*HEADER    SIGNALING PROTEIN                       10-JAN-06   2FN5              
*TITLE     NMR STRUCTURE OF THE NEURABIN PDZ DOMAIN (502-594)                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEURABIN-1;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: PDZ DOMAIN;                                                
*COMPND   5 SYNONYM: NEURABIN-I, NEURAL TISSUE-SPECIFIC F-ACTIN                  
*COMPND   6 BINDING PROTEIN I, PROTEIN PHOSPHATASE 1 REGULATORY                  
*COMPND   7 SUBUNIT 9A, P180, PP1BP175;                                          
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS;                              
*SOURCE   3 ORGANISM_COMMON: RAT;                                                
*SOURCE   4 GENE: PPP1R9A;                                                       
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   8 EXPRESSION_SYSTEM_CELL_LINE: IRL;                                    
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: RP1B                                      
*KEYWDS    PDZ, NEURABIN                                                         
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    B.DANCHECK, W.PETI                                                    
*REVDAT   1   09-JAN-07 2FN5    0                                                


! Distance constraint file from RADAR
! RADAR version 0.9b 
! File format   : cns
! File generated: 2005 November 16th, 19:57:22

assign  ((resid   41 and name HB   )) ((resid   42 and name HN   ))   3.07  1.27  0.00 ! #SUP  0.92
assign  ((resid   20 and name HN   )) ((resid   41 and name HB   ))   3.96  2.16  0.00 ! #SUP  0.78
assign  ((resid   41 and name HN   )) ((resid   41 and name HB   ))   3.63  1.83  0.00 ! #SUP  0.98
assign  ((resid   41 and name HB   )) ((resid   42 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   72 and name HB   )) ((resid   73 and name HB1  ))   4.52  2.72  0.00 ! #SUP  0.86
assign  ((resid   72 and name HB   )) ((resid   75 and name HN   ))   3.93  2.13  0.00 ! #SUP  0.77
assign  ((resid   72 and name HA   )) ((resid   72 and name HB   ))   2.81  1.01  0.00 ! #SUP  0.97
assign  ((resid   83 and name HB   )) ((resid   87 and name HG2* ))   3.43  1.63  0.00 ! #SUP  0.98
assign  ((resid   43 and name HB   )) ((resid   44 and name HN   ))   4.16  2.36  0.00 ! #SUP  0.99
assign  ((resid   43 and name HB   )) ((resid   46 and name HN   ))   5.38  3.58  0.00 ! #SUP  0.99
assign  ((resid   79 and name HA   )) ((resid   82 and name HD21 ))   4.26  2.46  0.00 ! #SUP  0.95
assign  ((resid   79 and name HA   )) ((resid   82 and name HB1  ))   4.23  2.43  0.00 ! #SUP  0.96
assign  ((resid   66 and name HD1* )) ((resid   79 and name HA   ))   3.92  2.12  0.00 ! #SUP  0.99
assign  ((resid   20 and name HB2  )) ((resid   21 and name HN   ))   4.11  2.31  0.00 ! #SUP  1.00
assign  ((resid   20 and name HN   )) ((resid   20 and name HB2  ))   3.91  2.11  0.00 ! #SUP  0.99
assign  ((resid   20 and name HB2  )) ((resid   41 and name HG2* ))   4.19  2.39  0.00 ! #SUP  0.87
assign  ((resid   20 and name HN   )) ((resid   20 and name HB1  ))   3.96  2.16  0.00 ! #SUP  0.99
assign  ((resid   56 and name HA   )) ((resid   58 and name HN   ))   4.00  2.20  0.00 ! #SUP  0.76
assign  ((resid   55 and name HA   )) ((resid   56 and name HA   ))   4.47  2.67  0.00 ! #SUP  0.92
assign  ((resid   35 and name HD2* )) ((resid   61 and name HA   ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid    6 and name HN   )) ((resid   90 and name HA   ))   4.42  2.62  0.00 ! #SUP  0.73
assign  ((resid   90 and name HA   )) ((resid   91 and name HG11 ))   4.94  3.14  0.00 ! #SUP  0.82
assign  ((resid   90 and name HA   )) ((resid   90 and name HG1* ))   2.87  1.07  0.00 ! #SUP  0.93
assign  ((resid   39 and name HA   )) ((resid   41 and name HN   ))   4.19  2.39  0.00 ! #SUP  0.95
assign  ((resid   21 and name HB   )) ((resid   39 and name HA   ))   4.79  2.99  0.00 ! #SUP  0.55
assign  ((resid   62 and name HA   )) ((resid   67 and name HB2  ))   5.36  3.56  0.00 ! #SUP  0.82
assign  ((resid   69 and name HA   )) ((resid   71 and name HN   ))   5.00  3.20  0.00 ! #SUP  0.91
assign  ((resid   54 and name HA   )) ((resid   55 and name HN   ))   2.64  0.84  0.00 ! #SUP  0.68
assign  ((resid   54 and name HA   )) ((resid   54 and name HG11 ))   3.25  1.45  0.00 ! #SUP  0.76
assign  ((resid   83 and name HG2* )) ((resid   87 and name HA   ))   4.67  2.87  0.00 ! #SUP  0.96
assign  ((resid   75 and name HA   )) ((resid   78 and name HN   ))   3.76  1.96  0.00 ! #SUP  0.57
assign  ((resid   75 and name HA   )) ((resid   75 and name HB2  ))   2.86  1.06  0.00 ! #SUP  0.91
assign  ((resid   75 and name HA   )) ((resid   78 and name HG2* ))   4.23  2.43  0.00 ! #SUP  0.72
assign  ((resid   83 and name HA   )) ((resid   84 and name HB*  ))   4.93  3.13  0.00 ! #SUP  0.55
assign  ((resid   83 and name HA   )) ((resid   84 and name HN   ))   2.65  0.85  0.00 ! #SUP  0.82
assign  ((resid    7 and name HA   )) ((resid   89 and name HN   ))   4.83  3.03  0.00 ! #SUP  0.88
assign  ((resid   26 and name HA   )) ((resid   26 and name HB   ))   2.84  1.04  0.00 ! #SUP  0.83
assign  ((resid   87 and name HA   )) ((resid   88 and name HN   ))   2.70  0.90  0.00 ! #SUP  0.82
assign  ((resid   87 and name HA   )) ((resid   87 and name HG2* ))   3.20  1.40  0.00 ! #SUP  0.99
assign  ((resid    7 and name HA   )) ((resid   91 and name HN   ))   4.34  2.54  0.00 ! #SUP  0.95
assign  ((resid    7 and name HA   )) ((resid    8 and name HB   ))   4.74  2.94  0.00 ! #SUP  0.90
assign  ((resid   41 and name HN   )) ((resid   42 and name HA   ))   4.87  3.07  0.00 ! #SUP  0.89
assign  ((resid   19 and name HG2* )) ((resid   42 and name HA   ))   3.10  1.30  0.00 ! #SUP  0.94
assign  ((resid   60 and name HA   )) ((resid   60 and name HG2* ))   2.97  1.17  0.00 ! #SUP  0.98
assign  ((resid   60 and name HA   )) ((resid   62 and name HN   ))   4.05  2.25  0.00 ! #SUP  0.89
assign  ((resid   62 and name HA   )) ((resid   63 and name HA   ))   4.77  2.97  0.00 ! #SUP  0.59
assign  ((resid   39 and name HG1* )) ((resid   41 and name HA   ))   4.12  2.32  0.00 ! #SUP  0.95
assign  ((resid   72 and name HA   )) ((resid   73 and name HN   ))   2.77  0.97  0.00 ! #SUP  0.86
assign  ((resid   72 and name HA   )) ((resid   75 and name HN   ))   4.91  3.11  0.00 ! #SUP  0.95
assign  ((resid   72 and name HA   )) ((resid   73 and name HB1  ))   4.74  2.94  0.00 ! #SUP  0.97
assign  ((resid   66 and name HA   )) ((resid   66 and name HG11 ))   3.37  1.57  0.00 ! #SUP  0.96
assign  ((resid   66 and name HA   )) ((resid   66 and name HG12 ))   3.37  1.57  0.00 ! #SUP  0.97
assign  ((resid   72 and name HA   )) ((resid   73 and name HA   ))   4.50  2.70  0.00 ! #SUP  1.00
assign  ((resid   21 and name HD1* )) ((resid   73 and name HA   ))   3.37  1.57  0.00 ! #SUP  0.97
assign  ((resid   21 and name HA   )) ((resid   40 and name HN   ))   3.11  1.31  0.00 ! #SUP  0.75
assign  ((resid   21 and name HA   )) ((resid   37 and name HG2* ))   4.49  2.69  0.00 ! #SUP  0.99
assign  ((resid   14 and name HA   )) ((resid   14 and name HG*  ))   3.36  1.56  0.00 ! #SUP  0.99
assign  ((resid   14 and name HA   )) ((resid   14 and name HB*  ))   2.48  0.68  0.00 ! #SUP  0.98
assign  ((resid   14 and name HA   )) ((resid   15 and name HN   ))   3.49  1.69  0.00 ! #SUP  0.99
assign  ((resid   14 and name HA   )) ((resid   16 and name HN   ))   4.20  2.40  0.00 ! #SUP  0.82
assign  ((resid   42 and name HG2* )) ((resid   49 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.70
assign  ((resid   19 and name HA   )) ((resid   20 and name HN   ))   2.80  1.00  0.00 ! #SUP  0.86
assign  ((resid   63 and name HN   )) ((resid   67 and name HA   ))   4.32  2.52  0.00 ! #SUP  0.96
assign  ((resid   81 and name HA   )) ((resid   81 and name HD*  ))   4.09  2.29  0.00 ! #SUP  0.84
assign  ((resid   81 and name HA   )) ((resid   81 and name HG1  ))   3.91  2.11  0.00 ! #SUP  0.72
assign  ((resid   71 and name HA   )) ((resid   75 and name HB2  ))   4.98  3.18  0.00 ! #SUP  0.74
assign  ((resid   71 and name HA   )) ((resid   75 and name HB1  ))   5.22  3.42  0.00 ! #SUP  0.74
assign  ((resid   71 and name HA   )) ((resid   71 and name HB   ))   2.82  1.02  0.00 ! #SUP  0.98
assign  ((resid   71 and name HA   )) ((resid   71 and name HG2* ))   3.29  1.49  0.00 ! #SUP  1.00
assign  ((resid   11 and name HA   )) ((resid   12 and name HA   ))   4.79  2.99  0.00 ! #SUP  0.69
assign  ((resid   12 and name HA   )) ((resid   13 and name HN   ))   2.72  0.92  0.00 ! #SUP  0.74
assign  ((resid   12 and name HA   )) ((resid   12 and name HG2  ))   3.51  1.71  0.00 ! #SUP  0.99
assign  ((resid   37 and name HA   )) ((resid   38 and name HN   ))   2.83  1.03  0.00 ! #SUP  0.81
assign  ((resid   23 and name HA1  )) ((resid   37 and name HA   ))   4.62  2.82  0.00 ! #SUP  0.84
assign  ((resid   40 and name HA   )) ((resid   40 and name HG*  ))   3.09  1.29  0.00 ! #SUP  0.59
