63   5.843   2.779  -5.067
  481   HG21  VAL  63          3HG2      VAL  63   4.380   4.162  -3.027
  482   HG22  VAL  63          1HG2      VAL  63   2.802   4.560  -3.713
  483   HG23  VAL  63          2HG2      VAL  63   4.273   4.939  -4.607
  484    H    ASN  64           H        ASN  64   2.658   5.149  -7.237
  485    HA   ASN  64           HA       ASN  64   3.684   6.698  -8.549
  486    HB2  ASN  64           2HB      ASN  64   5.513   6.103  -6.435
  487    HB3  ASN  64           1HB      ASN  64   6.429   6.377  -7.913
  488   HD21  ASN  64          1HD2      ASN  64   7.279   8.322  -7.290
  489   HD22  ASN  64          2HD2      ASN  64   6.325   9.752  -7.089
  490    H    GLY  65           H        GLY  65   3.383   3.982  -9.502
  491    HA2  GLY  65           2HA      GLY  65   3.892   2.864 -11.452
  492    HA3  GLY  65           1HA      GLY  65   5.012   4.160 -11.833
  493    H    GLU  66           H        GLU  66   4.923   1.996  -9.069
  494    HA   GLU  66           HA       GLU  66   7.269   0.586  -9.922
  495    HB2  GLU  66           2HB      GLU  66   7.495   2.832  -8.340
  496    HB3  GLU  66           1HB      GLU  66   7.482   1.525  -7.168
  497    HG2  GLU  66           2HG      GLU  66   9.754   2.063  -7.762
  498    HG3  GLU  66           1HG      GLU  66   9.344   0.454  -8.353
  499    HA   PRO  67           HA       PRO  67   4.462  -2.470  -8.161
  500    HB2  PRO  67           2HB      PRO  67   6.502  -4.414  -8.346
  501    HB3  PRO  67           1HB      PRO  67   5.182  -4.150  -9.488
  502    HG2  PRO  67           2HG      PRO  67   8.005  -3.269  -9.623
  503    HG3  PRO  67           1HG      PRO  67   6.865  -3.610 -10.936
  504    HD2  PRO  67           2HD      PRO  67   7.572  -1.101 -10.230
  505    HD3  PRO  67           1HD      PRO  67   5.981  -1.473 -10.887
  506    H    VAL  68           H        VAL  68   4.187  -3.036  -6.193
  507    HA   VAL  68           HA       VAL  68   6.198  -2.371  -4.194
  508    HB   VAL  68           HB       VAL  68   4.393  -2.614  -2.547
  509   HG11  VAL  68          1HG1      VAL  68   2.972  -0.733  -3.332
  510   HG12  VAL  68          2HG1      VAL  68   3.724  -0.876  -4.921
  511   HG13  VAL  68          3HG1      VAL  68   4.702  -0.439  -3.520
  512   HG21  VAL  68          3HG2      VAL  68   3.136  -4.383  -3.665
  513   HG22  VAL  68          1HG2      VAL  68   2.639  -3.242  -4.914
  514   HG23  VAL  68          2HG2      VAL  68   2.098  -3.018  -3.251
  515    H    HIS  69           H        HIS  69   5.197  -4.867  -5.924
  516    HA   HIS  69           HA       HIS  69   4.991  -7.077  -4.329
  517    HB2  HIS  69           2HB      HIS  69   5.919  -6.540  -7.129
  518    HB3  HIS  69           1HB      HIS  69   5.826  -8.143  -6.485
  519    HD2  HIS  69           2HD      HIS  69   3.017  -5.620  -5.644
  520    HE1  HIS  69           1HE      HIS  69   1.516  -8.493  -8.369
  521    HE2  HIS  69           2HE      HIS  69   0.902  -6.666  -6.723
  522    H    GLY  70           H        GLY  70   6.519  -7.164  -2.661
  523    HA2  GLY  70           2HA      GLY  70   8.531  -8.499  -2.207
  524    HA3  GLY  70           1HA      GLY  70   9.280  -7.695  -3.579
  525    H    LEU  71           H        LEU  71   7.655  -5.259  -2.321
  526    HA   LEU  71           HA       LEU  71   9.967  -4.172  -0.992
  527    HB2  LEU  71           2HB      LEU  71   7.181  -3.044  -1.347
  528    HB3  LEU  71           1HB      LEU  71   8.532  -2.169  -0.661
  529    HG   LEU  71           HG       LEU  71   8.171  -3.058  -3.514
  530   HD11  LEU  71          1HD1      LEU  71   8.716  -0.335  -2.341
  531   HD12  LEU  71          2HD1      LEU  71   7.106  -0.943  -2.720
  532   HD13  LEU  71          3HD1      LEU  71   8.288  -0.720  -4.009
  533   HD21  LEU  71          3HD2      LEU  71  10.461  -3.546  -2.977
  534   HD22  LEU  71          1HD2      LEU  71  10.652  -1.988  -2.172
  535   HD23  LEU  71          2HD2      LEU  71  10.413  -2.055  -3.917
  536    H    VAL  72           H        VAL  72  10.246  -3.820   1.164
  537    HA   VAL  72           HA       VAL  72   8.568  -5.338   2.957
  538    HB   VAL  72           HB       VAL  72  11.188  -4.937   3.002
  539   HG11  VAL  72          1HG1      VAL  72  10.923  -2.473   3.318
  540   HG12  VAL  72          2HG1      VAL  72  11.942  -3.270   4.516
  541   HG13  VAL  72          3HG1      VAL  72  10.291  -2.809   4.930
  542   HG21  VAL  72          3HG2      VAL  72  11.254  -5.809   5.165
  543   HG22  VAL  72          1HG2      VAL  72   9.702  -6.341   4.519
  544   HG23  VAL  72          2HG2      VAL  72   9.771  -4.983   5.642
  545    H    HIS  73           H        HIS  73   7.985  -4.240   5.113
  546    HA   HIS  73           HA       HIS  73   5.905  -2.537   4.937
  547    HB2  HIS  73           2HB      HIS  73   7.063  -3.733   6.986
  548    HB3  HIS  73           1HB      HIS  73   7.770  -2.150   7.239
  549    HD1  HIS  73           1HD      HIS  73   4.874  -4.073   8.157
  550    HD2  HIS  73           2HD      HIS  73   5.669  -0.068   7.413
  551    HE1  HIS  73           1HE      HIS  73   2.988  -2.770   9.216
  552    H    THR  74           H        THR  74   9.231  -1.523   5.518
  553    HA   THR  74           HA       THR  74   8.513   1.250   5.581
  554    HB   THR  74           HB       THR  74  10.824   1.625   6.126
  555    HG1  THR  74           1HG      THR  74  12.302  -0.178   6.020
  556   HG21  THR  74          3HG2      THR  74   9.478   0.731   7.928
  557   HG22  THR  74          1HG2      THR  74  11.087   0.011   8.011
  558   HG23  THR  74          2HG2      THR  74   9.736  -0.917   7.348
  559    H    GLU  75           H        GLU  75   9.558  -0.938   3.114
  560    HA   GLU  75           HA       GLU  75  10.903   0.946   1.492
  561    HB2  GLU  75           2HB      GLU  75   9.808  -1.787   1.076
  562    HB3  GLU  75           1HB      GLU  75  10.254  -0.826  -0.321
  563    HG2  GLU  75           2HG      GLU  75  12.512  -0.561   0.560
  564    HG3  GLU  75           1HG      GLU  75  12.074  -1.522   1.968
  565    H    VAL  76           H        VAL  76   7.525  -0.159   1.607
  566    HA   VAL  76           HA       VAL  76   6.719   1.312  -0.682
  567    HB   VAL  76           HB       VAL  76   4.399   1.188   0.336
  568   HG11  VAL  76          1HG1      VAL  76   5.929  -1.366  -0.052
  569   HG12  VAL  76          2HG1      VAL  76   5.232  -0.364  -1.324
  570   HG13  VAL  76          3HG1      VAL  76   4.179  -1.176  -0.168
  571   HG21  VAL  76          3HG2      VAL  76   5.934   0.217   2.604
  572   HG22  VAL  76          1HG2      VAL  76   4.649  -0.892   2.121
  573   HG23  VAL  76          2HG2      VAL  76   4.257   0.786   2.529
  574    H    VAL  77           H        VAL  77   6.588   2.003   2.772
  575    HA   VAL  77           HA       VAL  77   5.522   4.535   2.760
  576    HB   VAL  77           HB       VAL  77   7.715   3.511   4.538
  577   HG11  VAL  77          1HG1      VAL  77   7.459   5.902   4.760
  578   HG12  VAL  77          2HG1      VAL  77   6.839   5.091   6.199
  579   HG13  VAL  77          3HG1      VAL  77   5.721   5.713   4.985
  580   HG21  VAL  77          3HG2      VAL  77   6.132   1.943   4.954
  581   HG22  VAL  77          1HG2      VAL  77   4.803   2.988   4.450
  582   HG23  VAL  77          2HG2      VAL  77   5.542   3.203   6.037
  583    H    GLU  78           H        GLU  78   8.902   3.557   2.402
  584    HA   GLU  78           HA       GLU  78   9.988   6.141   2.203
  585    HB2  GLU  78           2HB      GLU  78  10.936   3.434   1.323
  586    HB3  GLU  78           1HB      GLU  78  11.857   4.884   0.946
  587    HG2  GLU  78           2HG      GLU  78  11.777   5.409   3.411
  588    HG3  GLU  78           1HG      GLU  78  11.167   3.773   3.638
  589    H    LEU  79           H        LEU  79   8.920   3.859  -0.294
  590    HA   LEU  79           HA       LEU  79   9.576   5.306  -2.562
  591    HB2  LEU  79           2HB      LEU  79   8.048   3.038  -1.975
  592    HB3  LEU  79           1HB      LEU  79   6.940   4.113  -2.804
  593    HG   LEU  79           HG       LEU  79   7.938   2.618  -4.405
  594   HD11  LEU  79          1HD1      LEU  79   7.516   4.891  -5.171
  595   HD12  LEU  79          2HD1      LEU  79   8.934   4.207  -5.966
  596   HD13  LEU  79          3HD1      LEU  79   9.133   5.373  -4.659
  597   HD21  LEU  79          3HD2      LEU  79  10.570   3.619  -3.341
  598   HD22  LEU  79          1HD2      LEU  79  10.382   2.660  -4.808
  599   HD23  LEU  79          2HD2      LEU  79   9.933   1.978  -3.246
  600    H    ILE  80           H        ILE  80   6.755   5.582  -0.474
  601    HA   ILE  80           HA       ILE  80   5.407   7.542  -2.002
  602    HB   ILE  80           HB       ILE  80   5.189   6.622   0.855
  603   HG12  ILE  80          2HG1      ILE  80   3.012   6.399  -1.163
  604   HG13  ILE  80          1HG1      ILE  80   4.426   5.375  -1.384
  605   HG21  ILE  80          1HG2      ILE  80   3.696   8.796  -0.557
  606   HG22  ILE  80          2HG2      ILE  80   4.465   8.833   1.029
  607   HG23  ILE  80          3HG2      ILE  80   2.986   7.905   0.787
  608   HD11  ILE  80          3HD1      ILE  80   2.624   4.268  -0.152
  609   HD12  ILE  80          1HD1      ILE  80   2.755   5.494   1.106
  610   HD13  ILE  80          2HD1      ILE  80   4.106   4.405   0.794
  611    H    LEU  81           H        LEU  81   7.393   7.769   0.958
  612    HA   LEU  81           HA       LEU  81   7.305  10.557   1.224
  613    HB2  LEU  81           2HB      LEU  81   9.529   8.661   1.993
  614    HB3  LEU  81           1HB      LEU  81   9.356  10.307   2.572
  615    HG   LEU  81           HG       LEU  81   7.309   8.150   3.072
  616   HD11  LEU  81          1HD1      LEU  81   9.300   7.435   4.163
  617   HD12  LEU  81          2HD1      LEU  81   8.257   8.153   5.389
  618   HD13  LEU  81          3HD1      LEU  81   9.630   9.061   4.756
  619   HD21  LEU  81          3HD2      LEU  81   7.737  10.908   4.206
  620   HD22  LEU  81          1HD2      LEU  81   6.606   9.725   4.865
  621   HD23  LEU  81          2HD2      LEU  81   6.376  10.350   3.233
  622    H    LYS  82           H        LYS  82   9.445   8.462  -0.590
  623    HA   LYS  82           HA       LYS  82  11.350  10.291  -1.471
  624    HB2  LYS  82           2HB      LYS  82  11.265   7.744  -1.630
  625    HB3  LYS  82           1HB      LYS  82  10.376   8.034  -3.095
  626    HG2  LYS  82           2HG      LYS  82  12.414   9.575  -3.672
  627    HG3  LYS  82           1HG      LYS  82  13.231   8.521  -2.517