assign  ((resid   39 and name HG1* )) ((resid   40 and name HA   ))   5.12  3.32  0.00 ! #SUP  0.96
assign  ((resid   20 and name HA   )) ((resid   21 and name HG11 ))   4.28  2.48  0.00 ! #SUP  0.57
assign  ((resid   33 and name HA   )) ((resid   33 and name HG2  ))   3.53  1.73  0.00 ! #SUP  0.83
assign  ((resid   32 and name HB1  )) ((resid   33 and name HA   ))   5.24  3.44  0.00 ! #SUP  0.54
assign  ((resid   17 and name HA   )) ((resid   17 and name HD2* ))   4.13  2.33  0.00 ! #SUP  0.45
assign  ((resid   58 and name HA   )) ((resid   59 and name HN   ))   3.44  1.64  0.00 ! #SUP  0.94
assign  ((resid    2 and name HA   )) ((resid    3 and name HN   ))   3.02  1.22  0.00 ! #SUP  0.58
assign  ((resid    2 and name HA   )) ((resid    2 and name HB*  ))   2.92  1.12  0.00 ! #SUP  1.00
assign  ((resid   37 and name HG2* )) ((resid   38 and name HA   ))   4.05  2.25  0.00 ! #SUP  0.94
assign  ((resid    3 and name HA   )) ((resid    4 and name HB2  ))   4.61  2.81  0.00 ! #SUP  0.89
assign  ((resid   64 and name HA   )) ((resid   65 and name HN   ))   3.05  1.25  0.00 ! #SUP  0.82
assign  ((resid   64 and name HA   )) ((resid   88 and name HB2  ))   3.71  1.91  0.00 ! #SUP  0.75
assign  ((resid   47 and name HA   )) ((resid   50 and name HN   ))   4.15  2.35  0.00 ! #SUP  0.70
assign  ((resid   37 and name HB   )) ((resid   38 and name HA   ))   5.43  3.63  0.00 ! #SUP  0.99
assign  ((resid   38 and name HA   )) ((resid   39 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   38 and name HA   )) ((resid   60 and name HN   ))   3.42  1.62  0.00 ! #SUP  0.71
assign  ((resid   34 and name HA   )) ((resid   35 and name HA   ))   4.48  2.68  0.00 ! #SUP  0.76
assign  ((resid    4 and name HA   )) ((resid    5 and name HD1* ))   4.19  2.39  0.00 ! #SUP  0.87
assign  ((resid    9 and name HA   )) ((resid    9 and name HG*  ))   3.15  1.35  0.00 ! #SUP  0.97
assign  ((resid    9 and name HA   )) ((resid   10 and name HB2  ))   4.59  2.79  0.00 ! #SUP  0.98
assign  ((resid    8 and name HG1* )) ((resid    9 and name HA   ))   4.46  2.66  0.00 ! #SUP  0.91
assign  ((resid    8 and name HB   )) ((resid    9 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid    9 and name HA   )) ((resid   88 and name HB2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   63 and name HN   ))   2.58  0.78  0.00 ! #SUP  0.72
assign  ((resid   60 and name HG2* )) ((resid   62 and name HA   ))   4.22  2.42  0.00 ! #SUP  0.98
assign  ((resid   23 and name HA2  )) ((resid   24 and name HA   ))   4.51  2.71  0.00 ! #SUP  0.95
assign  ((resid   35 and name HA   )) ((resid   35 and name HB*  ))   2.92  1.12  0.00 ! #SUP  0.99
assign  ((resid   77 and name HA   )) ((resid   81 and name HN   ))   4.71  2.91  0.00 ! #SUP  0.89
assign  ((resid   77 and name HA   )) ((resid   80 and name HN   ))   4.22  2.42  0.00 ! #SUP  0.90
assign  ((resid   34 and name HA   )) ((resid   34 and name HB1  ))   2.97  1.17  0.00 ! #SUP  0.78
assign  ((resid   48 and name HA   )) ((resid   54 and name HD1* ))   4.69  2.89  0.00 ! #SUP  0.94
assign  ((resid   11 and name HA   )) ((resid   11 and name HG*  ))   3.44  1.64  0.00 ! #SUP  0.76
assign  ((resid   11 and name HA   )) ((resid   87 and name HN   ))   4.20  2.40  0.00 ! #SUP  0.76
assign  ((resid   29 and name HA   )) ((resid   29 and name HB2  ))   3.02  1.22  0.00 ! #SUP  0.97
assign  ((resid   29 and name HA   )) ((resid   29 and name HB1  ))   3.02  1.22  0.00 ! #SUP  1.00
assign  ((resid    5 and name HA   )) ((resid    6 and name HA   ))   4.64  2.84  0.00 ! #SUP  0.85
assign  ((resid    6 and name HA   )) ((resid    7 and name HD2  ))   2.87  1.07  0.00 ! #SUP  0.99
assign  ((resid    6 and name HA   )) ((resid    7 and name HD1  ))   2.77  0.97  0.00 ! #SUP  0.98
assign  ((resid    6 and name HA   )) ((resid    6 and name HB2  ))   2.92  1.12  0.00 ! #SUP  0.99
assign  ((resid    6 and name HA   )) ((resid    6 and name HB1  ))   2.97  1.17  0.00 ! #SUP  1.00
assign  ((resid    6 and name HA   )) ((resid    7 and name HG1  ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid    5 and name HA   )) ((resid    6 and name HN   ))   2.67  0.87  0.00 ! #SUP  0.86
assign  ((resid    5 and name HA   )) ((resid    6 and name HD*  ))   4.22  2.42  0.00 ! #SUP  0.97
assign  ((resid    5 and name HA   )) ((resid   92 and name HA2  ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid    5 and name HA   )) ((resid   92 and name HA1  ))   3.90  2.10  0.00 ! #SUP  0.99
assign  ((resid    5 and name HA   )) ((resid    5 and name HG   ))   3.71  1.91  0.00 ! #SUP  0.98
assign  ((resid   86 and name HA   )) ((resid   87 and name HN   ))   2.56  0.76  0.00 ! #SUP  0.76
assign  ((resid   12 and name HN   )) ((resid   86 and name HA   ))   3.87  2.07  0.00 ! #SUP  0.85
assign  ((resid   11 and name HA   )) ((resid   86 and name HA   ))   3.00  1.20  0.00 ! #SUP  0.86
assign  ((resid    9 and name HG*  )) ((resid   86 and name HA   ))   4.36  2.56  0.00 ! #SUP  0.89
assign  ((resid   10 and name HA   )) ((resid   10 and name HG   ))   3.85  2.05  0.00 ! #SUP  0.99
assign  ((resid   55 and name HA   )) ((resid   56 and name HN   ))   2.77  0.97  0.00 ! #SUP  0.77
assign  ((resid   42 and name HG1* )) ((resid   55 and name HA   ))   5.28  3.48  0.00 ! #SUP  0.96
assign  ((resid   28 and name HA   )) ((resid   29 and name HN   ))   3.44  1.64  0.00 ! #SUP  0.95
assign  ((resid    6 and name HB2  )) ((resid    7 and name HD2  ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid    6 and name HD*  )) ((resid    7 and name HD1  ))   5.01  3.21  0.00 ! #SUP  0.99
assign  ((resid    6 and name HB2  )) ((resid    7 and name HD1  ))   3.94  2.14  0.00 ! #SUP  0.89
assign  ((resid   85 and name HA2  )) ((resid   86 and name HA   ))   4.87  3.07  0.00 ! #SUP  0.95
assign  ((resid   84 and name HB*  )) ((resid   85 and name HA1  ))   4.43  2.63  0.00 ! #SUP  0.72
assign  ((resid   84 and name HA   )) ((resid   85 and name HA2  ))   4.58  2.78  0.00 ! #SUP  0.73
assign  ((resid   12 and name HB2  )) ((resid   85 and name HA2  ))   3.82  2.02  0.00 ! #SUP  0.46
assign  ((resid   10 and name HB2  )) ((resid   10 and name HD1* ))   3.33  1.53  0.00 ! #SUP  1.00
assign  ((resid   10 and name HB1  )) ((resid   11 and name HN   ))   3.74  1.94  0.00 ! #SUP  0.99
assign  ((resid   10 and name HB1  )) ((resid   10 and name HD1* ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   10 and name HB1  )) ((resid   10 and name HD2* ))   3.21  1.41  0.00 ! #SUP  0.99
assign  ((resid   26 and name HG1* )) ((resid   27 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid   26 and name HG2* )) ((resid   27 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid   65 and name HN   )) ((resid   65 and name HA2  ))   2.77  0.97  0.00 ! #SUP  0.80
assign  ((resid   30 and name HB*  )) ((resid   31 and name HA1  ))   5.06  3.26  0.00 ! #SUP  0.78
assign  ((resid   25 and name HA2  )) ((resid   36 and name HN   ))   4.66  2.86  0.00 ! #SUP  0.76
assign  ((resid   12 and name HB1  )) ((resid   16 and name HA2  ))   4.21  2.41  0.00 ! #SUP  0.21
assign  ((resid   62 and name HG*  )) ((resid   65 and name HA1  ))   4.06  2.26  0.00 ! #SUP  0.73
assign  ((resid   12 and name HB2  )) ((resid   16 and name HA2  ))   4.69  2.89  0.00 ! #SUP  0.51
assign  ((resid   23 and name HA2  )) ((resid   38 and name HN   ))   4.20  2.40  0.00 ! #SUP  0.81
assign  ((resid   23 and name HA2  )) ((resid   37 and name HA   ))   3.72  1.92  0.00 ! #SUP  0.96
assign  ((resid   23 and name HA1  )) ((resid   24 and name HN   ))   3.50  1.70  0.00 ! #SUP  0.98
assign  ((resid    8 and name HG2* )) ((resid   53 and name HD2  ))   3.87  2.07  0.00 ! #SUP  0.84
assign  ((resid    3 and name HG*  )) ((resid   92 and name HA1  ))   4.07  2.27  0.00 ! #SUP  0.95
assign  ((resid   61 and name HG1* )) ((resid   92 and name HA1  ))   5.45  3.65  0.00 ! #SUP  0.68
assign  ((resid   17 and name HB2  )) ((resid   19 and name HG2* ))   4.41  2.61  0.00 ! #SUP  0.95
assign  ((resid   17 and name HB2  )) ((resid   19 and name HD1* ))   4.55  2.75  0.00 ! #SUP  0.93
assign  ((resid   17 and name HB1  )) ((resid   19 and name HG2* ))   4.41  2.61  0.00 ! #SUP  0.92
assign  ((resid   17 and name HB1  )) ((resid   19 and name HD1* ))   4.55  2.75  0.00 ! #SUP  0.99
assign  ((resid   36 and name HA1  )) ((resid   37 and name HN   ))   3.52  1.72  0.00 ! #SUP  0.90
assign  ((resid   48 and name HA   )) ((resid   51 and name HB1  ))   4.00  2.20  0.00 ! #SUP  0.92
assign  ((resid   10 and name HD2* )) ((resid   51 and name HB1  ))   4.14  2.34  0.00 ! #SUP  0.77
assign  ((resid    5 and name HB2  )) ((resid    6 and name HN   ))   4.38  2.58  0.00 ! #SUP  0.98
assign  ((resid    5 and name HB1  )) ((resid    6 and name HN   ))   3.71  1.91  0.00 ! #SUP  0.97
assign  ((resid    5 and name HB1  )) ((resid    5 and name HD1* ))   2.89  1.09  0.00 ! #SUP  0.97