  628    HD2  LYS  82           2HD      LYS  82  11.620   7.467  -4.825
  629    HD3  LYS  82           1HD      LYS  82  13.344   7.823  -4.951
  630    HE2  LYS  82           2HE      LYS  82  13.680   6.287  -2.980
  631    HE3  LYS  82           1HE      LYS  82  11.991   5.814  -3.162
  632    HZ1  LYS  82           3HZ      LYS  82  14.112   5.516  -5.220
  633    HZ2  LYS  82           1HZ      LYS  82  12.494   5.075  -5.415
  634    HZ3  LYS  82           2HZ      LYS  82  13.459   4.268  -4.288
  635    H    SER  83           H        SER  83   8.227   9.417  -2.756
  636    HA   SER  83           HA       SER  83   8.343  10.570  -5.259
  637    HB2  SER  83           2HB      SER  83   6.466   9.201  -4.543
  638    HB3  SER  83           1HB      SER  83   5.985  10.426  -3.368
  639    HG   SER  83           HG       SER  83   4.867  11.272  -4.908
  640    H    GLY  84           H        GLY  84   7.385  12.149  -2.193
  641    HA2  GLY  84           2HA      GLY  84   8.495  14.474  -2.173
  642    HA3  GLY  84           1HA      GLY  84   7.518  14.732  -3.604
  643    H    ASN  85           H        ASN  85   5.848  15.957  -3.179
  644    HA   ASN  85           HA       ASN  85   4.680  15.988  -0.505
  645    HB2  ASN  85           2HB      ASN  85   3.474  17.984  -1.284
  646    HB3  ASN  85           1HB      ASN  85   5.211  18.144  -1.503
  647   HD21  ASN  85          1HD2      ASN  85   6.049  18.305  -3.546
  648   HD22  ASN  85          2HD2      ASN  85   5.067  18.471  -4.962
  649    H    LYS  86           H        LYS  86   4.288  14.119  -3.005
  650    HA   LYS  86           HA       LYS  86   1.595  13.391  -2.360
  651    HB2  LYS  86           2HB      LYS  86   0.834  13.552  -4.688
  652    HB3  LYS  86           1HB      LYS  86   1.110  15.110  -3.970
  653    HG2  LYS  86           2HG      LYS  86   3.132  15.401  -5.196
  654    HG3  LYS  86           1HG      LYS  86   3.105  13.722  -5.733
  655    HD2  LYS  86           2HD      LYS  86   1.002  14.195  -6.956
  656    HD3  LYS  86           1HD      LYS  86   1.158  15.889  -6.498
  657    HE2  LYS  86           2HE      LYS  86   2.002  15.672  -8.708
  658    HE3  LYS  86           1HE      LYS  86   3.388  15.900  -7.641
  659    HZ1  LYS  86           3HZ      LYS  86   2.457  13.353  -8.849
  660    HZ2  LYS  86           1HZ      LYS  86   3.660  13.443  -7.663
  661    HZ3  LYS  86           2HZ      LYS  86   3.902  14.170  -9.166
  662    H    VAL  87           H        VAL  87   0.945  11.627  -4.064
  663    HA   VAL  87           HA       VAL  87   3.059  10.129  -5.265
  664    HB   VAL  87           HB       VAL  87   3.585   9.711  -2.890
  665   HG11  VAL  87          1HG1      VAL  87   0.900   8.352  -2.849
  666   HG12  VAL  87          2HG1      VAL  87   1.406   9.745  -1.892
  667   HG13  VAL  87          3HG1      VAL  87   2.136   8.168  -1.606
  668   HG21  VAL  87          3HG2      VAL  87   2.826   7.443  -4.682
  669   HG22  VAL  87          1HG2      VAL  87   3.566   7.159  -3.105
  670   HG23  VAL  87          2HG2      VAL  87   4.427   8.097  -4.325
  671    H    ALA  88           H        ALA  88   2.378   8.456  -6.511
  672    HA   ALA  88           HA       ALA  88  -0.515   8.228  -6.913
  673    HB1  ALA  88           1HB      ALA  88   0.752   8.742  -8.882
  674    HB2  ALA  88           2HB      ALA  88   0.111   7.104  -9.026
  675    HB3  ALA  88           3HB      ALA  88   1.806   7.355  -8.612
  676    H    ILE  89           H        ILE  89  -1.112   6.839  -5.242
  677    HA   ILE  89           HA       ILE  89   0.184   4.238  -5.057
  678    HB   ILE  89           HB       ILE  89  -0.341   5.115  -2.933
  679   HG12  ILE  89          2HG1      ILE  89  -2.653   3.257  -3.414
  680   HG13  ILE  89          1HG1      ILE  89  -0.987   2.691  -3.421
  681   HG21  ILE  89          1HG2      ILE  89  -1.936   6.814  -3.619
  682   HG22  ILE  89          2HG2      ILE  89  -2.548   5.875  -2.258
  683   HG23  ILE  89          3HG2      ILE  89  -3.157   5.569  -3.884
  684   HD11  ILE  89          3HD1      ILE  89  -2.217   2.413  -1.263
  685   HD12  ILE  89          1HD1      ILE  89  -2.218   4.169  -1.118
  686   HD13  ILE  89          2HD1      ILE  89  -0.690   3.289  -1.150
  687    H    SER  90           H        SER  90  -0.408   2.620  -6.350
  688    HA   SER  90           HA       SER  90  -3.033   2.728  -7.632
  689    HB2  SER  90           2HB      SER  90  -0.772   2.350  -8.846
  690    HB3  SER  90           1HB      SER  90  -0.895   0.706  -8.224
  691    HG   SER  90           HG       SER  90  -2.993   0.636  -9.248
  692    H    THR  91           H        THR  91  -4.662   1.687  -6.719
  693    HA   THR  91           HA       THR  91  -4.092  -0.759  -5.186
  694    HB   THR  91           HB       THR  91  -6.243  -0.386  -4.060
  695    HG1  THR  91           1HG      THR  91  -7.631   0.983  -4.847
  696   HG21  THR  91          3HG2      THR  91  -4.469   2.053  -4.015
  697   HG22  THR  91          1HG2      THR  91  -4.215   0.571  -3.090
  698   HG23  THR  91          2HG2      THR  91  -5.622   1.584  -2.763
  699    H    THR  92           H        THR  92  -6.183  -2.268  -5.216
  700    HA   THR  92           HA       THR  92  -6.713  -2.651  -8.088
  701    HB   THR  92           HB       THR  92  -5.628  -4.562  -7.207
  702    HG1  THR  92           1HG      THR  92  -8.425  -4.938  -7.544
  703   HG21  THR  92          3HG2      THR  92  -7.750  -4.720  -5.069
  704   HG22  THR  92          1HG2      THR  92  -6.098  -4.157  -4.820
  705   HG23  THR  92          2HG2      THR  92  -6.398  -5.828  -5.295
  706    HA   PRO  93           HA       PRO  93 -10.896  -1.119  -7.144
  707    HB2  PRO  93           2HB      PRO  93 -11.083  -1.889 -10.015
  708    HB3  PRO  93           1HB      PRO  93 -11.658  -0.428  -9.205
  709    HG2  PRO  93           2HG      PRO  93  -9.455  -0.374 -10.687
  710    HG3  PRO  93           1HG      PRO  93  -9.538   0.525  -9.167
  711    HD2  PRO  93           2HD      PRO  93  -8.121  -1.994  -9.789
  712    HD3  PRO  93           1HD      PRO  93  -7.662  -0.694  -8.686
  713    H    LEU  94           H        LEU  94 -13.086  -2.045  -7.831
  714    HA   LEU  94           HA       LEU  94 -13.337  -4.641  -6.804
  715    HB2  LEU  94           2HB      LEU  94 -15.637  -4.063  -8.335
  716    HB3  LEU  94           1HB      LEU  94 -15.445  -3.955  -6.610
  717    HG   LEU  94           HG       LEU  94 -14.512  -1.600  -7.055
  718   HD11  LEU  94          1HD1      LEU  94 -14.164  -1.600  -9.348
  719   HD12  LEU  94          2HD1      LEU  94 -15.651  -0.671  -9.146
  720   HD13  LEU  94          3HD1      LEU  94 -15.723  -2.353  -9.672
  721   HD21  LEU  94          3HD2      LEU  94 -16.711  -2.167  -6.025
  722   HD22  LEU  94          1HD2      LEU  94 -17.424  -2.116  -7.636
  723   HD23  LEU  94          2HD2      LEU  94 -16.711  -0.662  -6.940
  724    H    GLU  95           H        GLU  95 -14.205  -6.519  -7.827
  725    HA   GLU  95           HA       GLU  95 -14.145  -6.768 -10.683
  726    HB2  GLU  95           2HB      GLU  95 -12.344  -8.306 -10.889
  727    HB3  GLU  95           1HB      GLU  95 -11.714  -6.943  -9.980
  728    HG2  GLU  95           2HG      GLU  95 -12.770  -9.357  -8.571
  729    HG3  GLU  95           1HG      GLU  95 -11.141  -9.345  -9.233
  730    H    ASN  96           H        ASN  96 -14.799  -8.937 -11.357
  731    HA   ASN  96           HA       ASN  96 -16.766 -10.002  -9.555
  732    HB2  ASN  96           2HB      ASN  96 -17.379 -11.500 -11.396
  733    HB3  ASN  96           1HB      ASN  96 -17.252  -9.843 -11.970
  734   HD21  ASN  96          1HD2      ASN  96 -15.658  -9.296 -13.414
  735   HD22  ASN  96          2HD2      ASN  96 -14.675 -10.475 -14.215
  736    H1   SER 101           1HT      SER 101  -1.757 -18.417   1.653
  737    H2   SER 101           2HT      SER 101  -2.799 -18.209   2.966
  738    H3   SER 101           3HT      SER 101  -1.134 -18.358   3.232
  739    HA   SER 101           HA       SER 101  -0.707 -16.293   2.165
  740    HB2  SER 101           2HB      SER 101  -3.696 -16.278   1.693
  741    HB3  SER 101           1HB      SER 101  -2.641 -14.888   1.424
  742    HG   SER 101           HG       SER 101  -3.084 -17.044  -0.154
  743    H    TRP 102           H        TRP 102  -0.459 -14.574   3.525
  744    HA   TRP 102           HA       TRP 102  -0.539 -13.326   5.407
  745    HB2  TRP 102           2HB      TRP 102  -3.059 -13.244   4.701
  746    HB3  TRP 102           1HB      TRP 102  -3.294 -14.342   6.056
  747    HD1  TRP 102           HD       TRP 102  -1.505 -13.105   8.257
  748    HE1  TRP 102           1HE      TRP 102  -2.010 -10.795   9.258
  749    HE3  TRP 102           3HE      TRP 102  -4.350 -11.184   4.464
  750    HZ2  TRP 102           2HZ      TRP 102  -3.421  -8.468   8.538
  751    HZ3  TRP 102           3HZ      TRP 102  -5.241  -8.900   4.713
  752    HH2  TRP 102           HH       TRP 102  -4.783  -7.577   6.702
  753    H    GLU 103           H        GLU 103   0.774 -15.612   5.534
  754    HA   GLU 103           HA       GLU 103  -0.046 -17.316   7.666
  755    HB2  GLU 103           2HB      GLU 103   2.380 -17.025   5.961
  756    HB3  GLU 103           1HB      GLU 103   2.531 -17.927   7.462
  757    HG2  GLU 103           2HG      GLU 103   2.092 -19.432   5.639
  758    HG3  GLU 103           1HG      GLU 103   0.715 -19.412   6.735
  759    H    SER 104           H        SER 104   1.637 -14.312   7.502
  760    HA   SER 104           HA       SER 104   1.670 -14.031  10.321
  761    HB2  SER 104           2HB      SER 104   4.133 -13.888  10.610
  762    HB3  SER 104           1HB      SER 104   3.590 -15.513  10.194
  763    HG   SER 104           HG       SER 104   4.927 -15.385   8.589
  764    H    HIS 105           H        HIS 105   3.107 -12.060  10.934
  765    HA   HIS 105           HA       HIS 105   2.740  -9.966   8.892
  766    HB2  HIS 105           2HB      HIS 105   2.030 -10.132  11.706
  767    HB3  HIS 105           1HB      HIS 105   3.067  -8.747  11.393
  768    HD2  HIS 105           2HD      HIS 105  -0.335 -10.167   9.998
  769    HE1  HIS 105           1HE      HIS 105  -0.283  -5.950   9.714
  770    HE2  HIS 105           2HE      HIS 105  -1.731  -8.021   9.607
  771    H    LYS 106           H        LYS 106   5.015 -11.771   9.284
  772    HA   LYS 106           HA       LYS 106   7.122 -10.328  10.568
  773    HB2  LYS 106           2HB      LYS 106   7.182 -12.726   8.733
  774    HB3  LYS 106           1HB      LYS 106   8.566 -12.113   9.626
  775    HG2  LYS 106           2HG      LYS 106   7.496 -12.598  11.726