assign  ((resid   81 and name HN   )) ((resid   81 and name HD*  ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   81 and name HB1  )) ((resid   81 and name HD*  ))   3.42  1.62  0.00 ! #SUP  0.66
assign  ((resid   88 and name HA   )) ((resid   88 and name HD*  ))   3.96  2.16  0.00 ! #SUP  0.97
assign  ((resid   64 and name HA   )) ((resid   88 and name HD*  ))   4.72  2.92  0.00 ! #SUP  0.94
assign  ((resid   88 and name HB2  )) ((resid   88 and name HD*  ))   2.72  0.92  0.00 ! #SUP  0.90
assign  ((resid   88 and name HG1  )) ((resid   88 and name HD*  ))   2.65  0.85  0.00 ! #SUP  1.00
assign  ((resid   88 and name HG2  )) ((resid   88 and name HD*  ))   2.93  1.13  0.00 ! #SUP  1.00
assign  ((resid    8 and name HB   )) ((resid   89 and name HB2  ))   3.11  1.31  0.00 ! #SUP  0.64
assign  ((resid    8 and name HG1* )) ((resid   89 and name HB2  ))   4.13  2.33  0.00 ! #SUP  0.99
assign  ((resid   60 and name HG2* )) ((resid   89 and name HB1  ))   4.66  2.86  0.00 ! #SUP  0.75
assign  ((resid   38 and name HN   )) ((resid   38 and name HB1  ))   3.87  2.07  0.00 ! #SUP  0.99
assign  ((resid   38 and name HB1  )) ((resid   39 and name HN   ))   3.54  1.74  0.00 ! #SUP  0.92
assign  ((resid   19 and name HN   )) ((resid   19 and name HB   ))   3.84  2.04  0.00 ! #SUP  0.99
assign  ((resid   35 and name HN   )) ((resid   35 and name HB*  ))   2.95  1.15  0.00 ! #SUP  0.83
assign  ((resid   35 and name HB*  )) ((resid   35 and name HD2* ))   2.92  1.12  0.00 ! #SUP  0.73
assign  ((resid   22 and name HN   )) ((resid   22 and name HB   ))   3.77  1.97  0.00 ! #SUP  0.98
assign  ((resid   30 and name HB*  )) ((resid   32 and name HB2  ))   4.10  2.30  0.00 ! #SUP  0.69
assign  ((resid   34 and name HG2  )) ((resid   34 and name HE*  ))   3.42  1.62  0.00 ! #SUP  0.76
assign  ((resid   58 and name HB2  )) ((resid   91 and name HG2* ))   3.14  1.34  0.00 ! #SUP  0.88
assign  ((resid   58 and name HN   )) ((resid   58 and name HB2  ))   3.65  1.85  0.00 ! #SUP  0.92
assign  ((resid   28 and name HB*  )) ((resid   29 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.84
assign  ((resid   58 and name HB1  )) ((resid   91 and name HG2* ))   3.14  1.34  0.00 ! #SUP  0.91
assign  ((resid   80 and name HB1  )) ((resid   80 and name HD1* ))   3.03  1.23  0.00 ! #SUP  0.93
assign  ((resid   68 and name HB2  )) ((resid   71 and name HB   ))   4.78  2.98  0.00 ! #SUP  0.67
assign  ((resid   86 and name HB*  )) ((resid   87 and name HN   ))   3.72  1.92  0.00 ! #SUP  0.99
assign  ((resid   86 and name HB*  )) ((resid   86 and name HD21 ))   3.69  1.89  0.00 ! #SUP  1.00
assign  ((resid   86 and name HB*  )) ((resid   86 and name HD22 ))   3.69  1.89  0.00 ! #SUP  0.98
assign  ((resid   86 and name HA   )) ((resid   86 and name HB*  ))   2.69  0.89  0.00 ! #SUP  0.99
assign  ((resid   11 and name HA   )) ((resid   86 and name HB*  ))   4.70  2.90  0.00 ! #SUP  1.00
assign  ((resid    9 and name HG*  )) ((resid   86 and name HB*  ))   3.48  1.68  0.00 ! #SUP  0.65
assign  ((resid   68 and name HB2  )) ((resid   71 and name HG1* ))   4.35  2.55  0.00 ! #SUP  0.96
assign  ((resid   68 and name HB1  )) ((resid   71 and name HG1* ))   4.82  3.02  0.00 ! #SUP  0.90
assign  ((resid   68 and name HB1  )) ((resid   68 and name HD2* ))   3.50  1.70  0.00 ! #SUP  0.91
assign  ((resid   75 and name HN   )) ((resid   75 and name HB2  ))   2.89  1.09  0.00 ! #SUP  0.77
assign  ((resid   71 and name HB   )) ((resid   75 and name HB2  ))   3.54  1.74  0.00 ! #SUP  0.99
assign  ((resid   72 and name HN   )) ((resid   75 and name HB2  ))   3.44  1.64  0.00 ! #SUP  0.81
assign  ((resid   71 and name HG2* )) ((resid   75 and name HB1  ))   3.93  2.13  0.00 ! #SUP  0.96
assign  ((resid   64 and name HN   )) ((resid   64 and name HB2  ))   4.11  2.31  0.00 ! #SUP  0.96
assign  ((resid   64 and name HN   )) ((resid   64 and name HB1  ))   4.11  2.31  0.00 ! #SUP  0.99
assign  ((resid    6 and name HN   )) ((resid    6 and name HB2  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid    6 and name HB1  )) ((resid    7 and name HD2  ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   82 and name HB2  )) ((resid   82 and name HD21 ))   3.47  1.67  0.00 ! #SUP  0.98
assign  ((resid   54 and name HN   )) ((resid   54 and name HB   ))   3.14  1.34  0.00 ! #SUP  0.90
assign  ((resid   74 and name HN   )) ((resid   74 and name HB2  ))   3.74  1.94  0.00 ! #SUP  0.98
assign  ((resid   74 and name HB2  )) ((resid   75 and name HN   ))   4.29  2.49  0.00 ! #SUP  0.99
assign  ((resid   74 and name HN   )) ((resid   74 and name HB1  ))   3.74  1.94  0.00 ! #SUP  0.98
assign  ((resid   74 and name HB1  )) ((resid   75 and name HN   ))   4.29  2.49  0.00 ! #SUP  0.98
assign  ((resid    8 and name HB   )) ((resid   89 and name HB1  ))   3.65  1.85  0.00 ! #SUP  0.90
assign  ((resid    8 and name HB   )) ((resid   91 and name HD1* ))   4.67  2.87  0.00 ! #SUP  0.98
assign  ((resid    8 and name HB   )) ((resid   54 and name HD1* ))   4.22  2.42  0.00 ! #SUP  0.90
assign  ((resid   57 and name HN   )) ((resid   57 and name HB1  ))   4.11  2.31  0.00 ! #SUP  0.99
assign  ((resid   57 and name HB1  )) ((resid   58 and name HN   ))   4.43  2.63  0.00 ! #SUP  0.85
assign  ((resid   62 and name HG*  )) ((resid   65 and name HA2  ))   4.15  2.35  0.00 ! #SUP  0.80
assign  ((resid   62 and name HG*  )) ((resid   63 and name HN   ))   3.68  1.88  0.00 ! #SUP  0.94
assign  ((resid   62 and name HG*  )) ((resid   66 and name HN   ))   4.00  2.20  0.00 ! #SUP  0.94
assign  ((resid   62 and name HG*  )) ((resid   67 and name HA   ))   3.63  1.83  0.00 ! #SUP  0.84
assign  ((resid   91 and name HB   )) ((resid   91 and name HD1* ))   3.94  2.14  0.00 ! #SUP  0.98
assign  ((resid   33 and name HN   )) ((resid   33 and name HG1  ))   4.29  2.49  0.00 ! #SUP  0.76
assign  ((resid    9 and name HN   )) ((resid    9 and name HG*  ))   4.23  2.43  0.00 ! #SUP  0.91
assign  ((resid    9 and name HG*  )) ((resid   88 and name HG1  ))   3.48  1.68  0.00 ! #SUP  0.84
assign  ((resid    9 and name HG*  )) ((resid   88 and name HD*  ))   4.04  2.24  0.00 ! #SUP  0.89
assign  ((resid   37 and name HB   )) ((resid   60 and name HB   ))   3.96  2.16  0.00 ! #SUP  0.69
assign  ((resid   14 and name HN   )) ((resid   14 and name HG*  ))   3.11  1.31  0.00 ! #SUP  0.94
assign  ((resid   14 and name HG*  )) ((resid   15 and name HN   ))   3.45  1.65  0.00 ! #SUP  0.88
assign  ((resid   14 and name HB*  )) ((resid   14 and name HG*  ))   2.40  0.60  0.00 ! #SUP  0.94
assign  ((resid   24 and name HB*  )) ((resid   25 and name HN   ))   3.86  2.06  0.00 ! #SUP  0.93
assign  ((resid    4 and name HN   )) ((resid    4 and name HG2  ))   4.87  3.07  0.00 ! #SUP  0.98
assign  ((resid    4 and name HG2  )) ((resid    6 and name HD*  ))   4.06  2.26  0.00 ! #SUP  0.98
assign  ((resid    4 and name HG1  )) ((resid    5 and name HN   ))   3.96  2.16  0.00 ! #SUP  0.86
assign  ((resid    4 and name HG1  )) ((resid    6 and name HD*  ))   4.04  2.24  0.00 ! #SUP  0.87
assign  ((resid   37 and name HN   )) ((resid   37 and name HB   ))   3.47  1.67  0.00 ! #SUP  0.93
assign  ((resid   11 and name HG*  )) ((resid   86 and name HA   ))   4.55  2.75  0.00 ! #SUP  0.79
assign  ((resid   44 and name HG*  )) ((resid   45 and name HN   ))   3.84  2.04  0.00 ! #SUP  0.50
assign  ((resid   44 and name HA   )) ((resid   44 and name HG*  ))   3.21  1.41  0.00 ! #SUP  0.59
assign  ((resid   44 and name HN   )) ((resid   44 and name HG*  ))   4.03  2.23  0.00 ! #SUP  0.85
assign  ((resid   44 and name HG*  )) ((resid   46 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.68
assign  ((resid   63 and name HB   )) ((resid   89 and name HD*  ))   4.84  3.04  0.00 ! #SUP  1.00
assign  ((resid   49 and name HN   )) ((resid   49 and name HG1  ))   4.10  2.30  0.00 ! #SUP  0.95
assign  ((resid   49 and name HG1  )) ((resid   49 and name HE21 ))   3.38  1.58  0.00 ! #SUP  0.93
assign  ((resid   49 and name HG1  )) ((resid   49 and name HE22 ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   37 and name HD1* )) ((resid   73 and name HG2  ))   5.07  3.27  0.00 ! #SUP  0.97
assign  ((resid   21 and name HD1* )) ((resid   73 and name HG2  ))   3.55  1.75  0.00 ! #SUP  0.83
assign  ((resid   87 and name HN   )) ((resid   87 and name HB   ))   3.37  1.57  0.00 ! #SUP  0.89
assign  ((resid   20 and name HB2  )) ((resid   40 and name HB*  ))   4.52  2.72  0.00 ! #SUP  0.85
assign  ((resid   34 and name HA   )) ((resid   34 and name HB2  ))   2.97  1.17  0.00 ! #SUP  0.95
assign  ((resid   84 and name HB*  )) ((resid   84 and name HD*  ))   2.40  0.60  0.00 ! #SUP  0.99
assign  ((resid   61 and name HB   )) ((resid   62 and name HN   ))   3.61  1.81  0.00 ! #SUP  0.98
assign  ((resid    7 and name HB1  )) ((resid    8 and name HN   ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid    7 and name HB2  )) ((resid   90 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.88
assign  ((resid   24 and name HG2  )) ((resid   38 and name HD*  ))   3.65  1.85  0.00 ! #SUP  0.96