  776    HG3  LYS 106           1HG      LYS 106   6.017 -13.078  10.898
  777    HD2  LYS 106           2HD      LYS 106   7.175 -15.066  11.524
  778    HD3  LYS 106           1HD      LYS 106   7.330 -14.887   9.775
  779    HE2  LYS 106           2HE      LYS 106   9.571 -14.136   9.961
  780    HE3  LYS 106           1HE      LYS 106   9.427 -13.925  11.705
  781    HZ1  LYS 106           3HZ      LYS 106   9.319 -16.532  10.285
  782    HZ2  LYS 106           1HZ      LYS 106   9.232 -16.304  11.959
  783    HZ3  LYS 106           2HZ      LYS 106  10.657 -15.932  11.128
  784    H    SER 107           H        SER 107   5.825  -8.794   8.500
  785    HA   SER 107           HA       SER 107   8.048  -8.461   6.598
  786    HB2  SER 107           2HB      SER 107   5.220  -7.447   6.260
  787    HB3  SER 107           1HB      SER 107   6.487  -7.515   5.037
  788    HG   SER 107           HG       SER 107   5.073  -9.236   4.747
  789    H    GLY 108           H        GLY 108   7.092  -7.357   9.428
  790    HA2  GLY 108           2HA      GLY 108   8.554  -5.229   9.869
  791    HA3  GLY 108           1HA      GLY 108   7.310  -4.489   8.871
  792    H    GLY 109           H        GLY 109   6.907  -3.165  10.792
  793    HA2  GLY 109           2HA      GLY 109   5.310  -4.624  12.799
  794    HA3  GLY 109           1HA      GLY 109   6.195  -3.144  13.135
  795    H    GLU 110           H        GLU 110   5.348  -1.174  12.511
  796    HA   GLU 110           HA       GLU 110   2.876  -1.024  11.021
  797    HB2  GLU 110           2HB      GLU 110   2.498  -1.532  13.621
  798    HB3  GLU 110           1HB      GLU 110   2.720   0.208  13.733
  799    HG2  GLU 110           2HG      GLU 110   0.735  -1.080  11.886
  800    HG3  GLU 110           1HG      GLU 110   0.350  -0.598  13.535
  801    H    THR 111           H        THR 111   3.830   0.399   9.628
  802    HA   THR 111           HA       THR 111   4.628   2.996  10.761
  803    HB   THR 111           HB       THR 111   5.852   1.875   8.244
  804    HG1  THR 111           1HG      THR 111   6.210   0.675  10.405
  805   HG21  THR 111          3HG2      THR 111   7.650   3.494   8.836
  806   HG22  THR 111          1HG2      THR 111   6.650   4.054  10.175
  807   HG23  THR 111          2HG2      THR 111   6.093   4.257   8.513
  808    H    ARG 112           H        ARG 112   2.377   3.532  10.382
  809    HA   ARG 112           HA       ARG 112   1.248   3.503   7.789
  810    HB2  ARG 112           2HB      ARG 112  -0.438   5.066   8.764
  811    HB3  ARG 112           1HB      ARG 112  -0.208   3.594   9.695
  812    HG2  ARG 112           2HG      ARG 112   1.529   5.188  10.966
  813    HG3  ARG 112           1HG      ARG 112   0.376   6.398  10.396
  814    HD2  ARG 112           2HD      ARG 112  -1.446   5.018  11.391
  815    HD3  ARG 112           1HD      ARG 112  -0.208   3.971  12.083
  816    HE   ARG 112           HE       ARG 112  -0.500   6.836  12.738
  817   HH11  ARG 112          1HH1      ARG 112   0.265   3.526  13.663
  818   HH12  ARG 112          2HH1      ARG 112   0.560   3.942  15.325
  819   HH21  ARG 112          1HH2      ARG 112  -0.106   7.360  14.922
  820   HH22  ARG 112          2HH2      ARG 112   0.350   6.114  16.040
  821    H    LEU 113           H        LEU 113   0.589   5.509   6.597
  822    HA   LEU 113           HA       LEU 113   2.952   7.182   6.265
  823    HB2  LEU 113           2HB      LEU 113   0.560   6.527   4.595
  824    HB3  LEU 113           1HB      LEU 113   1.429   8.010   4.272
  825    HG   LEU 113           HG       LEU 113   2.170   6.242   2.776
  826   HD11  LEU 113          1HD1      LEU 113   3.813   7.879   3.357
  827   HD12  LEU 113          2HD1      LEU 113   4.582   6.295   3.265
  828   HD13  LEU 113          3HD1      LEU 113   4.218   7.009   4.835
  829   HD21  LEU 113          3HD2      LEU 113   1.643   4.356   4.293
  830   HD22  LEU 113          1HD2      LEU 113   3.085   4.754   5.226
  831   HD23  LEU 113          2HD2      LEU 113   3.236   4.242   3.545
  Start of MODEL   10
    1    H1   GLY   1           1HT      GLY   1  -9.876 -11.779 -12.178
    2    H2   GLY   1           2HT      GLY   1  -9.335 -11.205 -13.672
    3    H3   GLY   1           3HT      GLY   1 -10.894 -10.830 -13.139
    4    HA2  GLY   1           1HA      GLY   1  -9.895  -9.612 -11.242
    5    HA3  GLY   1           2HA      GLY   1  -8.332  -9.880 -11.999
    6    H    GLY   2           H        GLY   2  -7.634  -8.122 -13.009
    7    HA2  GLY   2           2HA      GLY   2  -9.187  -6.856 -15.041
    8    HA3  GLY   2           1HA      GLY   2  -9.077  -5.855 -13.600
    9    H    SER   3           H        SER   3  -8.020  -4.473 -15.342
   10    HA   SER   3           HA       SER   3  -5.142  -4.776 -15.041
   11    HB2  SER   3           2HB      SER   3  -6.461  -4.457 -17.750
   12    HB3  SER   3           1HB      SER   3  -4.727  -4.386 -17.444
   13    HG   SER   3           HG       SER   3  -5.813  -6.632 -16.394
   14    H    MET   4           H        MET   4  -3.973  -2.802 -15.546
   15    HA   MET   4           HA       MET   4  -3.605  -0.571 -15.414
   16    HB2  MET   4           2HB      MET   4  -6.299  -0.542 -16.757
   17    HB3  MET   4           1HB      MET   4  -5.466   0.946 -16.340
   18    HG2  MET   4           2HG      MET   4  -3.645   0.428 -17.778
   19    HG3  MET   4           1HG      MET   4  -4.256  -1.203 -18.049
   20    HE1  MET   4           3HE      MET   4  -6.474   2.026 -17.862
   21    HE2  MET   4           1HE      MET   4  -6.457   2.570 -19.541
   22    HE3  MET   4           2HE      MET   4  -4.980   2.629 -18.580
   23    H    ARG   5           H        ARG   5  -3.594  -0.853 -13.121
   24    HA   ARG   5           HA       ARG   5  -5.936  -0.351 -11.569
   25    HB2  ARG   5           2HB      ARG   5  -3.002  -0.486 -10.876
   26    HB3  ARG   5           1HB      ARG   5  -4.241  -0.143  -9.679
   27    HG2  ARG   5           2HG      ARG   5  -3.939  -2.409  -9.428
   28    HG3  ARG   5           1HG      ARG   5  -5.317  -2.345 -10.526
   29    HD2  ARG   5           2HD      ARG   5  -3.892  -2.775 -12.419
   30    HD3  ARG   5           1HD      ARG   5  -2.452  -2.668 -11.407
   31    HE   ARG   5           HE       ARG   5  -4.233  -4.675 -10.470
   32   HH11  ARG   5          1HH1      ARG   5  -1.881  -4.027 -12.982
   33   HH12  ARG   5          2HH1      ARG   5  -1.405  -5.684 -13.137
   34   HH21  ARG   5          1HH2      ARG   5  -3.621  -6.852 -10.676
   35   HH22  ARG   5          2HH2      ARG   5  -2.383  -7.300 -11.810
   36    HA   PRO   6           HA       PRO   6  -5.583   4.092 -11.769
   37    HB2  PRO   6           2HB      PRO   6  -7.653   4.410  -9.829
   38    HB3  PRO   6           1HB      PRO   6  -7.815   4.439 -11.587
   39    HG2  PRO   6           2HG      PRO   6  -8.884   2.478  -9.960
   40    HG3  PRO   6           1HG      PRO   6  -8.521   2.266 -11.672
   41    HD2  PRO   6           2HD      PRO   6  -6.904   1.506  -9.271
   42    HD3  PRO   6           1HD      PRO   6  -7.271   0.568 -10.731
   43    HA   PRO   7           HA       PRO   7  -3.125   4.673  -7.978
   44    HB2  PRO   7           2HB      PRO   7  -1.973   6.914  -9.414
   45    HB3  PRO   7           1HB      PRO   7  -1.184   5.482  -8.764
   46    HG2  PRO   7           2HG      PRO   7  -1.471   5.909 -11.416
   47    HG3  PRO   7           1HG      PRO   7  -1.489   4.282 -10.711
   48    HD2  PRO   7           2HD      PRO   7  -3.798   5.986 -11.594
   49    HD3  PRO   7           1HD      PRO   7  -3.544   4.239 -11.805
   50    H    ILE   8           H        ILE   8  -4.050   5.677  -6.381
   51    HA   ILE   8           HA       ILE   8  -5.563   8.087  -6.748
   52    HB   ILE   8           HB       ILE   8  -4.870   6.951  -4.074
   53   HG12  ILE   8          2HG1      ILE   8  -7.251   5.865  -5.314
   54   HG13  ILE   8          1HG1      ILE   8  -5.809   5.395  -6.140
   55   HG21  ILE   8          1HG2      ILE   8  -6.251   9.033  -4.451
   56   HG22  ILE   8          2HG2      ILE   8  -7.018   7.764  -3.494
   57   HG23  ILE   8          3HG2      ILE   8  -7.449   7.970  -5.189
   58   HD11  ILE   8          3HD1      ILE   8  -6.289   5.007  -3.213
   59   HD12  ILE   8          1HD1      ILE   8  -4.898   4.432  -4.130
   60   HD13  ILE   8          2HD1      ILE   8  -6.502   3.763  -4.445
   61    H    ILE   9           H        ILE   9  -4.463   9.933  -6.933
   62    HA   ILE   9           HA       ILE   9  -1.807  10.207  -5.901
   63    HB   ILE   9           HB       ILE   9  -3.407  12.549  -6.845
   64   HG12  ILE   9          2HG1      ILE   9  -3.846  10.699  -8.458
   65   HG13  ILE   9          1HG1      ILE   9  -2.954  12.041  -9.166
   66   HG21  ILE   9          1HG2      ILE   9  -1.184  12.980  -6.034
   67   HG22  ILE   9          2HG2      ILE   9  -1.206  13.205  -7.786
   68   HG23  ILE   9          3HG2      ILE   9  -0.514  11.735  -7.090
   69   HD11  ILE   9          3HD1      ILE   9  -2.098   9.890  -9.910
   70   HD12  ILE   9          1HD1      ILE   9  -1.770   9.437  -8.238
   71   HD13  ILE   9          2HD1      ILE   9  -0.889  10.773  -8.978
   72    H    ILE  10           H        ILE  10  -1.721  10.208  -3.692
   73    HA   ILE  10           HA       ILE  10  -3.584  11.743  -2.115
   74    HB   ILE  10           HB       ILE  10  -0.886  10.677  -1.212
   75   HG12  ILE  10          2HG1      ILE  10  -3.297   9.246  -0.357
   76   HG13  ILE  10          1HG1      ILE  10  -2.903   9.055  -2.037
   77   HG21  ILE  10          1HG2      ILE  10  -2.274  10.608   1.002
   78   HG22  ILE  10          2HG2      ILE  10  -3.251  11.828   0.183
   79   HG23  ILE  10          3HG2      ILE  10  -1.533  12.113   0.459
   80   HD11  ILE  10          3HD1      ILE  10  -0.568   8.465  -1.256
   81   HD12  ILE  10          1HD1      ILE  10  -1.855   7.287  -0.996
   82   HD13  ILE  10          2HD1      ILE  10  -1.308   8.300   0.336
   83    H    HIS  11           H        HIS  11  -2.755  13.534  -0.706
   84    HA   HIS  11           HA       HIS  11  -0.465  14.949  -1.806
   85    HB2  HIS  11           2HB      HIS  11  -2.586  15.766  -2.941
   86    HB3  HIS  11           1HB      HIS  11  -3.137  16.317  -1.363
   87    HD2  HIS  11           2HD      HIS  11   0.019  17.019  -3.639
   88    HE1  HIS  11           1HE      HIS  11  -1.120  20.517  -1.550
   89    HE2  HIS  11           2HE      HIS  11   0.357  19.579  -3.383
   90    H    ARG  12           H        ARG  12   0.773  15.024  -0.078
   91    HA   ARG  12           HA       ARG  12  -0.118  14.830   2.577
   92    HB2  ARG  12           2HB      ARG  12   2.134  14.211   1.772
   93    HB3  ARG  12           1HB      ARG  12   2.493  15.911   1.522
   94    HG2  ARG  12           2HG      ARG  12   2.285  16.330   3.895
   95    HG3  ARG  12           1HG      ARG  12   1.850  14.640   4.170
   96    HD2  ARG  12           2HD      ARG  12   3.990  13.916   3.346
   97    HD3  ARG  12           1HD      ARG  12   4.430  15.567   2.937
   98    HE   ARG  12           HE       ARG  12   4.111  14.530   5.679
   99   HH11  ARG  12          1HH1      ARG  12   5.415  16.864   3.418
  100   HH12  ARG  12          2HH1      ARG  12   6.428  17.630   4.597
  101   HH21  ARG  12          1HH2      ARG  12   5.457  15.548   7.242
  102   HH22  ARG  12          2HH2      ARG  12   6.464  16.879   6.760
  103    H    ALA  13           H        ALA  13  -1.332  16.298   3.537
  104    HA   ALA  13           HA       ALA  13  -1.178  19.104   2.898
  105    HB1  ALA  13           1HB      ALA  13  -3.039  19.366   4.386
  106    HB2  ALA  13           2HB      ALA  13  -2.768  17.768   5.085
  107    HB3  ALA  13           3HB      ALA  13  -3.312  17.918   3.415
  108    H    GLY  14           H        GLY  14   1.278  18.354   3.776
  109    HA2  GLY  14           2HA      GLY  14   2.907  19.203   5.173
  110    HA3  GLY  14           1HA      GLY  14   1.652  20.068   6.044
  111    H    LYS  15           H        LYS  15   0.654  16.953   5.944
  112    HA   LYS  15           HA       LYS  15   2.009  16.311   8.472
  113    HB2  LYS  15           2HB      LYS  15  -0.233  14.932   8.812
  114    HB3  LYS  15           1HB      LYS  15  -0.092  16.612   9.295
  115    HG2  LYS  15           2HG      LYS  15  -1.317  17.359   7.417
  116    HG3  LYS  15           1HG      LYS  15  -1.191  15.790   6.623
  117    HD2  LYS  15           2HD      LYS  15  -3.415  16.041   7.524
  118    HD3  LYS  15           1HD      LYS  15  -2.553  14.804   8.441
  119    HE2  LYS  15           2HE      LYS  15  -2.033  16.514  10.160
  120    HE3  LYS  15           1HE      LYS  15  -3.021  17.668   9.265
  121    HZ1  LYS  15           3HZ      LYS  15  -4.943  16.264   9.611
  122    HZ2  LYS  15           1HZ      LYS  15  -4.230  16.629  11.100
  123    HZ3  LYS  15           2HZ      LYS  15  -4.003  15.106  10.409
  124    H    LYS  16           H        LYS  16  -0.215  14.344   6.532
  125    HA   LYS  16           HA       LYS  16   1.920  12.645   5.596
  126    HB2  LYS  16           2HB      LYS  16   0.712  10.617   6.672
  127    HB3  LYS  16           1HB      LYS  16   1.797  11.571   7.660
  128    HG2  LYS  16           2HG      LYS  16  -0.397  12.869   8.266
  129    HG3  LYS  16           1HG      LYS  16  -1.160  11.366   7.751
  130    HD2  LYS  16           2HD      LYS  16   0.179  10.117   9.360
  131    HD3  LYS  16           1HD      LYS  16   0.985  11.605   9.860
  132    HE2  LYS  16           2HE      LYS  16  -1.155  12.517  10.612
  133    HE3  LYS  16           1HE      LYS  16  -1.968  11.039  10.100
  134    HZ1  LYS  16           3HZ      LYS  16  -0.912   9.805  11.775
  135    HZ2  LYS  16           1HZ      LYS  16  -1.401  11.234  12.535
  136    HZ3  LYS  16           2HZ      LYS  16   0.217  11.023  12.098
  137    H    TYR  17           H        TYR  17   0.715  10.510   4.682
  138    HA   TYR  17           HA       TYR  17  -1.193  11.589   2.767
  139    HB2  TYR  17           2HB      TYR  17   0.009   8.817   2.761
  140    HB3  TYR  17           1HB      TYR  17  -0.733   9.684   1.396
  141    HD1  TYR  17           1HD      TYR  17   2.263   9.428   3.528
  142    HD2  TYR  17           2HD      TYR  17   0.439  11.449   0.275
  143    HE1  TYR  17           1HE      TYR  17   4.424  10.429   2.958
  144    HE2  TYR  17           2HE      TYR  17   2.598  12.471  -0.318
  145    HH   TYR  17           HH       TYR  17   4.754  12.761   0.320
  146    H    GLY  18           H        GLY  18  -1.443  10.488   5.703
  147    HA2  GLY  18           2HA      GLY  18  -3.095   9.644   6.993
  148    HA3  GLY  18           1HA      GLY  18  -4.156  10.181   5.727
  149    H    PHE  19           H        PHE  19  -1.836   7.506   5.740
  150    HA   PHE  19           HA       PHE  19  -3.920   5.586   6.129
  151    HB2  PHE  19           2HB      PHE  19  -4.050   4.543   4.036
  152    HB3  PHE  19           1HB      PHE  19  -4.169   6.236   3.702
  153    HD1  PHE  19           2HD      PHE  19  -1.852   7.411   3.121
  154    HD2  PHE  19           1HD      PHE  19  -2.643   3.242   2.820
  155    HE1  PHE  19           2HE      PHE  19   0.033   7.161   1.548
  156    HE2  PHE  19           1HE      PHE  19  -0.769   2.989   1.254
  157    HZ   PHE  19           HZ       PHE  19   0.573   4.953   0.616
  158    H    THR  20           H        THR  20  -3.351   3.574   6.423
  159    HA   THR  20           HA       THR  20  -0.563   3.133   7.206
  160    HB   THR  20           HB       THR  20  -3.064   1.512   7.737
  161    HG1  THR  20           1HG      THR  20  -3.003   2.464   9.735
  162   HG21  THR  20          3HG2      THR  20  -0.383   1.174   9.074
  163   HG22  THR  20          1HG2      THR  20  -0.893   0.194   7.700
  164   HG23  THR  20          2HG2      THR  20  -1.805   0.137   9.210
  165    H    LEU  21           H        LEU  21   0.810   2.185   5.776
  166    HA   LEU  21           HA       LEU  21  -0.259   0.435   3.713
  167    HB2  LEU  21           2HB      LEU  21   1.735   2.229   3.527
  168    HB3  LEU  21           1HB      LEU  21   2.678   0.839   3.974
  169    HG   LEU  21           HG       LEU  21   2.543  -0.052   1.935
  170   HD11  LEU  21          1HD1      LEU  21   0.501  -0.193   0.590
  171   HD12  LEU  21          2HD1      LEU  21  -0.336   0.828   1.758
  172   HD13  LEU  21          3HD1      LEU  21   0.240  -0.770   2.235
  173   HD21  LEU  21          3HD2      LEU  21   1.369   2.620   1.220
  174   HD22  LEU  21          1HD2      LEU  21   2.231   1.525   0.138
  175   HD23  LEU  21          2HD2      LEU  21   3.078   2.286   1.486
  176    H    ARG  22           H        ARG  22  -0.903  -1.321   5.006
  177    HA   ARG  22           HA       ARG  22   0.859  -2.692   6.780
  178    HB2  ARG  22           2HB      ARG  22  -1.797  -2.761   6.415
  179    HB3  ARG  22           1HB      ARG  22  -1.368  -4.150   5.438
  180    HG2  ARG  22           2HG      ARG  22  -1.808  -5.085   7.497
  181    HG3  ARG  22           1HG      ARG  22  -0.051  -4.925   7.510
  182    HD2  ARG  22           2HD      ARG  22  -0.174  -2.959   8.868
  183    HD3  ARG  22           1HD      ARG  22  -1.929  -2.884   8.695
  184    HE   ARG  22           HE       ARG  22  -1.340  -5.351   9.824
  185   HH11  ARG  22          1HH1      ARG  22  -1.027  -1.969  10.703
  186   HH12  ARG  22          2HH1      ARG  22  -1.073  -2.284  12.408
  187   HH21  ARG  22          1HH2      ARG  22  -1.422  -5.749  12.070
  188   HH22  ARG  22          2HH2      ARG  22  -1.305  -4.417  13.178
  189    H    ALA  23           H        ALA  23   2.151  -4.481   6.408
  190    HA   ALA  23           HA       ALA  23   2.624  -5.170   3.585
  191    HB1  ALA  23           1HB      ALA  23   4.434  -5.525   5.976
  192    HB2  ALA  23           2HB      ALA  23   4.573  -4.268   4.746
  193    HB3  ALA  23           3HB      ALA  23   4.828  -5.958   4.312
  194    H    ILE  24           H        ILE  24   2.465  -7.288   2.891
  195    HA   ILE  24           HA       ILE  24   2.057  -9.365   4.913
  196    HB   ILE  24           HB       ILE  24   0.153 -10.264   3.442
  197   HG12  ILE  24          2HG1      ILE  24  -0.290  -7.366   2.787
  198   HG13  ILE  24          1HG1      ILE  24   0.649  -8.393   1.708
  199   HG21  ILE  24          1HG2      ILE  24  -0.160  -9.512   5.719
  200   HG22  ILE  24          2HG2      ILE  24  -1.511  -8.988   4.714
  201   HG23  ILE  24          3HG2      ILE  24  -0.257  -7.837   5.175
  202   HD11  ILE  24          3HD1      ILE  24  -1.703  -8.199   1.044
  203   HD12  ILE  24          1HD1      ILE  24  -2.179  -8.936   2.573
  204   HD13  ILE  24          2HD1      ILE  24  -1.235  -9.861   1.404
  205    H    ARG  25           H        ARG  25   2.599 -11.402   4.296
  206    HA   ARG  25           HA       ARG  25   3.836 -11.664   1.635
  207    HB2  ARG  25           2HB      ARG  25   4.604 -12.933   4.270
  208    HB3  ARG  25           1HB      ARG  25   5.271 -13.425   2.719
  209    HG2  ARG  25           2HG      ARG  25   6.340 -11.333   2.412
  210    HG3  ARG  25           1HG      ARG  25   5.458 -10.612   3.759
  211    HD2  ARG  25           2HD      ARG  25   6.623 -12.048   5.325
  212    HD3  ARG  25           1HD      ARG  25   7.449 -12.866   4.000
  213    HE   ARG  25           HE       ARG  25   8.238 -10.362   3.594
  214   HH11  ARG  25          1HH1      ARG  25   8.045 -12.192   6.573
  215   HH12  ARG  25          2HH1      ARG  25   9.364 -11.352   7.322
  216   HH21  ARG  25          1HH2      ARG  25   9.980  -9.257   4.592
  217   HH22  ARG  25          2HH2      ARG  25  10.448  -9.678   6.210
  218    H    VAL  26           H        VAL  26   2.018 -12.450   0.627
  219    HA   VAL  26           HA       VAL  26   0.469 -14.594   1.733
  220    HB   VAL  26           HB       VAL  26  -0.554 -14.651  -0.605
  221   HG11  VAL  26          1HG1      VAL  26  -1.678 -12.381  -0.222
  222   HG12  VAL  26          2HG1      VAL  26  -0.634 -12.246   1.194
  223   HG13  VAL  26          3HG1      VAL  26  -1.791 -13.573   1.075
  224   HG21  VAL  26          3HG2      VAL  26  -0.158 -12.779  -2.056
  225   HG22  VAL  26          1HG2      VAL  26   1.372 -13.603  -1.749
  226   HG23  VAL  26          2HG2      VAL  26   1.001 -12.091  -0.917
  227    H    TYR  27           H        TYR  27   1.028 -16.635   1.751
  228    HA   TYR  27           HA       TYR  27   3.234 -17.604   0.187
  229    HB2  TYR  27           2HB      TYR  27   1.465 -18.744   2.309
  230    HB3  TYR  27           1HB      TYR  27   2.417 -19.838   1.312
  231    HD1  TYR  27           2HD      TYR  27   2.908 -16.657   3.224
  232    HD2  TYR  27           1HD      TYR  27   4.472 -20.454   2.126
  233    HE1  TYR  27           2HE      TYR  27   4.874 -16.252   4.642
  234    HE2  TYR  27           1HE      TYR  27   6.430 -20.061   3.552
  235    HH   TYR  27           HH       TYR  27   7.620 -18.443   4.625
  236    H    MET  28           H        MET  28   3.156 -19.464  -1.203
  237    HA   MET  28           HA       MET  28   0.537 -19.996  -2.411
  238    HB2  MET  28           2HB      MET  28   3.031 -19.216  -3.903
  239    HB3  MET  28           1HB      MET  28   1.616 -19.889  -4.678
  240    HG2  MET  28           2HG      MET  28   0.344 -17.993  -3.887