assign  ((resid   24 and name HB*  )) ((resid   24 and name HG2  ))   2.83  1.03  0.00 ! #SUP  0.99
assign  ((resid   22 and name HG2* )) ((resid   24 and name HG2  ))   3.42  1.62  0.00 ! #SUP  0.94
assign  ((resid   24 and name HN   )) ((resid   24 and name HG2  ))   3.92  2.12  0.00 ! #SUP  0.97
assign  ((resid   24 and name HN   )) ((resid   24 and name HG1  ))   4.31  2.51  0.00 ! #SUP  0.95
assign  ((resid   24 and name HG1  )) ((resid   38 and name HD*  ))   3.79  1.99  0.00 ! #SUP  0.92
assign  ((resid   22 and name HG2* )) ((resid   24 and name HG1  ))   3.63  1.83  0.00 ! #SUP  0.95
assign  ((resid   24 and name HA   )) ((resid   24 and name HG1  ))   3.97  2.17  0.00 ! #SUP  0.98
assign  ((resid    3 and name HG*  )) ((resid   93 and name HN   ))   3.40  1.60  0.00 ! #SUP  0.66
assign  ((resid    3 and name HA   )) ((resid    3 and name HG*  ))   3.00  1.20  0.00 ! #SUP  0.83
assign  ((resid   56 and name HN   )) ((resid   56 and name HB   ))   3.22  1.42  0.00 ! #SUP  0.92
assign  ((resid    4 and name HB2  )) ((resid    5 and name HN   ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid    9 and name HN   )) ((resid    9 and name HB2  ))   3.46  1.66  0.00 ! #SUP  0.69
assign  ((resid    7 and name HB2  )) ((resid    8 and name HG2* ))   5.30  3.50  0.00 ! #SUP  0.60
assign  ((resid    7 and name HB2  )) ((resid   90 and name HG2* ))   5.05  3.25  0.00 ! #SUP  0.60
assign  ((resid    9 and name HB1  )) ((resid   10 and name HN   ))   4.68  2.88  0.00 ! #SUP  0.96
assign  ((resid   79 and name HB   )) ((resid   80 and name HN   ))   4.08  2.28  0.00 ! #SUP  0.98
assign  ((resid   76 and name HA   )) ((resid   79 and name HB   ))   4.14  2.34  0.00 ! #SUP  0.91
assign  ((resid   64 and name HN   )) ((resid   88 and name HB1  ))   4.23  2.43  0.00 ! #SUP  0.93
assign  ((resid    9 and name HB2  )) ((resid   10 and name HN   ))   4.68  2.88  0.00 ! #SUP  0.94
assign  ((resid   88 and name HB1  )) ((resid   89 and name HN   ))   4.30  2.50  0.00 ! #SUP  0.38
assign  ((resid   11 and name HN   )) ((resid   11 and name HB1  ))   2.98  1.18  0.00 ! #SUP  0.82
assign  ((resid   11 and name HB2  )) ((resid   11 and name HG*  ))   2.55  0.75  0.00 ! #SUP  0.93
assign  ((resid   11 and name HN   )) ((resid   11 and name HB2  ))   3.37  1.57  0.00 ! #SUP  0.94
assign  ((resid    2 and name HB*  )) ((resid    2 and name HD2  ))   3.68  1.88  0.00 ! #SUP  0.99
assign  ((resid   11 and name HB1  )) ((resid   11 and name HG*  ))   2.40  0.60  0.00 ! #SUP  0.64
assign  ((resid   33 and name HN   )) ((resid   33 and name HB1  ))   4.09  2.29  0.00 ! #SUP  0.89
assign  ((resid   81 and name HN   )) ((resid   81 and name HB2  ))   2.97  1.17  0.00 ! #SUP  0.92
assign  ((resid   50 and name HB*  )) ((resid   50 and name HD1  ))   3.64  1.84  0.00 ! #SUP  0.98
assign  ((resid   50 and name HB*  )) ((resid   50 and name HD2  ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid   59 and name HN   )) ((resid   59 and name HB2  ))   3.86  2.06  0.00 ! #SUP  0.98
assign  ((resid   14 and name HB*  )) ((resid   15 and name HN   ))   3.76  1.96  0.00 ! #SUP  0.98
assign  ((resid   44 and name HN   )) ((resid   44 and name HB1  ))   3.42  1.62  0.00 ! #SUP  0.60
assign  ((resid   13 and name HA   )) ((resid   14 and name HB*  ))   4.82  3.02  0.00 ! #SUP  0.86
assign  ((resid   37 and name HD1* )) ((resid   73 and name HB1  ))   3.96  2.16  0.00 ! #SUP  0.98
assign  ((resid   22 and name HN   )) ((resid   22 and name HG11 ))   5.00  3.20  0.00 ! #SUP  0.99
assign  ((resid   42 and name HG1* )) ((resid   49 and name HB*  ))   5.20  3.40  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG2* )) ((resid   49 and name HB*  ))   5.20  3.40  0.00 ! #SUP  0.89
assign  ((resid   50 and name HN   )) ((resid   50 and name HG1  ))   4.06  2.26  0.00 ! #SUP  0.99
assign  ((resid   80 and name HA   )) ((resid   80 and name HG   ))   3.79  1.99  0.00 ! #SUP  0.94
assign  ((resid   53 and name HA   )) ((resid   53 and name HG*  ))   3.34  1.54  0.00 ! #SUP  0.99
assign  ((resid   53 and name HN   )) ((resid   53 and name HG*  ))   4.08  2.28  0.00 ! #SUP  0.79
assign  ((resid    5 and name HN   )) ((resid    5 and name HG   ))   3.97  2.17  0.00 ! #SUP  0.98
assign  ((resid    6 and name HA   )) ((resid    7 and name HG2  ))   4.49  2.69  0.00 ! #SUP  0.99
assign  ((resid   60 and name HN   )) ((resid   60 and name HG11 ))   3.75  1.95  0.00 ! #SUP  0.26
assign  ((resid   37 and name HG12 )) ((resid   71 and name HG2* ))   3.76  1.96  0.00 ! #SUP  0.56
assign  ((resid   93 and name HA   )) ((resid   93 and name HG1  ))   3.85  2.05  0.00 ! #SUP  0.97
assign  ((resid   93 and name HA   )) ((resid   93 and name HG2  ))   3.85  2.05  0.00 ! #SUP  0.85
assign  ((resid   60 and name HA   )) ((resid   60 and name HG11 ))   3.78  1.98  0.00 ! #SUP  0.98
assign  ((resid   12 and name HN   )) ((resid   12 and name HG1  ))   4.14  2.34  0.00 ! #SUP  0.97
assign  ((resid   17 and name HA   )) ((resid   17 and name HD1* ))   4.13  2.33  0.00 ! #SUP  0.98
assign  ((resid   60 and name HN   )) ((resid   60 and name HG12 ))   4.01  2.21  0.00 ! #SUP  0.99
assign  ((resid   60 and name HG12 )) ((resid   91 and name HG12 ))   4.76  2.96  0.00 ! #SUP  0.24
assign  ((resid   21 and name HG2* )) ((resid   21 and name HG12 ))   3.23  1.43  0.00 ! #SUP  0.95
assign  ((resid   80 and name HB2  )) ((resid   80 and name HD2* ))   3.30  1.50  0.00 ! #SUP  0.97
assign  ((resid   10 and name HD2* )) ((resid   11 and name HN   ))   3.94  2.14  0.00 ! #SUP  0.46
assign  ((resid   10 and name HB2  )) ((resid   10 and name HD2* ))   3.33  1.53  0.00 ! #SUP  0.51
assign  ((resid   40 and name HG*  )) ((resid   41 and name HN   ))   3.93  2.13  0.00 ! #SUP  0.68
assign  ((resid   34 and name HN   )) ((resid   34 and name HG1  ))   4.33  2.53  0.00 ! #SUP  0.88
assign  ((resid   34 and name HN   )) ((resid   34 and name HG2  ))   4.33  2.53  0.00 ! #SUP  0.82
assign  ((resid    5 and name HD1* )) ((resid    6 and name HN   ))   3.83  2.03  0.00 ! #SUP  0.98
assign  ((resid    5 and name HA   )) ((resid    5 and name HD1* ))   2.60  0.80  0.00 ! #SUP  0.99
assign  ((resid    5 and name HD1* )) ((resid   92 and name HA2  ))   3.08  1.28  0.00 ! #SUP  0.98
assign  ((resid    5 and name HD1* )) ((resid   92 and name HA1  ))   2.94  1.14  0.00 ! #SUP  0.95
assign  ((resid    3 and name HG*  )) ((resid    5 and name HD1* ))   3.05  1.25  0.00 ! #SUP  0.78
assign  ((resid    5 and name HB2  )) ((resid    5 and name HD1* ))   3.35  1.55  0.00 ! #SUP  1.00
assign  ((resid    8 and name HA   )) ((resid    8 and name HG2* ))   2.71  0.91  0.00 ! #SUP  0.92
assign  ((resid   80 and name HN   )) ((resid   80 and name HD1* ))   4.12  2.32  0.00 ! #SUP  0.61
assign  ((resid   80 and name HD1* )) ((resid   89 and name HE*  ))   3.35  1.55  0.00 ! #SUP  0.33
assign  ((resid   80 and name HA   )) ((resid   80 and name HD1* ))   2.53  0.73  0.00 ! #SUP  0.79
assign  ((resid   80 and name HD1* )) ((resid   83 and name HG2* ))   3.04  1.24  0.00 ! #SUP  0.42
assign  ((resid   63 and name HG1* )) ((resid   80 and name HD1* ))   2.97  1.17  0.00 ! #SUP  0.75
assign  ((resid   63 and name HG2* )) ((resid   80 and name HD1* ))   2.97  1.17  0.00 ! #SUP  0.78
assign  ((resid   79 and name HG1* )) ((resid   80 and name HN   ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   79 and name HG1* ))   3.78  1.98  0.00 ! #SUP  0.93
assign  ((resid   76 and name HA   )) ((resid   79 and name HG1* ))   4.39  2.59  0.00 ! #SUP  0.53
assign  ((resid   79 and name HA   )) ((resid   79 and name HG1* ))   2.69  0.89  0.00 ! #SUP  0.62
assign  ((resid   66 and name HB   )) ((resid   79 and name HG1* ))   4.41  2.61  0.00 ! #SUP  0.99
assign  ((resid   66 and name HG2* )) ((resid   79 and name HG1* ))   2.88  1.08  0.00 ! #SUP  0.96
assign  ((resid   87 and name HN   )) ((resid   87 and name HG1* ))   4.03  2.23  0.00 ! #SUP  0.99
assign  ((resid   84 and name HN   )) ((resid   87 and name HG1* ))   4.30  2.50  0.00 ! #SUP  0.99
assign  ((resid   87 and name HG1* )) ((resid   88 and name HN   ))   4.24  2.44  0.00 ! #SUP  0.84
assign  ((resid   87 and name HG1* )) ((resid   89 and name HD*  ))   4.97  3.17  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG1* )) ((resid   89 and name HE*  ))   3.74  1.94  0.00 ! #SUP  0.99
assign  ((resid   87 and name HA   )) ((resid   87 and name HG1* ))   3.20  1.40  0.00 ! #SUP  0.97
assign  ((resid   83 and name HG2* )) ((resid   87 and name HG1* ))   3.63  1.83  0.00 ! #SUP  0.99
assign  ((resid   83 and name HG2* )) ((resid   84 and name HN   ))   3.64  1.84  0.00 ! #SUP  0.94
assign  ((resid   80 and name HA   )) ((resid   83 and name HG2* ))   2.77  0.97  0.00 ! #SUP  0.96
assign  ((resid   63 and name HG1* )) ((resid   83 and name HG2* ))   3.46  1.66  0.00 ! #SUP  0.98
assign  ((resid   82 and name HN   )) ((resid   83 and name HG2* ))   4.01  2.21  0.00 ! #SUP  0.94
assign  ((resid   39 and name HG1* )) ((resid   56 and name HA   ))   2.74  0.94  0.00 ! #SUP  0.93