  241    HG3  MET  28           1HG      MET  28   1.784 -17.317  -3.156
  242    HE1  MET  28           3HE      MET  28   4.022 -17.984  -5.320
  243    HE2  MET  28           1HE      MET  28   3.860 -16.421  -4.518
  244    HE3  MET  28           2HE      MET  28   3.993 -16.503  -6.274
  245    H    GLY  29           H        GLY  29   0.731 -21.965  -1.182
  246    HA2  GLY  29           2HA      GLY  29   0.907 -24.295  -1.970
  247    HA3  GLY  29           1HA      GLY  29   2.536 -23.899  -2.494
  248    H    ASP  30           H        ASP  30   3.244 -25.702  -1.230
  249    HA   ASP  30           HA       ASP  30   3.028 -25.436   1.669
  250    HB2  ASP  30           2HB      ASP  30   4.051 -27.620  -0.138
  251    HB3  ASP  30           1HB      ASP  30   4.346 -27.643   1.598
  252    H    SER  31           H        SER  31   5.206 -24.745  -0.857
  253    HA   SER  31           HA       SER  31   7.627 -24.872   0.641
  254    HB2  SER  31           2HB      SER  31   7.716 -23.035  -1.594
  255    HB3  SER  31           1HB      SER  31   8.527 -24.587  -1.397
  256    HG   SER  31           HG       SER  31   6.913 -25.592  -2.383
  257    H    ASP  32           H        ASP  32   9.026 -22.809   0.765
  258    HA   ASP  32           HA       ASP  32   7.594 -20.914   2.403
  259    HB2  ASP  32           2HB      ASP  32   9.901 -21.824   2.929
  260    HB3  ASP  32           1HB      ASP  32  10.508 -20.821   1.618
  261    H    VAL  33           H        VAL  33   7.188 -21.069  -0.563
  262    HA   VAL  33           HA       VAL  33   8.197 -18.565  -1.559
  263    HB   VAL  33           HB       VAL  33   8.030 -20.280  -3.192
  264   HG11  VAL  33          1HG1      VAL  33   5.960 -21.410  -3.779
  265   HG12  VAL  33          2HG1      VAL  33   5.096 -20.513  -2.531
  266   HG13  VAL  33          3HG1      VAL  33   6.342 -21.675  -2.079
  267   HG21  VAL  33          3HG2      VAL  33   6.469 -19.266  -4.846
  268   HG22  VAL  33          1HG2      VAL  33   7.535 -18.105  -4.056
  269   HG23  VAL  33          2HG2      VAL  33   5.849 -18.235  -3.556
  270    H    TYR  34           H        TYR  34   7.244 -16.712  -1.458
  271    HA   TYR  34           HA       TYR  34   4.371 -16.498  -1.112
  272    HB2  TYR  34           2HB      TYR  34   4.645 -14.906   0.805
  273    HB3  TYR  34           1HB      TYR  34   5.067 -16.567   1.194
  274    HD1  TYR  34           1HD      TYR  34   6.573 -13.295   0.244
  275    HD2  TYR  34           2HD      TYR  34   7.146 -17.065   2.120
  276    HE1  TYR  34           1HE      TYR  34   8.767 -12.549   1.059
  277    HE2  TYR  34           2HE      TYR  34   9.340 -16.329   2.940
  278    HH   TYR  34           HH       TYR  34  11.044 -14.712   2.439
  279    H    THR  35           H        THR  35   3.576 -14.336  -1.482
  280    HA   THR  35           HA       THR  35   5.471 -12.761  -3.094
  281    HB   THR  35           HB       THR  35   2.808 -11.864  -3.499
  282    HG1  THR  35           1HG      THR  35   3.103 -14.636  -3.277
  283   HG21  THR  35          3HG2      THR  35   4.714 -13.407  -5.261
  284   HG22  THR  35          1HG2      THR  35   4.585 -11.653  -5.131
  285   HG23  THR  35          2HG2      THR  35   3.260 -12.586  -5.827
  286    H    VAL  36           H        VAL  36   6.044 -10.852  -2.335
  287    HA   VAL  36           HA       VAL  36   4.902  -9.914   0.150
  288    HB   VAL  36           HB       VAL  36   7.025  -8.449  -1.394
  289   HG11  VAL  36          1HG1      VAL  36   7.728  -7.742   0.819
  290   HG12  VAL  36          2HG1      VAL  36   6.488  -8.758   1.557
  291   HG13  VAL  36          3HG1      VAL  36   6.022  -7.372   0.571
  292   HG21  VAL  36          3HG2      VAL  36   7.806 -10.729  -1.321
  293   HG22  VAL  36          1HG2      VAL  36   7.405 -10.850   0.392
  294   HG23  VAL  36          2HG2      VAL  36   8.702  -9.778  -0.138
  295    H    HIS  37           H        HIS  37   2.988  -8.967  -0.079
  296    HA   HIS  37           HA       HIS  37   2.728  -6.821  -2.082
  297    HB2  HIS  37           2HB      HIS  37   0.569  -8.550  -0.849
  298    HB3  HIS  37           1HB      HIS  37   0.272  -7.191  -1.922
  299    HD2  HIS  37           2HD      HIS  37  -0.067 -10.681  -2.328
  300    HE1  HIS  37           1HE      HIS  37   2.089  -9.601  -5.807
  301    HE2  HIS  37           2HE      HIS  37   0.573 -11.342  -4.758
  302    H    HIS  38           H        HIS  38   0.665  -5.422  -1.195
  303    HA   HIS  38           HA       HIS  38   0.943  -4.864   1.646
  304    HB2  HIS  38           2HB      HIS  38   1.565  -2.805  -0.491
  305    HB3  HIS  38           1HB      HIS  38   1.294  -2.421   1.202
  306    HD2  HIS  38           2HD      HIS  38   4.110  -3.142  -1.114
  307    HE1  HIS  38           1HE      HIS  38   5.528  -4.081   2.750
  308    HE2  HIS  38           2HE      HIS  38   6.100  -4.043   0.289
  309    H    MET  39           H        MET  39  -0.761  -3.526   2.439
  310    HA   MET  39           HA       MET  39  -2.933  -2.897   0.599
  311    HB2  MET  39           2HB      MET  39  -3.331  -4.751   2.963
  312    HB3  MET  39           1HB      MET  39  -4.607  -4.113   1.939
  313    HG2  MET  39           2HG      MET  39  -3.366  -5.289   0.021
  314    HG3  MET  39           1HG      MET  39  -2.528  -6.167   1.297
  315    HE1  MET  39           3HE      MET  39  -3.841  -7.640   3.154
  316    HE2  MET  39           1HE      MET  39  -5.590  -7.865   3.143
  317    HE3  MET  39           2HE      MET  39  -4.907  -6.275   3.488
  318    H    VAL  40           H        VAL  40  -4.210  -1.251   1.332
  319    HA   VAL  40           HA       VAL  40  -3.185   0.277   3.510
  320    HB   VAL  40           HB       VAL  40  -4.015   1.547   1.705
  321   HG11  VAL  40          1HG1      VAL  40  -6.838   0.839   1.831
  322   HG12  VAL  40          2HG1      VAL  40  -5.801  -0.484   1.299
  323   HG13  VAL  40          3HG1      VAL  40  -5.778   1.052   0.436
  324   HG21  VAL  40          3HG2      VAL  40  -5.455   3.062   2.769
  325   HG22  VAL  40          1HG2      VAL  40  -4.576   2.278   4.083
  326   HG23  VAL  40          2HG2      VAL  40  -6.232   1.791   3.715
  327    H    TRP  41           H        TRP  41  -3.440  -0.430   5.447
  328    HA   TRP  41           HA       TRP  41  -5.553  -2.106   6.337
  329    HB2  TRP  41           2HB      TRP  41  -3.075  -1.686   7.199
  330    HB3  TRP  41           1HB      TRP  41  -3.902  -0.563   8.265
  331    HD1  TRP  41           HD       TRP  41  -3.978  -1.724  10.517
  332    HE1  TRP  41           1HE      TRP  41  -4.753  -4.015  11.378
  333    HE3  TRP  41           3HE      TRP  41  -5.007  -3.970   6.037
  334    HZ2  TRP  41           2HZ      TRP  41  -5.701  -6.456  10.299
  335    HZ3  TRP  41           3HZ      TRP  41  -5.849  -6.278   6.043
  336    HH2  TRP  41           HH       TRP  41  -6.185  -7.493   8.131
  337    H    HIS  42           H        HIS  42  -4.765   1.272   6.773
  338    HA   HIS  42           HA       HIS  42  -7.544   1.907   7.332
  339    HB2  HIS  42           2HB      HIS  42  -5.989   1.364   9.476
  340    HB3  HIS  42           1HB      HIS  42  -5.649   3.070   9.282
  341    HD2  HIS  42           2HD      HIS  42  -8.068   4.707   9.308
  342    HE1  HIS  42           1HE      HIS  42 -10.096   1.863  11.692
  343    HE2  HIS  42           2HE      HIS  42 -10.024   4.283  10.956
  344    H    VAL  43           H        VAL  43  -8.033   3.833   6.494
  345    HA   VAL  43           HA       VAL  43  -5.814   5.684   6.010
  346    HB   VAL  43           HB       VAL  43  -6.265   4.686   3.897
  347   HG11  VAL  43          1HG1      VAL  43  -9.132   5.324   4.436
  348   HG12  VAL  43          2HG1      VAL  43  -8.392   3.741   4.195
  349   HG13  VAL  43          3HG1      VAL  43  -8.509   4.876   2.850
  350   HG21  VAL  43          3HG2      VAL  43  -5.859   7.105   3.902
  351   HG22  VAL  43          1HG2      VAL  43  -7.604   7.375   3.950
  352   HG23  VAL  43          2HG2      VAL  43  -6.877   6.588   2.550
  353    H    GLU  44           H        GLU  44  -6.103   7.661   6.607
  354    HA   GLU  44           HA       GLU  44  -8.268   8.404   8.257
  355    HB2  GLU  44           2HB      GLU  44  -5.862   9.785   7.132
  356    HB3  GLU  44           1HB      GLU  44  -7.068  10.676   8.030
  357    HG2  GLU  44           2HG      GLU  44  -6.727   9.180   9.948
  358    HG3  GLU  44           1HG      GLU  44  -5.470   8.347   9.033
  359    H    ASP  45           H        ASP  45 -10.191   8.977   7.596
  360    HA   ASP  45           HA       ASP  45 -10.650   9.984   4.925
  361    HB2  ASP  45           2HB      ASP  45 -13.051   9.895   5.593
  362    HB3  ASP  45           1HB      ASP  45 -12.215   8.359   5.786
  363    H    GLY  46           H        GLY  46  -9.090  11.652   6.595
  364    HA2  GLY  46           2HA      GLY  46 -10.891  13.856   7.282
  365    HA3  GLY  46           1HA      GLY  46  -9.225  13.693   7.801
  366    H    GLY  47           H        GLY  47  -8.420  13.027   4.945
  367    HA2  GLY  47           2HA      GLY  47  -9.064  15.201   3.314
  368    HA3  GLY  47           1HA      GLY  47  -7.660  15.640   4.260
  369    HA   PRO  48           HA       PRO  48  -4.739  13.481   1.751
  370    HB2  PRO  48           2HB      PRO  48  -4.582  11.185   3.645
  371    HB3  PRO  48           1HB      PRO  48  -3.282  12.137   2.923
  372    HG2  PRO  48           2HG      PRO  48  -3.936  12.581   5.407
  373    HG3  PRO  48           1HG      PRO  48  -3.742  13.980   4.326
  374    HD2  PRO  48           2HD      PRO  48  -6.267  12.622   5.220
  375    HD3  PRO  48           1HD      PRO  48  -5.878  14.350   5.168
  376    H    ALA  49           H        ALA  49  -4.404  10.418   2.140
  377    HA   ALA  49           HA       ALA  49  -5.136   9.532  -0.288
  378    HB1  ALA  49           1HB      ALA  49  -4.105   7.712   0.414
  379    HB2  ALA  49           2HB      ALA  49  -5.406   7.338   1.551
  380    HB3  ALA  49           3HB      ALA  49  -4.078   8.392   2.049
  381    H    SER  50           H        SER  50  -7.299   9.416   2.549
  382    HA   SER  50           HA       SER  50  -9.244   7.771   1.345
  383    HB2  SER  50           2HB      SER  50  -9.043   9.428   3.734
  384    HB3  SER  50           1HB      SER  50 -10.673   9.341   3.077
  385    HG   SER  50           HG       SER  50  -9.826   6.905   2.969
  386    H    GLU  51           H        GLU  51  -9.413  11.295   1.856
  387    HA   GLU  51           HA       GLU  51 -11.742  11.653   0.311
  388    HB2  GLU  51           2HB      GLU  51  -9.609  13.678   0.998
  389    HB3  GLU  51           1HB      GLU  51 -11.232  14.045   0.425
  390    HG2  GLU  51           2HG      GLU  51 -11.253  12.318   2.753
  391    HG3  GLU  51           1HG      GLU  51 -10.422  13.839   3.054
  392    H    ALA  52           H        ALA  52  -8.445  11.319  -0.529
  393    HA   ALA  52           HA       ALA  52  -8.512  12.572  -3.080
  394    HB1  ALA  52           1HB      ALA  52  -6.384  12.310  -2.154
  395    HB2  ALA  52           2HB      ALA  52  -6.438  11.076  -3.418
  396    HB3  ALA  52           3HB      ALA  52  -6.678  10.623  -1.728
  397    H    GLY  53           H        GLY  53  -9.524   9.473  -1.874
  398    HA2  GLY  53           2HA      GLY  53 -11.214   8.537  -3.573
  399    HA3  GLY  53           1HA      GLY  53  -9.803   8.455  -4.611
  400    H    LEU  54           H        LEU  54  -8.312   7.807  -1.936
  401    HA   LEU  54           HA       LEU  54  -8.272   4.990  -2.358
  402    HB2  LEU  54           2HB      LEU  54  -6.391   6.513  -1.467
  403    HB3  LEU  54           1HB      LEU  54  -7.169   6.342   0.085
  404    HG   LEU  54           HG       LEU  54  -6.224   3.992  -1.547
  405   HD11  LEU  54          1HD1      LEU  54  -4.323   5.423  -1.012
  406   HD12  LEU  54          2HD1      LEU  54  -4.283   3.922  -0.086
  407   HD13  LEU  54          3HD1      LEU  54  -4.799   5.422   0.686
  408   HD21  LEU  54          3HD2      LEU  54  -6.340   2.862   0.632
  409   HD22  LEU  54          1HD2      LEU  54  -7.901   3.466   0.078
  410   HD23  LEU  54          2HD2      LEU  54  -7.012   4.336   1.326
  411    H    ARG  55           H        ARG  55  -9.795   3.680  -1.761
  412    HA   ARG  55           HA       ARG  55 -11.413   4.293   0.586
  413    HB2  ARG  55           2HB      ARG  55 -12.539   2.028  -0.342
  414    HB3  ARG  55           1HB      ARG  55 -12.984   3.627  -0.908
  415    HG2  ARG  55           2HG      ARG  55 -12.739   2.421  -2.861
  416    HG3  ARG  55           1HG      ARG  55 -11.193   3.250  -2.721
  417    HD2  ARG  55           2HD      ARG  55 -10.686   1.021  -3.314
  418    HD3  ARG  55           1HD      ARG  55 -10.325   1.159  -1.592
  419    HE   ARG  55           HE       ARG  55 -12.723   0.196  -1.375
  420   HH11  ARG  55          1HH1      ARG  55 -10.296  -0.728  -3.742
  421   HH12  ARG  55          2HH1      ARG  55 -10.968  -2.316  -3.974
  422   HH21  ARG  55          1HH2      ARG  55 -13.581  -1.885  -1.674
  423   HH22  ARG  55          2HH2      ARG  55 -12.836  -2.969  -2.805
  424    H    GLN  56           H        GLN  56 -10.977   3.388   2.484
  425    HA   GLN  56           HA       GLN  56  -8.862   1.759   3.064
  426    HB2  GLN  56           2HB      GLN  56 -10.243   2.974   4.716
  427    HB3  GLN  56           1HB      GLN  56 -11.475   1.750   4.551
  428    HG2  GLN  56           2HG      GLN  56 -10.172   0.180   5.552
  429    HG3  GLN  56           1HG      GLN  56  -8.680   1.048   5.284
  430   HE21  GLN  56          1HE2      GLN  56 -10.036  -0.054   7.726
  431   HE22  GLN  56          2HE2      GLN  56 -10.065   1.275   8.832
  432    H    GLY  57           H        GLY  57  -8.389  -0.335   3.038
  433    HA2  GLY  57           2HA      GLY  57  -8.794  -2.644   2.969
  434    HA3  GLY  57           1HA      GLY  57 -10.490  -2.310   2.638
  435    H    ASP  58           H        ASP  58  -7.353  -1.673   1.121
  436    HA   ASP  58           HA       ASP  58  -8.300  -2.873  -1.372
  437    HB2  ASP  58           2HB      ASP  58  -8.507  -0.237  -1.243
  438    HB3  ASP  58           1HB      ASP  58  -6.776  -0.308  -1.557
  439    H    LEU  59           H        LEU  59  -6.561  -3.456  -2.781
  440    HA   LEU  59           HA       LEU  59  -4.092  -4.007  -1.289
  441    HB2  LEU  59           2HB      LEU  59  -5.013  -6.050  -1.965
  442    HB3  LEU  59           1HB      LEU  59  -5.528  -5.416  -3.514
  443    HG   LEU  59           HG       LEU  59  -3.061  -5.279  -4.125
  444   HD11  LEU  59          1HD1      LEU  59  -2.163  -5.446  -1.861
  445   HD12  LEU  59          2HD1      LEU  59  -1.556  -6.742  -2.895
  446   HD13  LEU  59          3HD1      LEU  59  -2.826  -7.075  -1.715
  447   HD21  LEU  59          3HD2      LEU  59  -4.391  -7.936  -3.620
  448   HD22  LEU  59          1HD2      LEU  59  -2.954  -7.716  -4.621
  449   HD23  LEU  59          2HD2      LEU  59  -4.478  -6.956  -5.084
  450    H    ILE  60           H        ILE  60  -2.284  -3.015  -1.855
  451    HA   ILE  60           HA       ILE  60  -2.311  -1.198  -4.106
  452    HB   ILE  60           HB       ILE  60  -0.227  -1.720  -1.981
  453   HG12  ILE  60          2HG1      ILE  60  -0.803   0.752  -1.506
  454   HG13  ILE  60          1HG1      ILE  60  -2.228   0.470  -2.498
  455   HG21  ILE  60          1HG2      ILE  60   1.013   0.167  -2.894
  456   HG22  ILE  60          2HG2      ILE  60  -0.170   0.329  -4.195
  457   HG23  ILE  60          3HG2      ILE  60   0.846  -1.109  -4.102
  458   HD11  ILE  60          3HD1      ILE  60  -1.528  -1.044   0.005
  459   HD12  ILE  60          1HD1      ILE  60  -2.988  -1.236  -0.965
  460   HD13  ILE  60          2HD1      ILE  60  -2.693   0.278  -0.107
  461    H    THR  61           H        THR  61  -1.612  -1.682  -6.045
  462    HA   THR  61           HA       THR  61  -0.006  -4.107  -6.413
  463    HB   THR  61           HB       THR  61  -0.712  -4.052  -8.732
  464    HG1  THR  61           1HG      THR  61  -0.830  -1.902  -9.240
  465   HG21  THR  61          3HG2      THR  61  -3.068  -3.461  -6.934
  466   HG22  THR  61          1HG2      THR  61  -2.266  -5.028  -7.075
  467   HG23  THR  61          2HG2      THR  61  -3.111  -4.343  -8.463
  468    H    HIS  62           H        HIS  62  -0.027  -0.644  -6.968
  469    HA   HIS  62           HA       HIS  62   2.834  -0.711  -7.558
  470    HB2  HIS  62           2HB      HIS  62   0.817   0.661  -9.351
  471    HB3  HIS  62           1HB      HIS  62   2.555   0.846  -9.471
  472    HD2  HIS  62           2HD      HIS  62   3.918  -1.335 -10.588
  473    HE1  HIS  62           1HE      HIS  62   0.392  -3.323 -11.825
  474    HE2  HIS  62           2HE      HIS  62   2.894  -3.124 -12.164
  475    H    VAL  63           H        VAL  63   3.809   1.424  -7.440
  476    HA   VAL  63           HA       VAL  63   2.224   3.529  -6.230
  477    HB   VAL  63           HB       VAL  63   3.046   2.293  -4.304
  478   HG11  VAL  63          1HG1      VAL  63   5.002   1.234  -5.283
  479   HG12  VAL  63          2HG1      VAL  63   5.422   2.092  -3.801
  480   HG13  VAL  63          3HG1      VAL  63   5.815   2.797  -5.369
  481   HG21  VAL  63          3HG2      VAL  63   4.511   4.202  -3.321
  482   HG22  VAL  63          1HG2      VAL  63   2.841   4.536  -3.784
  483   HG23  VAL  63          2HG2      VAL  63   4.163   5.010  -4.850
  484    H    ASN  64           H        ASN  64   2.606   5.244  -7.440
  485    HA   ASN  64           HA       ASN  64   3.626   6.791  -8.765
  486    HB2  ASN  64           2HB      ASN  64   5.519   6.158  -6.666
  487    HB3  ASN  64           1HB      ASN  64   6.350   6.616  -8.149
  488   HD21  ASN  64          1HD2      ASN  64   7.080   8.542  -7.384
  489   HD22  ASN  64          2HD2      ASN  64   6.046   9.880  -7.013
  490    H    GLY  65           H        GLY  65   3.358   4.100  -9.744
  491    HA2  GLY  65           2HA      GLY  65   3.928   2.940 -11.653
  492    HA3  GLY  65           1HA      GLY  65   4.977   4.286 -12.070
  493    H    GLU  66           H        GLU  66   4.999   2.129  -9.287
  494    HA   GLU  66           HA       GLU  66   7.476   0.894 -10.121
  495    HB2  GLU  66           2HB      GLU  66   7.579   3.108  -8.585
  496    HB3  GLU  66           1HB      GLU  66   7.418   1.884  -7.339
  497    HG2  GLU  66           2HG      GLU  66   9.760   2.457  -7.807
  498    HG3  GLU  66           1HG      GLU  66   9.398   0.758  -8.104
  499    HA   PRO  67           HA       PRO  67   4.733  -2.487  -8.779
  500    HB2  PRO  67           2HB      PRO  67   7.473  -3.652  -9.039
  501    HB3  PRO  67           1HB      PRO  67   5.924  -4.295  -9.591
  502    HG2  PRO  67           2HG      PRO  67   7.706  -3.014 -11.220
  503    HG3  PRO  67           1HG      PRO  67   5.960  -3.081 -11.517
  504    HD2  PRO  67           2HD      PRO  67   7.581  -0.801 -10.782
  505    HD3  PRO  67           1HD      PRO  67   5.888  -0.832 -11.260
  506    H    VAL  68           H        VAL  68   4.277  -2.865  -6.793
  507    HA   VAL  68           HA       VAL  68   6.172  -2.332  -4.656
  508    HB   VAL  68           HB       VAL  68   4.284  -2.706  -3.117
  509   HG11  VAL  68          1HG1      VAL  68   3.642  -0.812  -5.376
  510   HG12  VAL  68          2HG1      VAL  68   4.670  -0.465  -3.986
  511   HG13  VAL  68          3HG1      VAL  68   2.947  -0.756  -3.755
  512   HG21  VAL  68          3HG2      VAL  68   3.099  -4.389  -4.421
  513   HG22  VAL  68          1HG2      VAL  68   2.667  -3.164  -5.615
  514   HG23  VAL  68          2HG2      VAL  68   2.033  -3.057  -3.973
  515    H    HIS  69           H        HIS  69   5.172  -4.746  -6.536
  516    HA   HIS  69           HA       HIS  69   4.991  -7.018  -5.016
  517    HB2  HIS  69           2HB      HIS  69   5.729  -6.298  -7.814
  518    HB3  HIS  69           1HB      HIS  69   5.882  -7.939  -7.281
  519    HD2  HIS  69           2HD      HIS  69   2.866  -6.013  -5.902
  520    HE1  HIS  69           1HE      HIS  69   1.508  -8.582  -8.987
  521    HE2  HIS  69           2HE      HIS  69   0.820  -7.203  -6.975
  522    H    GLY  70           H        GLY  70   6.520  -7.267  -3.416
  523    HA2  GLY  70           2HA      GLY  70   8.559  -8.522  -3.010
  524    HA3  GLY  70           1HA      GLY  70   9.284  -7.683  -4.372
  525    H    LEU  71           H        LEU  71   7.607  -5.319  -2.959
  526    HA   LEU  71           HA       LEU  71   9.941  -4.220  -1.669
  527    HB2  LEU  71           2HB      LEU  71   7.127  -3.196  -2.014
  528    HB3  LEU  71           1HB      LEU  71   8.361  -2.313  -1.141
  529    HG   LEU  71           HG       LEU  71   8.292  -2.949  -4.085
  530   HD11  LEU  71          1HD1      LEU  71   8.337  -0.535  -4.331
  531   HD12  LEU  71          2HD1      LEU  71   8.425  -0.336  -2.581
  532   HD13  LEU  71          3HD1      LEU  71   6.976  -1.018  -3.319
  533   HD21  LEU  71          3HD2      LEU  71  10.550  -3.276  -3.559
  534   HD22  LEU  71          1HD2      LEU  71  10.554  -1.970  -2.374
  535   HD23  LEU  71          2HD2      LEU  71  10.456  -1.599  -4.094