assign  ((resid   41 and name HG2* )) ((resid   42 and name HN   ))   2.99  1.19  0.00 ! #SUP  0.88
assign  ((resid   41 and name HN   )) ((resid   41 and name HG2* ))   4.07  2.27  0.00 ! #SUP  1.00
assign  ((resid   83 and name HG2* )) ((resid   87 and name HG2* ))   3.63  1.83  0.00 ! #SUP  0.75
assign  ((resid   39 and name HA   )) ((resid   39 and name HG1* ))   2.74  0.94  0.00 ! #SUP  0.92
assign  ((resid   43 and name HG2* )) ((resid   46 and name HN   ))   3.51  1.71  0.00 ! #SUP  0.59
assign  ((resid   12 and name HE*  )) ((resid   43 and name HG2* ))   4.13  2.33  0.00 ! #SUP  0.36
assign  ((resid   72 and name HG2* )) ((resid   73 and name HN   ))   3.27  1.47  0.00 ! #SUP  0.77
assign  ((resid   69 and name HA   )) ((resid   69 and name HG1* ))   3.29  1.49  0.00 ! #SUP  0.69
assign  ((resid   42 and name HG1* )) ((resid   43 and name HN   ))   4.07  2.27  0.00 ! #SUP  0.67
assign  ((resid   78 and name HG2* )) ((resid   79 and name HN   ))   3.24  1.44  0.00 ! #SUP  0.91
assign  ((resid   78 and name HG2* )) ((resid   82 and name HD21 ))   2.96  1.16  0.00 ! #SUP  0.79
assign  ((resid   78 and name HG2* )) ((resid   82 and name HN   ))   4.42  2.62  0.00 ! #SUP  0.90
assign  ((resid   78 and name HG2* )) ((resid   82 and name HD22 ))   2.88  1.08  0.00 ! #SUP  0.65
assign  ((resid   78 and name HA   )) ((resid   78 and name HG2* ))   2.61  0.81  0.00 ! #SUP  0.89
assign  ((resid   78 and name HG2* )) ((resid   79 and name HA   ))   3.41  1.61  0.00 ! #SUP  0.86
assign  ((resid   39 and name HN   )) ((resid   39 and name HG2* ))   2.62  0.82  0.00 ! #SUP  0.84
assign  ((resid   61 and name HG2* )) ((resid   62 and name HN   ))   4.10  2.30  0.00 ! #SUP  0.94
assign  ((resid   61 and name HN   )) ((resid   61 and name HG2* ))   3.85  2.05  0.00 ! #SUP  0.93
assign  ((resid   61 and name HA   )) ((resid   61 and name HG2* ))   3.28  1.48  0.00 ! #SUP  0.96
assign  ((resid   26 and name HA   )) ((resid   26 and name HG1* ))   3.30  1.50  0.00 ! #SUP  0.74
assign  ((resid    8 and name HG1* )) ((resid    9 and name HN   ))   3.64  1.84  0.00 ! #SUP  0.91
assign  ((resid    8 and name HA   )) ((resid    8 and name HG1* ))   2.59  0.79  0.00 ! #SUP  0.82
assign  ((resid    8 and name HG1* )) ((resid   10 and name HB2  ))   3.39  1.59  0.00 ! #SUP  0.60
assign  ((resid   79 and name HN   )) ((resid   79 and name HG2* ))   3.78  1.98  0.00 ! #SUP  0.91
assign  ((resid   66 and name HB   )) ((resid   79 and name HG2* ))   4.41  2.61  0.00 ! #SUP  0.93
assign  ((resid   79 and name HA   )) ((resid   79 and name HG2* ))   2.69  0.89  0.00 ! #SUP  0.98
assign  ((resid   42 and name HG2* )) ((resid   55 and name HA   ))   5.28  3.48  0.00 ! #SUP  0.66
assign  ((resid   71 and name HG1* )) ((resid   72 and name HN   ))   3.70  1.90  0.00 ! #SUP  0.95
assign  ((resid   68 and name HA   )) ((resid   71 and name HG1* ))   2.74  0.94  0.00 ! #SUP  0.82
assign  ((resid   71 and name HA   )) ((resid   71 and name HG1* ))   2.74  0.94  0.00 ! #SUP  0.98
assign  ((resid   61 and name HN   )) ((resid   61 and name HG1* ))   3.85  2.05  0.00 ! #SUP  0.88
assign  ((resid   61 and name HG1* )) ((resid   62 and name HN   ))   4.10  2.30  0.00 ! #SUP  0.88
assign  ((resid   61 and name HA   )) ((resid   61 and name HG1* ))   3.28  1.48  0.00 ! #SUP  0.96
assign  ((resid   63 and name HG2* )) ((resid   64 and name HN   ))   3.64  1.84  0.00 ! #SUP  0.96
assign  ((resid   63 and name HA   )) ((resid   63 and name HG2* ))   3.04  1.24  0.00 ! #SUP  0.98
assign  ((resid   63 and name HG2* )) ((resid   80 and name HA   ))   4.13  2.33  0.00 ! #SUP  0.96
assign  ((resid   63 and name HG2* )) ((resid   83 and name HG2* ))   3.46  1.66  0.00 ! #SUP  0.98
assign  ((resid   63 and name HG2* )) ((resid   89 and name HD*  ))   4.34  2.54  0.00 ! #SUP  0.86
assign  ((resid   60 and name HG2* )) ((resid   60 and name HD1* ))   2.55  0.75  0.00 ! #SUP  0.89
assign  ((resid   26 and name HA   )) ((resid   26 and name HG2* ))   3.30  1.50  0.00 ! #SUP  0.99
assign  ((resid   28 and name HB*  )) ((resid   29 and name HN   ))   3.62  1.82  0.00 ! #SUP  0.93
assign  ((resid   59 and name HN   )) ((resid   91 and name HG2* ))   3.40  1.60  0.00 ! #SUP  0.68
assign  ((resid   91 and name HG2* )) ((resid   92 and name HN   ))   2.77  0.97  0.00 ! #SUP  0.61
assign  ((resid   21 and name HG2* )) ((resid   21 and name HG11 ))   3.08  1.28  0.00 ! #SUP  0.96
assign  ((resid   21 and name HG2* )) ((resid   22 and name HN   ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   21 and name HN   )) ((resid   21 and name HG2* ))   3.27  1.47  0.00 ! #SUP  0.99
assign  ((resid   21 and name HA   )) ((resid   21 and name HG2* ))   2.65  0.85  0.00 ! #SUP  0.98
assign  ((resid   21 and name HG2* )) ((resid   21 and name HD1* ))   3.34  1.54  0.00 ! #SUP  0.96
assign  ((resid   21 and name HG2* )) ((resid   37 and name HG2* ))   3.49  1.69  0.00 ! #SUP  0.96
assign  ((resid   37 and name HN   )) ((resid   37 and name HG2* ))   4.28  2.48  0.00 ! #SUP  0.99
assign  ((resid   37 and name HA   )) ((resid   37 and name HG2* ))   2.97  1.17  0.00 ! #SUP  0.97
assign  ((resid   21 and name HB   )) ((resid   37 and name HG2* ))   2.73  0.93  0.00 ! #SUP  0.76
assign  ((resid   22 and name HN   )) ((resid   37 and name HG2* ))   3.28  1.48  0.00 ! #SUP  0.89
assign  ((resid   37 and name HG11 )) ((resid   71 and name HG2* ))   3.36  1.56  0.00 ! #SUP  0.58
assign  ((resid   71 and name HN   )) ((resid   71 and name HG2* ))   2.69  0.89  0.00 ! #SUP  0.70
assign  ((resid   68 and name HB2  )) ((resid   71 and name HG2* ))   2.91  1.11  0.00 ! #SUP  0.87
assign  ((resid   71 and name HG2* )) ((resid   75 and name HB2  ))   3.63  1.83  0.00 ! #SUP  0.86
assign  ((resid   66 and name HA   )) ((resid   66 and name HG2* ))   3.14  1.34  0.00 ! #SUP  1.00
assign  ((resid   66 and name HG2* )) ((resid   79 and name HG2* ))   2.88  1.08  0.00 ! #SUP  0.96
assign  ((resid   66 and name HG2* )) ((resid   67 and name HN   ))   2.80  1.00  0.00 ! #SUP  0.73
assign  ((resid   63 and name HN   )) ((resid   66 and name HG2* ))   3.17  1.37  0.00 ! #SUP  0.92
assign  ((resid   66 and name HG2* )) ((resid   68 and name HA   ))   3.38  1.58  0.00 ! #SUP  0.29
assign  ((resid   63 and name HB   )) ((resid   66 and name HG2* ))   4.02  2.22  0.00 ! #SUP  1.00
assign  ((resid   66 and name HG2* )) ((resid   68 and name HG   ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   66 and name HG2* )) ((resid   66 and name HD1* ))   2.50  0.70  0.00 ! #SUP  0.88
assign  ((resid   22 and name HA   )) ((resid   22 and name HG2* ))   3.19  1.39  0.00 ! #SUP  0.93
assign  ((resid   21 and name HD1* )) ((resid   77 and name HA   ))   3.93  2.13  0.00 ! #SUP  0.72
assign  ((resid   21 and name HD1* )) ((resid   22 and name HN   ))   3.48  1.68  0.00 ! #SUP  0.90
assign  ((resid   21 and name HD1* )) ((resid   77 and name HN   ))   3.23  1.43  0.00 ! #SUP  0.62
assign  ((resid   21 and name HD1* )) ((resid   37 and name HD1* ))   2.55  0.75  0.00 ! #SUP  0.70
assign  ((resid   22 and name HD1* )) ((resid   24 and name HG2  ))   3.43  1.63  0.00 ! #SUP  0.91
assign  ((resid   22 and name HB   )) ((resid   22 and name HD1* ))   2.55  0.75  0.00 ! #SUP  0.71
assign  ((resid   19 and name HN   )) ((resid   19 and name HD1* ))   4.25  2.45  0.00 ! #SUP  0.98
assign  ((resid   19 and name HA   )) ((resid   19 and name HD1* ))   4.23  2.43  0.00 ! #SUP  0.99
assign  ((resid   19 and name HB   )) ((resid   19 and name HD1* ))   3.04  1.24  0.00 ! #SUP  1.00
assign  ((resid   19 and name HG2* )) ((resid   19 and name HD1* ))   2.55  0.75  0.00 ! #SUP  0.97
assign  ((resid   66 and name HA   )) ((resid   66 and name HD1* ))   3.80  2.00  0.00 ! #SUP  0.99
assign  ((resid   66 and name HB   )) ((resid   66 and name HD1* ))   2.72  0.92  0.00 ! #SUP  0.99
assign  ((resid   60 and name HN   )) ((resid   60 and name HD1* ))   3.57  1.77  0.00 ! #SUP  0.99
assign  ((resid   60 and name HD1* )) ((resid   89 and name HD*  ))   3.62  1.82  0.00 ! #SUP  0.68
assign  ((resid   39 and name HA   )) ((resid   60 and name HD1* ))   4.41  2.61  0.00 ! #SUP  0.77
assign  ((resid   39 and name HB   )) ((resid   60 and name HD1* ))   4.77  2.97  0.00 ! #SUP  0.94
assign  ((resid   60 and name HB   )) ((resid   60 and name HD1* ))   3.27  1.47  0.00 ! #SUP  0.96
assign  ((resid   39 and name HG2* )) ((resid   60 and name HD1* ))   2.56  0.76  0.00 ! #SUP  0.97
assign  ((resid   54 and name HD1* )) ((resid   60 and name HD1* ))   3.58  1.78  0.00 ! #SUP  0.54
assign  ((resid   60 and name HD1* )) ((resid   61 and name HN   ))   4.27  2.47  0.00 ! #SUP  0.84
assign  ((resid   54 and name HD1* )) ((resid   55 and name HN   ))   4.07  2.27  0.00 ! #SUP  0.91
assign  ((resid   54 and name HD1* )) ((resid   89 and name HD*  ))   3.51  1.71  0.00 ! #SUP  0.87
assign  ((resid   54 and name HB   )) ((resid   54 and name HD1* ))   2.75  0.95  0.00 ! #SUP  0.90