  536    H    VAL  72           H        VAL  72  10.322  -4.014   0.491
  537    HA   VAL  72           HA       VAL  72   8.667  -5.555   2.280
  538    HB   VAL  72           HB       VAL  72  11.307  -5.113   2.263
  539   HG11  VAL  72          1HG1      VAL  72  12.042  -3.549   3.899
  540   HG12  VAL  72          2HG1      VAL  72  10.385  -3.158   4.358
  541   HG13  VAL  72          3HG1      VAL  72  10.994  -2.691   2.770
  542   HG21  VAL  72          3HG2      VAL  72   9.789  -5.469   4.842
  543   HG22  VAL  72          1HG2      VAL  72  11.417  -6.032   4.473
  544   HG23  VAL  72          2HG2      VAL  72  10.031  -6.739   3.644
  545    H    HIS  73           H        HIS  73   8.100  -4.498   4.461
  546    HA   HIS  73           HA       HIS  73   6.050  -2.739   4.272
  547    HB2  HIS  73           2HB      HIS  73   6.909  -4.040   6.322
  548    HB3  HIS  73           1HB      HIS  73   7.920  -2.647   6.626
  549    HD1  HIS  73           1HD      HIS  73   4.207  -3.450   6.306
  550    HD2  HIS  73           2HD      HIS  73   6.762  -0.638   7.976
  551    HE1  HIS  73           1HE      HIS  73   2.772  -1.959   7.751
  552    H    THR  74           H        THR  74   9.339  -1.830   5.177
  553    HA   THR  74           HA       THR  74   8.752   0.946   5.302
  554    HB   THR  74           HB       THR  74  11.056   1.206   5.878
  555    HG1  THR  74           1HG      THR  74  12.371   0.071   4.623
  556   HG21  THR  74          3HG2      THR  74   9.893   0.206   7.672
  557   HG22  THR  74          1HG2      THR  74  11.348  -0.773   7.492
  558   HG23  THR  74          2HG2      THR  74   9.805  -1.361   6.855
  559    H    GLU  75           H        GLU  75   9.679  -1.130   2.699
  560    HA   GLU  75           HA       GLU  75  11.026   0.821   1.150
  561    HB2  GLU  75           2HB      GLU  75   9.907  -1.883   0.627
  562    HB3  GLU  75           1HB      GLU  75  10.302  -0.847  -0.737
  563    HG2  GLU  75           2HG      GLU  75  12.582  -0.630   0.033
  564    HG3  GLU  75           1HG      GLU  75  12.209  -1.589   1.462
  565    H    VAL  76           H        VAL  76   7.615  -0.241   1.244
  566    HA   VAL  76           HA       VAL  76   6.849   1.398  -0.950
  567    HB   VAL  76           HB       VAL  76   4.519   1.247   0.040
  568   HG11  VAL  76          1HG1      VAL  76   6.014  -1.276  -0.583
  569   HG12  VAL  76          2HG1      VAL  76   5.312  -0.157  -1.753
  570   HG13  VAL  76          3HG1      VAL  76   4.264  -1.067  -0.664
  571   HG21  VAL  76          3HG2      VAL  76   6.028   0.005   2.199
  572   HG22  VAL  76          1HG2      VAL  76   4.673  -0.973   1.629
  573   HG23  VAL  76          2HG2      VAL  76   4.389   0.680   2.200
  574    H    VAL  77           H        VAL  77   6.767   1.868   2.539
  575    HA   VAL  77           HA       VAL  77   5.701   4.395   2.715
  576    HB   VAL  77           HB       VAL  77   7.983   3.320   4.347
  577   HG11  VAL  77          1HG1      VAL  77   7.239   4.785   6.103
  578   HG12  VAL  77          2HG1      VAL  77   5.898   5.340   5.106
  579   HG13  VAL  77          3HG1      VAL  77   7.555   5.725   4.645
  580   HG21  VAL  77          3HG2      VAL  77   6.417   1.658   4.619
  581   HG22  VAL  77          1HG2      VAL  77   5.052   2.762   4.427
  582   HG23  VAL  77          2HG2      VAL  77   5.980   2.755   5.927
  583    H    GLU  78           H        GLU  78   9.099   3.479   2.243
  584    HA   GLU  78           HA       GLU  78  10.123   6.084   2.042
  585    HB2  GLU  78           2HB      GLU  78  11.079   3.400   1.102
  586    HB3  GLU  78           1HB      GLU  78  11.980   4.865   0.728
  587    HG2  GLU  78           2HG      GLU  78  12.033   5.350   3.167
  588    HG3  GLU  78           1HG      GLU  78  11.325   3.758   3.438
  589    H    LEU  79           H        LEU  79   9.038   3.796  -0.448
  590    HA   LEU  79           HA       LEU  79   9.635   5.259  -2.725
  591    HB2  LEU  79           2HB      LEU  79   8.253   2.930  -2.185
  592    HB3  LEU  79           1HB      LEU  79   7.000   3.971  -2.831
  593    HG   LEU  79           HG       LEU  79   7.970   2.589  -4.589
  594   HD11  LEU  79          1HD1      LEU  79   8.770   5.481  -4.877
  595   HD12  LEU  79          2HD1      LEU  79   7.166   4.819  -5.183
  596   HD13  LEU  79          3HD1      LEU  79   8.529   4.332  -6.191
  597   HD21  LEU  79          3HD2      LEU  79  10.389   3.134  -3.249
  598   HD22  LEU  79          1HD2      LEU  79  10.530   3.828  -4.865
  599   HD23  LEU  79          2HD2      LEU  79  10.135   2.121  -4.670
  600    H    ILE  80           H        ILE  80   6.868   5.487  -0.556
  601    HA   ILE  80           HA       ILE  80   5.457   7.430  -2.060
  602    HB   ILE  80           HB       ILE  80   5.278   6.428   0.763
  603   HG12  ILE  80          2HG1      ILE  80   3.123   6.346  -1.307
  604   HG13  ILE  80          1HG1      ILE  80   4.479   5.233  -1.433
  605   HG21  ILE  80          1HG2      ILE  80   3.759   8.671  -0.513
  606   HG22  ILE  80          2HG2      ILE  80   4.617   8.659   1.027
  607   HG23  ILE  80          3HG2      ILE  80   3.119   7.746   0.844
  608   HD11  ILE  80          3HD1      ILE  80   2.639   4.185  -0.298
  609   HD12  ILE  80          1HD1      ILE  80   2.587   5.494   0.881
  610   HD13  ILE  80          2HD1      ILE  80   3.981   4.417   0.824
  611    H    LEU  81           H        LEU  81   7.411   7.678   0.927
  612    HA   LEU  81           HA       LEU  81   7.257  10.447   1.227
  613    HB2  LEU  81           2HB      LEU  81   9.501   8.582   1.988
  614    HB3  LEU  81           1HB      LEU  81   9.335  10.231   2.559
  615    HG   LEU  81           HG       LEU  81   7.293   8.077   3.074
  616   HD11  LEU  81          1HD1      LEU  81   9.350   7.453   4.166
  617   HD12  LEU  81          2HD1      LEU  81   8.209   8.053   5.367
  618   HD13  LEU  81          3HD1      LEU  81   9.534   9.078   4.821
  619   HD21  LEU  81          3HD2      LEU  81   6.513   9.662   4.792
  620   HD22  LEU  81          1HD2      LEU  81   6.383  10.305   3.156
  621   HD23  LEU  81          2HD2      LEU  81   7.693  10.835   4.207
  622    H    LYS  82           H        LYS  82   9.469   8.481  -0.655
  623    HA   LYS  82           HA       LYS  82  11.336  10.388  -1.416
  624    HB2  LYS  82           2HB      LYS  82  11.262   7.853  -1.764
  625    HB3  LYS  82           1HB      LYS  82  10.396   8.255  -3.218
  626    HG2  LYS  82           2HG      LYS  82  12.459   9.866  -3.586
  627    HG3  LYS  82           1HG      LYS  82  13.244   8.656  -2.570
  628    HD2  LYS  82           2HD      LYS  82  11.663   7.987  -5.046
  629    HD3  LYS  82           1HD      LYS  82  13.411   8.241  -5.041
  630    HE2  LYS  82           2HE      LYS  82  13.520   6.440  -3.257
  631    HE3  LYS  82           1HE      LYS  82  11.836   6.085  -3.652
  632    HZ1  LYS  82           3HZ      LYS  82  14.150   5.939  -5.509
  633    HZ2  LYS  82           1HZ      LYS  82  12.538   5.684  -5.957
  634    HZ3  LYS  82           2HZ      LYS  82  13.290   4.630  -4.872
  635    H    SER  83           H        SER  83   8.226   9.573  -2.793
  636    HA   SER  83           HA       SER  83   8.369  10.945  -5.204
  637    HB2  SER  83           2HB      SER  83   6.554   9.388  -4.624
  638    HB3  SER  83           1HB      SER  83   5.930  10.550  -3.455
  639    HG   SER  83           HG       SER  83   5.022  11.618  -5.013
  640    H    GLY  84           H        GLY  84   7.490  12.202  -1.993
  641    HA2  GLY  84           2HA      GLY  84   8.308  14.560  -1.710
  642    HA3  GLY  84           1HA      GLY  84   7.465  14.892  -3.212
  643    H    ASN  85           H        ASN  85   5.985  16.347  -2.501
  644    HA   ASN  85           HA       ASN  85   4.530  15.976  -0.063
  645    HB2  ASN  85           2HB      ASN  85   3.175  17.934  -0.889
  646    HB3  ASN  85           1HB      ASN  85   4.893  18.220  -0.671
  647   HD21  ASN  85          1HD2      ASN  85   4.417  20.066  -2.035
  648   HD22  ASN  85          2HD2      ASN  85   4.455  19.864  -3.754
  649    H    LYS  86           H        LYS  86   4.229  14.281  -2.764
  650    HA   LYS  86           HA       LYS  86   1.607  13.402  -2.103
  651    HB2  LYS  86           2HB      LYS  86   0.768  13.703  -4.433
  652    HB3  LYS  86           1HB      LYS  86   0.832  15.148  -3.467
  653    HG2  LYS  86           2HG      LYS  86   2.595  16.030  -4.695
  654    HG3  LYS  86           1HG      LYS  86   3.054  14.453  -5.340
  655    HD2  LYS  86           2HD      LYS  86   1.036  14.372  -6.679
  656    HD3  LYS  86           1HD      LYS  86   0.496  15.904  -5.992
  657    HE2  LYS  86           2HE      LYS  86   1.422  16.279  -8.179
  658    HE3  LYS  86           1HE      LYS  86   2.468  17.002  -6.959
  659    HZ1  LYS  86           3HZ      LYS  86   3.509  15.642  -8.850
  660    HZ2  LYS  86           1HZ      LYS  86   3.009  14.290  -7.967
  661    HZ3  LYS  86           2HZ      LYS  86   4.080  15.402  -7.277
  662    H    VAL  87           H        VAL  87   0.898  11.692  -3.734
  663    HA   VAL  87           HA       VAL  87   2.976  10.360  -5.211
  664    HB   VAL  87           HB       VAL  87   3.656   9.844  -2.890
  665   HG11  VAL  87          1HG1      VAL  87   2.252   8.099  -1.694
  666   HG12  VAL  87          2HG1      VAL  87   0.944   8.559  -2.781
  667   HG13  VAL  87          3HG1      VAL  87   1.641   9.752  -1.686
  668   HG21  VAL  87          3HG2      VAL  87   2.836   7.612  -4.714
  669   HG22  VAL  87          1HG2      VAL  87   3.697   7.309  -3.205
  670   HG23  VAL  87          2HG2      VAL  87   4.438   8.306  -4.457
  671    H    ALA  88           H        ALA  88   2.280   8.647  -6.446
  672    HA   ALA  88           HA       ALA  88  -0.627   8.380  -6.743
  673    HB1  ALA  88           1HB      ALA  88   0.566   8.952  -8.745
  674    HB2  ALA  88           2HB      ALA  88  -0.066   7.311  -8.896
  675    HB3  ALA  88           3HB      ALA  88   1.643   7.571  -8.544
  676    H    ILE  89           H        ILE  89  -1.222   6.917  -5.159
  677    HA   ILE  89           HA       ILE  89   0.174   4.361  -5.024
  678    HB   ILE  89           HB       ILE  89  -0.385   5.130  -2.876
  679   HG12  ILE  89          2HG1      ILE  89  -2.644   3.234  -3.501
  680   HG13  ILE  89          1HG1      ILE  89  -0.964   2.721  -3.394
  681   HG21  ILE  89          1HG2      ILE  89  -1.956   6.849  -3.359
  682   HG22  ILE  89          2HG2      ILE  89  -2.709   5.737  -2.217
  683   HG23  ILE  89          3HG2      ILE  89  -3.148   5.679  -3.923
  684   HD11  ILE  89          3HD1      ILE  89  -2.339   2.369  -1.334
  685   HD12  ILE  89          1HD1      ILE  89  -2.410   4.123  -1.163
  686   HD13  ILE  89          2HD1      ILE  89  -0.855   3.291  -1.096
  687    H    SER  90           H        SER  90  -0.365   2.740  -6.345
  688    HA   SER  90           HA       SER  90  -2.961   2.809  -7.687
  689    HB2  SER  90           2HB      SER  90  -0.405   2.236  -8.553
  690    HB3  SER  90           1HB      SER  90  -1.133   0.640  -8.406
  691    HG   SER  90           HG       SER  90  -2.909   2.224  -9.575
  692    H    THR  91           H        THR  91  -4.591   1.781  -6.722
  693    HA   THR  91           HA       THR  91  -4.019  -0.693  -5.242
  694    HB   THR  91           HB       THR  91  -6.183  -0.370  -4.138
  695    HG1  THR  91           1HG      THR  91  -7.588   1.004  -4.875
  696   HG21  THR  91          3HG2      THR  91  -4.367   2.034  -4.036
  697   HG22  THR  91          1HG2      THR  91  -4.268   0.579  -3.044
  698   HG23  THR  91          2HG2      THR  91  -5.631   1.682  -2.856
  699    H    THR  92           H        THR  92  -6.291  -2.098  -5.283
  700    HA   THR  92           HA       THR  92  -6.782  -2.418  -8.175
  701    HB   THR  92           HB       THR  92  -5.506  -4.288  -7.478
  702    HG1  THR  92           1HG      THR  92  -8.049  -5.451  -7.343
  703   HG21  THR  92          3HG2      THR  92  -7.469  -4.563  -5.211
  704   HG22  THR  92          1HG2      THR  92  -5.742  -4.224  -5.106
  705   HG23  THR  92          2HG2      THR  92  -6.298  -5.804  -5.655
  706    HA   PRO  93           HA       PRO  93 -10.956  -1.216  -6.921
  707    HB2  PRO  93           2HB      PRO  93 -11.350  -1.723  -9.816
  708    HB3  PRO  93           1HB      PRO  93 -11.806  -0.322  -8.843
  709    HG2  PRO  93           2HG      PRO  93  -9.726  -0.259 -10.540
  710    HG3  PRO  93           1HG      PRO  93  -9.713   0.635  -9.018
  711    HD2  PRO  93           2HD      PRO  93  -8.276  -1.824  -9.761
  712    HD3  PRO  93           1HD      PRO  93  -7.820  -0.551  -8.623
  713    H    LEU  94           H        LEU  94 -13.133  -2.156  -7.526
  714    HA   LEU  94           HA       LEU  94 -13.220  -4.876  -6.816
  715    HB2  LEU  94           2HB      LEU  94 -15.691  -4.229  -7.938
  716    HB3  LEU  94           1HB      LEU  94 -15.265  -4.201  -6.253
  717    HG   LEU  94           HG       LEU  94 -14.513  -1.801  -6.614
  718   HD11  LEU  94          1HD1      LEU  94 -14.306  -1.529  -8.890
  719   HD12  LEU  94          2HD1      LEU  94 -15.888  -0.809  -8.583
  720   HD13  LEU  94          3HD1      LEU  94 -15.774  -2.445  -9.232
  721   HD21  LEU  94          3HD2      LEU  94 -16.809  -0.953  -6.455
  722   HD22  LEU  94          1HD2      LEU  94 -16.565  -2.377  -5.445
  723   HD23  LEU  94          2HD2      LEU  94 -17.420  -2.522  -6.981
  724    H    GLU  95           H        GLU  95 -14.359  -6.569  -8.032
  725    HA   GLU  95           HA       GLU  95 -14.513  -6.390 -10.885
  726    HB2  GLU  95           2HB      GLU  95 -12.810  -7.916 -11.507
  727    HB3  GLU  95           1HB      GLU  95 -12.044  -6.748 -10.450
  728    HG2  GLU  95           2HG      GLU  95 -13.083  -9.283  -9.294
  729    HG3  GLU  95           1HG      GLU  95 -11.570  -9.299 -10.197
  730    H    ASN  96           H        ASN  96 -15.429  -8.298 -11.828
  731    HA   ASN  96           HA       ASN  96 -17.246  -9.611 -10.020
  732    HB2  ASN  96           2HB      ASN  96 -18.176 -10.673 -12.046
  733    HB3  ASN  96           1HB      ASN  96 -18.069  -8.927 -12.208
  734   HD21  ASN  96          1HD2      ASN  96 -16.983  -8.091 -13.851
  735   HD22  ASN  96          2HD2      ASN  96 -16.054  -8.997 -14.993
  736    H1   SER 101           1HT      SER 101  -4.859 -16.270   0.861
  737    H2   SER 101           2HT      SER 101  -5.734 -17.018   2.101
  738    H3   SER 101           3HT      SER 101  -5.213 -17.921   0.769
  739    HA   SER 101           HA       SER 101  -3.883 -18.264   2.804
  740    HB2  SER 101           2HB      SER 101  -2.209 -17.030   0.631
  741    HB3  SER 101           1HB      SER 101  -1.887 -18.474   1.593
  742    HG   SER 101           HG       SER 101  -2.572 -19.265  -0.312
  743    H    TRP 102           H        TRP 102  -3.413 -17.236   4.617
  744    HA   TRP 102           HA       TRP 102  -1.682 -15.027   4.763
  745    HB2  TRP 102           2HB      TRP 102  -3.726 -13.828   3.965
  746    HB3  TRP 102           1HB      TRP 102  -4.567 -14.373   5.410
  747    HD1  TRP 102           HD       TRP 102  -1.286 -13.580   6.682
  748    HE1  TRP 102           1HE      TRP 102  -1.173 -11.189   7.619
  749    HE3  TRP 102           3HE      TRP 102  -5.531 -11.691   4.572
  750    HZ2  TRP 102           2HZ      TRP 102  -2.685  -8.811   7.479
  751    HZ3  TRP 102           3HZ      TRP 102  -6.118  -9.347   5.014
  752    HH2  TRP 102           HH       TRP 102  -4.728  -7.939   6.438
  753    H    GLU 103           H        GLU 103  -0.601 -15.576   6.519
  754    HA   GLU 103           HA       GLU 103  -1.919 -16.997   8.677
  755    HB2  GLU 103           2HB      GLU 103   0.975 -16.197   8.294
  756    HB3  GLU 103           1HB      GLU 103   0.374 -17.170   9.630
  757    HG2  GLU 103           2HG      GLU 103  -0.452 -18.812   7.912
  758    HG3  GLU 103           1HG      GLU 103   0.455 -17.886   6.718
  759    H    SER 104           H        SER 104   0.607 -14.590   9.106
  760    HA   SER 104           HA       SER 104  -1.240 -12.836  10.546
  761    HB2  SER 104           2HB      SER 104   1.446 -13.606  11.696
  762    HB3  SER 104           1HB      SER 104   0.144 -12.719  12.484
  763    HG   SER 104           HG       SER 104  -0.720 -15.132  11.607
  764    H    HIS 105           H        HIS 105   0.761 -11.051  11.484
  765    HA   HIS 105           HA       HIS 105   1.867 -10.107   8.925
  766    HB2  HIS 105           2HB      HIS 105   0.144  -8.588   9.691
  767    HB3  HIS 105           1HB      HIS 105   0.875  -8.498  11.288
  768    HD2  HIS 105           2HD      HIS 105   1.134  -5.721  10.944
  769    HE1  HIS 105           1HE      HIS 105   4.210  -6.065   8.063
  770    HE2  HIS 105           2HE      HIS 105   3.174  -4.568   9.823
  771    H    LYS 106           H        LYS 106   3.879 -10.934   9.018
  772    HA   LYS 106           HA       LYS 106   5.612  -9.878  11.145
  773    HB2  LYS 106           2HB      LYS 106   5.602 -12.678  10.015
  774    HB3  LYS 106           1HB      LYS 106   6.966 -12.011  10.904
  775    HG2  LYS 106           2HG      LYS 106   5.341 -11.574  12.794
  776    HG3  LYS 106           1HG      LYS 106   4.193 -12.578  11.905
  777    HD2  LYS 106           2HD      LYS 106   5.761 -14.443  11.969
  778    HD3  LYS 106           1HD      LYS 106   6.940 -13.437  12.818
  779    HE2  LYS 106           2HE      LYS 106   5.803 -14.838  14.414
  780    HE3  LYS 106           1HE      LYS 106   5.306 -13.169  14.663
  781    HZ1  LYS 106           3HZ      LYS 106   3.435 -14.698  14.757
  782    HZ2  LYS 106           1HZ      LYS 106   3.753 -15.214  13.178
  783    HZ3  LYS 106           2HZ      LYS 106   3.272 -13.619  13.466
  784    H    SER 107           H        SER 107   4.862  -9.115   8.394
  785    HA   SER 107           HA       SER 107   7.305  -9.492   6.864
  786    HB2  SER 107           2HB      SER 107   5.318  -7.652   5.763
  787    HB3  SER 107           1HB      SER 107   5.997  -9.124   5.067
  788    HG   SER 107           HG       SER 107   3.605  -8.745   6.293
  789    H    GLY 108           H        GLY 108   6.544  -7.587   9.330
  790    HA2  GLY 108           2HA      GLY 108   8.554  -5.866   9.403
  791    HA3  GLY 108           1HA      GLY 108   7.490  -5.049   8.266
  792    H    GLY 109           H        GLY 109   7.599  -3.383  10.003
  793    HA2  GLY 109           2HA      GLY 109   6.079  -3.960  12.406
  794    HA3  GLY 109           1HA      GLY 109   6.846  -2.433  11.994
  795    H    GLU 110           H        GLU 110   5.123  -1.106  12.362
  796    HA   GLU 110           HA       GLU 110   2.868  -1.403  10.492
  797    HB2  GLU 110           2HB      GLU 110   2.721  -0.631  13.418
  798    HB3  GLU 110           1HB      GLU 110   1.378  -0.507  12.289
  799    HG2  GLU 110           2HG      GLU 110   1.242  -2.844  12.040
  800    HG3  GLU 110           1HG      GLU 110   2.800  -3.095  12.822
  801    H    THR 111           H        THR 111   5.169   0.095  10.072
  802    HA   THR 111           HA       THR 111   4.856   2.828  10.804
  803    HB   THR 111           HB       THR 111   6.415   1.751   8.451
  804    HG1  THR 111           1HG      THR 111   6.950   1.701  11.227
  805   HG21  THR 111          3HG2      THR 111   7.848   3.688   8.836
  806   HG22  THR 111          1HG2      THR 111   6.853   4.170  10.212
  807   HG23  THR 111          2HG2      THR 111   6.179   4.201   8.582
  808    H    ARG 112           H        ARG 112   3.034   3.817  10.204
  809    HA   ARG 112           HA       ARG 112   1.915   3.312   7.557
  810    HB2  ARG 112           2HB      ARG 112  -0.025   4.648   8.439
  811    HB3  ARG 112           1HB      ARG 112   0.307   3.149   9.299
  812    HG2  ARG 112           2HG      ARG 112   0.902   4.215  11.202
  813    HG3  ARG 112           1HG      ARG 112   1.599   5.590  10.345
  814    HD2  ARG 112           2HD      ARG 112  -1.359   5.056  10.545
  815    HD3  ARG 112           1HD      ARG 112  -0.473   6.111  11.649
  816    HE   ARG 112           HE       ARG 112   0.114   7.010   9.099
  817   HH11  ARG 112          1HH1      ARG 112  -2.765   6.612  11.056
  818   HH12  ARG 112          2HH1      ARG 112  -3.587   7.952  10.329
  819   HH21  ARG 112          1HH2      ARG 112  -0.967   8.749   8.135
  820   HH22  ARG 112          2HH2      ARG 112  -2.576   9.178   8.678
  821    H    LEU 113           H        LEU 113   0.920   5.213   6.460
  822    HA   LEU 113           HA       LEU 113   2.915   7.335   6.239
  823    HB2  LEU 113           2HB      LEU 113   0.695   6.356   4.449
  824    HB3  LEU 113           1HB      LEU 113   1.518   7.868   4.150
  825    HG   LEU 113           HG       LEU 113   2.507   6.274   2.706
  826   HD11  LEU 113          1HD1      LEU 113   4.805   6.170   3.428
  827   HD12  LEU 113          2HD1      LEU 113   4.323   6.530   5.085
  828   HD13  LEU 113          3HD1      LEU 113   4.103   7.741   3.820
  829   HD21  LEU 113          3HD2      LEU 113   3.395   4.137   3.439
  830   HD22  LEU 113          1HD2      LEU 113   1.674   4.258   3.805
  831   HD23  LEU 113          2HD2      LEU 113   2.866   4.465   5.089