assign  ((resid   90 and name HN   )) ((resid   91 and name HD1* ))   4.90  3.10  0.00 ! #SUP  0.96
assign  ((resid   89 and name HA   )) ((resid   91 and name HD1* ))   4.32  2.52  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA   )) ((resid   91 and name HD1* ))   4.17  2.37  0.00 ! #SUP  0.89
assign  ((resid   91 and name HN   )) ((resid   91 and name HD1* ))   3.51  1.71  0.00 ! #SUP  0.97
assign  ((resid   89 and name HD*  )) ((resid   91 and name HD1* ))   3.38  1.58  0.00 ! #SUP  0.99
assign  ((resid   60 and name HA   )) ((resid   91 and name HD1* ))   2.89  1.09  0.00 ! #SUP  0.86
assign  ((resid   89 and name HB2  )) ((resid   91 and name HD1* ))   3.36  1.56  0.00 ! #SUP  0.96
assign  ((resid   89 and name HB1  )) ((resid   91 and name HD1* ))   3.14  1.34  0.00 ! #SUP  0.99
assign  ((resid   37 and name HD1* )) ((resid   73 and name HN   ))   3.17  1.37  0.00 ! #SUP  0.82
assign  ((resid   24 and name HN   )) ((resid   37 and name HD1* ))   3.91  2.11  0.00 ! #SUP  0.92
assign  ((resid   37 and name HN   )) ((resid   37 and name HD1* ))   3.89  2.09  0.00 ! #SUP  0.85
assign  ((resid   23 and name HN   )) ((resid   37 and name HD1* ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   37 and name HD1* )) ((resid   76 and name HN   ))   3.85  2.05  0.00 ! #SUP  0.29
assign  ((resid   23 and name HA2  )) ((resid   37 and name HD1* ))   3.08  1.28  0.00 ! #SUP  0.98
assign  ((resid   37 and name HA   )) ((resid   37 and name HD1* ))   2.77  0.97  0.00 ! #SUP  0.86
assign  ((resid   37 and name HD1* )) ((resid   73 and name HA   ))   2.75  0.95  0.00 ! #SUP  0.96
assign  ((resid   23 and name HA1  )) ((resid   37 and name HD1* ))   3.27  1.47  0.00 ! #SUP  0.96
assign  ((resid   37 and name HB   )) ((resid   37 and name HD1* ))   3.64  1.84  0.00 ! #SUP  0.97
assign  ((resid   37 and name HD1* )) ((resid   73 and name HB2  ))   3.88  2.08  0.00 ! #SUP  0.97
assign  ((resid   37 and name HG2* )) ((resid   37 and name HD1* ))   2.90  1.10  0.00 ! #SUP  0.90
assign  ((resid   41 and name HB   )) ((resid   42 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.38
assign  ((resid   42 and name HA   )) ((resid   43 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   20 and name HB2  )) ((resid   40 and name HG*  ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   20 and name HB1  )) ((resid   40 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   20 and name HB1  )) ((resid   41 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid    7 and name HB2  )) ((resid    8 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid    7 and name HB1  )) ((resid    8 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.92
assign  ((resid    7 and name HG2  )) ((resid    8 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.92
assign  ((resid   84 and name HN   )) ((resid   87 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.59
assign  ((resid   86 and name HA   )) ((resid   87 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.87
assign  ((resid   62 and name HG*  )) ((resid   63 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   60 and name HG2* )) ((resid   63 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.90
assign  ((resid   21 and name HD1* )) ((resid   72 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.93
assign  ((resid   66 and name HA   )) ((resid   67 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   71 and name HG2* )) ((resid   73 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.90
assign  ((resid   73 and name HA   )) ((resid   75 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   22 and name HA   )) ((resid   40 and name HG*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid    8 and name HG1* )) ((resid   53 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid    8 and name HG2* )) ((resid   53 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   53 and name HA   )) ((resid   54 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   81 and name HA   )) ((resid   83 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   67 and name HA   )) ((resid   68 and name HG   ))   5.50  3.70  0.00 ! #SUP  0.30
assign  ((resid   62 and name HB*  )) ((resid   67 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   28 and name HB*  )) ((resid   33 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.87
assign  ((resid   12 and name HG1  )) ((resid   17 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.49
assign  ((resid   12 and name HD*  )) ((resid   17 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   74 and name HA   )) ((resid   77 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.88
assign  ((resid   38 and name HA   )) ((resid   39 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.59
assign  ((resid   62 and name HA   )) ((resid   68 and name HG   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   77 and name HA   )) ((resid   80 and name HG   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   62 and name HA   )) ((resid   68 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.52
assign  ((resid   62 and name HA   )) ((resid   90 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.69
assign  ((resid   39 and name HG2* )) ((resid   59 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   28 and name HA   )) ((resid   30 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   12 and name HB1  )) ((resid   85 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   12 and name HB2  )) ((resid   85 and name HA1  ))   5.50  3.70  0.00 ! #SUP  0.80
assign  ((resid   84 and name HA   )) ((resid   85 and name HA1  ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   24 and name HA   )) ((resid   25 and name HA1  ))   5.50  3.70  0.00 ! #SUP  0.80
assign  ((resid   25 and name HA1  )) ((resid   36 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.62
assign  ((resid   25 and name HA2  )) ((resid   35 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.74
assign  ((resid   30 and name HB*  )) ((resid   31 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   14 and name HA   )) ((resid   16 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   61 and name HG1* )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.61
assign  ((resid   21 and name HD1* )) ((resid   23 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   23 and name HA2  )) ((resid   37 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   81 and name HD*  )) ((resid   82 and name HD22 ))   5.50  3.70  0.00 ! #SUP  0.61
assign  ((resid   22 and name HG2* )) ((resid   38 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.92
assign  ((resid   22 and name HB   )) ((resid   23 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.86
assign  ((resid   22 and name HB   )) ((resid   40 and name HG*  ))   5.50  3.70  0.00 ! #SUP  0.86
assign  ((resid   29 and name HB2  )) ((resid   30 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HG11 )) ((resid   68 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.87
assign  ((resid   86 and name HB*  )) ((resid   87 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   71 and name HG1* )) ((resid   75 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.72
assign  ((resid   72 and name HB   )) ((resid   74 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   72 and name HB   )) ((resid   74 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid    6 and name HD*  )) ((resid   91 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.55
assign  ((resid    9 and name HG*  )) ((resid   10 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid    9 and name HG*  )) ((resid   88 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   28 and name HA   )) ((resid   33 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.64
assign  ((resid   28 and name HA   )) ((resid   33 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.64
assign  ((resid    9 and name HG*  )) ((resid   11 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.78
assign  ((resid    4 and name HN   )) ((resid    4 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.87
assign  ((resid   11 and name HG*  )) ((resid   47 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.84
assign  ((resid   11 and name HG*  )) ((resid   86 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.81
assign  ((resid   63 and name HB   )) ((resid   66 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   63 and name HB   )) ((resid   79 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   60 and name HG11 )) ((resid   63 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.49
assign  ((resid   21 and name HD1* )) ((resid   73 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   37 and name HD1* )) ((resid   73 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.83
assign  ((resid   71 and name HB   )) ((resid   75 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   71 and name HB   )) ((resid   76 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   11 and name HG*  )) ((resid   12 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.62
assign  ((resid   12 and name HB1  )) ((resid   85 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid    7 and name HB1  )) ((resid   90 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   55 and name HA   )) ((resid   56 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   56 and name HB   )) ((resid   57 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.81
assign  ((resid   24 and name HG2  )) ((resid   38 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.41
assign  ((resid   24 and name HG1  )) ((resid   38 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.53
assign  ((resid   39 and name HB   )) ((resid   57 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.87
assign  ((resid   63 and name HN   )) ((resid   79 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.30
assign  ((resid    7 and name HB1  )) ((resid    8 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.73
assign  ((resid    7 and name HB1  )) ((resid   90 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.71
assign  ((resid   12 and name HD*  )) ((resid   49 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.64
assign  ((resid   12 and name HD*  )) ((resid   85 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.73
assign  ((resid   73 and name HB1  )) ((resid   74 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   44 and name HG*  )) ((resid   49 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid   46 and name HN   )) ((resid   49 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.25
assign  ((resid    7 and name HB1  )) ((resid   88 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid    9 and name HG*  )) ((resid   88 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   17 and name HG   )) ((resid   81 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.50
assign  ((resid   35 and name HN   )) ((resid   35 and name HG   ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   54 and name HD1* )) ((resid   91 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.84
assign  ((resid   91 and name HN   )) ((resid   91 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   34 and name HA   )) ((resid   35 and name HG   ))   5.50  3.70  0.00 ! #SUP  0.36
assign  ((resid   12 and name HG1  )) ((resid   47 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.71
assign  ((resid   12 and name HG1  )) ((resid   17 and name HD2* ))   5.50  3.70  0.00 ! #SUP  0.87
assign  ((resid   37 and name HG12 )) ((resid   73 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.63
assign  ((resid   76 and name HA   )) ((resid   80 and name HD2* ))   5.50  3.70  0.00 ! #SUP  0.65
assign  ((resid   34 and name HG2  )) ((resid   35 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   34 and name HG1  )) ((resid   35 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   34 and name HG1  )) ((resid   35 and name HD2* ))   5.50  3.70  0.00 ! #SUP  0.70
assign  ((resid   34 and name HG2  )) ((resid   35 and name HD2* ))   5.50  3.70  0.00 ! #SUP  0.57
assign  ((resid    5 and name HD1* )) ((resid   92 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid    8 and name HG2* )) ((resid   90 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.61
assign  ((resid    8 and name HG2* )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   54 and name HD1* )) ((resid   80 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid    8 and name HG2* )) ((resid   88 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.36
assign  ((resid   87 and name HG2* )) ((resid   88 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   39 and name HG1* )) ((resid   42 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   39 and name HG1* )) ((resid   58 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   39 and name HG1* )) ((resid   56 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   39 and name HG1* )) ((resid   42 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   39 and name HN   )) ((resid   39 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   39 and name HG1* )) ((resid   55 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   39 and name HG1* )) ((resid   57 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   39 and name HG1* )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.85
assign  ((resid   19 and name HB   )) ((resid   39 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   82 and name HA   )) ((resid   83 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.73
assign  ((resid   19 and name HA   )) ((resid   39 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.67
assign  ((resid   41 and name HG2* )) ((resid   42 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   19 and name HB   )) ((resid   41 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.78
assign  ((resid   78 and name HG2* )) ((resid   79 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   39 and name HG2* )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   42 and name HG1* )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   41 and name HG2* )) ((resid   42 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.87
assign  ((resid   42 and name HG1* )) ((resid   49 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   19 and name HA   )) ((resid   42 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.76
assign  ((resid   39 and name HG2* )) ((resid   60 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.90
assign  ((resid   38 and name HD*  )) ((resid   39 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   61 and name HG2* )) ((resid   91 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.90
assign  ((resid   19 and name HA   )) ((resid   42 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   39 and name HG2* )) ((resid   58 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   71 and name HG1* )) ((resid   72 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.56
assign  ((resid   66 and name HG2* )) ((resid   71 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   42 and name HG2* )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.80
assign  ((resid   60 and name HG2* )) ((resid   89 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   26 and name HG2* )) ((resid   27 and name HA1  ))   5.50  3.70  0.00 ! #SUP  0.54
assign  ((resid   60 and name HN   )) ((resid   91 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   21 and name HG2* )) ((resid   40 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   60 and name HA   )) ((resid   91 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   91 and name HG2* )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.73
assign  ((resid   21 and name HG2* )) ((resid   39 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   54 and name HD1* )) ((resid   91 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   89 and name HB2  )) ((resid   91 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   21 and name HG2* )) ((resid   37 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.84
assign  ((resid   21 and name HG2* )) ((resid   73 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.84
assign  ((resid   22 and name HB   )) ((resid   37 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.39
assign  ((resid   37 and name HG2* )) ((resid   60 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   37 and name HG2* )) ((resid   60 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.60
assign  ((resid   37 and name HG2* )) ((resid   39 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   19 and name HN   )) ((resid   19 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.86
assign  ((resid   19 and name HG2* )) ((resid   20 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   68 and name HA   )) ((resid   71 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   22 and name HG2* )) ((resid   38 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   63 and name HG1* )) ((resid   66 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.71
assign  ((resid   22 and name HG2* )) ((resid   40 and name HG*  ))   5.50  3.70  0.00 ! #SUP  0.90
assign  ((resid   21 and name HD1* )) ((resid   73 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   22 and name HD1* )) ((resid   24 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   22 and name HN   )) ((resid   22 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   22 and name HD1* )) ((resid   38 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   17 and name HD2* )) ((resid   19 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   66 and name HD1* )) ((resid   68 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.70
assign  ((resid   59 and name HB1  )) ((resid   91 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   60 and name HB   )) ((resid   91 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   37 and name HD1* )) ((resid   71 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   35 and name HB*  )) ((resid   37 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   37 and name HD1* )) ((resid   77 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   11 and name HG*  )) ((resid   13 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.30
assign  ((resid   26 and name HB   )) ((resid   27 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid    7 and name HB2  )) ((resid    9 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.67
assign  ((resid   39 and name HB   )) ((resid   40 and name HN   ))   4.80  3.00  0.00 ! #SUP  0.99
assign  ((resid   40 and name HN   )) ((resid   40 and name HB*  ))   3.34  1.54  0.00 ! #SUP  0.96
assign  ((resid   22 and name HG2* )) ((resid   40 and name HN   ))   4.32  2.52  0.00 ! #SUP  0.84
assign  ((resid   39 and name HG1* )) ((resid   40 and name HN   ))   3.97  2.17  0.00 ! #SUP  0.84
assign  ((resid   93 and name HN   )) ((resid   94 and name HN   ))   4.39  2.59  0.00 ! #SUP  0.98
assign  ((resid   93 and name HA   )) ((resid   94 and name HN   ))   2.40  0.60  0.00 ! #SUP  0.65
assign  ((resid   44 and name HN   )) ((resid   45 and name HN   ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   46 and name HN   ))   5.11  3.31  0.00 ! #SUP  0.85
assign  ((resid   43 and name HA   )) ((resid   44 and name HN   ))   2.58  0.78  0.00 ! #SUP  0.66
assign  ((resid   44 and name HN   )) ((resid   44 and name HB2  ))   3.42  1.62  0.00 ! #SUP  0.90
assign  ((resid   43 and name HG2* )) ((resid   44 and name HN   ))   3.46  1.66  0.00 ! #SUP  0.94
assign  ((resid   91 and name HN   )) ((resid   92 and name HN   ))   4.67  2.87  0.00 ! #SUP  0.95
assign  ((resid   61 and name HB   )) ((resid   91 and name HN   ))   4.64  2.84  0.00 ! #SUP  1.00
assign  ((resid   90 and name HB   )) ((resid   91 and name HN   ))   4.83  3.03  0.00 ! #SUP  1.00
assign  ((resid   90 and name HA   )) ((resid   91 and name HN   ))   3.16  1.36  0.00 ! #SUP  0.85
assign  ((resid   91 and name HN   )) ((resid   91 and name HG11 ))   3.49  1.69  0.00 ! #SUP  0.87
assign  ((resid   91 and name HN   )) ((resid   91 and name HB   ))   2.91  1.11  0.00 ! #SUP  0.67
assign  ((resid   61 and name HG1* )) ((resid   91 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   90 and name HG2* )) ((resid   91 and name HN   ))   4.99  3.19  0.00 ! #SUP  0.91
assign  ((resid   91 and name HN   )) ((resid   91 and name HG2* ))   3.79  1.99  0.00 ! #SUP  0.99
assign  ((resid   61 and name HN   )) ((resid   91 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   90 and name HN   ))   4.57  2.77  0.00 ! #SUP  0.72
assign  ((resid   61 and name HN   )) ((resid   91 and name HA   ))   3.42  1.62  0.00 ! #SUP  0.70
assign  ((resid   60 and name HA   )) ((resid   61 and name HN   ))   2.74  0.94  0.00 ! #SUP  0.80
assign  ((resid   61 and name HN   )) ((resid   61 and name HB   ))   3.72  1.92  0.00 ! #SUP  0.99
assign  ((resid   60 and name HG2* )) ((resid   61 and name HN   ))   3.16  1.36  0.00 ! #SUP  0.94
assign  ((resid   61 and name HN   )) ((resid   91 and name HD1* ))   4.07  2.27  0.00 ! #SUP  0.83
assign  ((resid   64 and name HN   )) ((resid   89 and name HN   ))   5.45  3.65  0.00 ! #SUP  0.76
assign  ((resid   63 and name HN   )) ((resid   64 and name HN   ))   4.80  3.00  0.00 ! #SUP  1.00
assign  ((resid   64 and name HN   )) ((resid   89 and name HA   ))   4.32  2.52  0.00 ! #SUP  0.82
assign  ((resid   63 and name HA   )) ((resid   64 and name HN   ))   2.55  0.75  0.00 ! #SUP  0.86
assign  ((resid   64 and name HN   )) ((resid   64 and name HA   ))   2.60  0.80  0.00 ! #SUP  0.89
assign  ((resid   64 and name HN   )) ((resid   65 and name HA2  ))   5.29  3.49  0.00 ! #SUP  1.00
assign  ((resid   62 and name HG*  )) ((resid   64 and name HN   ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   64 and name HN   )) ((resid   88 and name HB2  ))   3.57  1.77  0.00 ! #SUP  0.94
assign  ((resid   63 and name HG1* )) ((resid   64 and name HN   ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid    9 and name HA   )) ((resid   87 and name HN   ))   4.50  2.70  0.00 ! #SUP  0.95
assign  ((resid    9 and name HG*  )) ((resid   87 and name HN   ))   4.33  2.53  0.00 ! #SUP  0.92
assign  ((resid   10 and name HB2  )) ((resid   87 and name HN   ))   4.63  2.83  0.00 ! #SUP  0.82
assign  ((resid   87 and name HN   )) ((resid   87 and name HG2* ))   4.03  2.23  0.00 ! #SUP  0.87
assign  ((resid    9 and name HN   )) ((resid   10 and name HN   ))   4.25  2.45  0.00 ! #SUP  0.99
assign  ((resid    9 and name HN   )) ((resid   89 and name HN   ))   5.10  3.30  0.00 ! #SUP  0.89
assign  ((resid    8 and name HN   )) ((resid    9 and name HN   ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid    8 and name HA   )) ((resid    9 and name HN   ))   2.51  0.71  0.00 ! #SUP  0.73
assign  ((resid    9 and name HN   )) ((resid    9 and name HB1  ))   3.46  1.66  0.00 ! #SUP  0.94
assign  ((resid    8 and name HB   )) ((resid    9 and name HN   ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   89 and name HE*  ))   4.64  2.84  0.00 ! #SUP  0.94
assign  ((resid   64 and name HN   )) ((resid   88 and name HN   ))   3.62  1.82  0.00 ! #SUP  0.97
assign  ((resid   87 and name HN   )) ((resid   88 and name HN   ))   4.74  2.94  0.00 ! #SUP  0.99
assign  ((resid    9 and name HA   )) ((resid   88 and name HN   ))   5.09  3.29  0.00 ! #SUP  0.98
assign  ((resid   63 and name HA   )) ((resid   88 and name HN   ))   4.79  2.99  0.00 ! #SUP  0.91
assign  ((resid   64 and name HA   )) ((resid   88 and name HN   ))   3.91  2.11  0.00 ! #SUP  0.52
assign  ((resid   88 and name HN   )) ((resid   88 and name HD*  ))   4.49  2.69  0.00 ! #SUP  0.96
assign  ((resid   86 and name HB*  )) ((resid   88 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.72
assign  ((resid   88 and name HN   )) ((resid   88 and name HB1  ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   88 and name HN   )) ((resid   88 and name HB2  ))   3.09  1.29  0.00 ! #SUP  0.99
assign  ((resid   88 and name HN   )) ((resid   88 and name HG1  ))   4.06  2.26  0.00 ! #SUP  0.99
assign  ((resid   88 and name HN   )) ((resid   88 and name HG2  ))   5.00  3.20  0.00 ! #SUP  0.98
assign  ((resid   87 and name HG2* )) ((resid   88 and name HN   ))   4.24  2.44  0.00 ! #SUP  0.93
assign  ((resid    4 and name HN   )) ((resid   93 and name HN   ))   3.30  1.50  0.00 ! #SUP  0.99
assign  ((resid    4 and name HN   )) ((resid   93 and name HA   ))   4.94  3.14  0.00 ! #SUP  0.97
assign  ((resid    3 and name HA   )) ((resid    4 and name HN   ))   2.40  0.60  0.00 ! #SUP  0.64
assign  ((resid    3 and name HG*  )) ((resid    4 and name HN   ))   3.18  1.38  0.00 ! #SUP  0.66
assign  ((resid    4 and name HN   )) ((resid    4 and name HB2  ))   3.16  1.36  0.00 ! #SUP  0.98
assign  ((resid    4 and name HN   )) ((resid    4 and name HB1  ))   2.89  1.09  0.00 ! #SUP  0.92
assign  ((resid    4 and name HN   )) ((resid    5 and name HD2* ))   4.41  2.61  0.00 ! #SUP  0.76
assign  ((resid   55 and name HN   )) ((resid   56 and name HN   ))   4.55  2.75  0.00 ! #SUP  0.99
assign  ((resid   55 and name HN   )) ((resid   58 and name HN   ))   4.84  3.04  0.00 ! #SUP  0.86
assign  ((resid   59 and name HN   )) ((resid   60 and name HN   ))   5.14  3.34  0.00 ! #SUP  0.96
assign  ((resid   60 and name HN   )) ((resid   61 and name HN   ))   4.99  3.19  0.00 ! #SUP  0.88
assign  ((resid   59 and name HA   )) ((resid   60 and name HN   ))   2.83  1.03  0.00 ! #SUP  0.76
assign  ((resid   37 and name HB   )) ((resid   60 and name HN   ))   5.17  3.37  0.00 ! #SUP  0.65
assign  ((resid   59 and name HB2  )) ((resid   60 and name HN   ))   4.40  2.60  0.00 ! #SUP  0.73
assign  ((resid   60 and name HN   )) ((resid   60 and name HB   ))   3.16  1.36  0.00 ! #SUP  0.96
assign  ((resid   59 and name HG2  )) ((resid   60 and name HN   ))   4.00  2.20  0.00 ! #SUP  0.80
assign  ((resid   59 and name HG1  )) ((resid   60 and name HN   ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   37 and name HG2* )) ((resid   60 and name HN   ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   60 and name HN   )) ((resid   60 and name HG2* ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   68 and name HN   ))   5.29  3.49  0.00 ! #SUP  0.92
assign  ((resid   62 and name HA   )) ((resid   68 and name HN   ))   3.12  1.32  0.00 ! #SUP  0.51
assign  ((resid   67 and name HA   )) ((resid   68 and name HN   ))   2.67  0.87  0.00 ! #SUP  0.84
assign  ((resid   67 and name HB2  )) ((resid   68 and name HN   ))   4.86  3.06  0.00 ! #SUP  0.89
assign  ((resid   67 and name HB1  )) ((resid   68 and name HN   ))   4.86  3.06  0.00 ! #SUP  0.67
assign  ((resid   68 and name HN   )) ((resid   68 and name HB2  ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   68 and name HN   )) ((resid   68 and name HG   ))   3.43  1.63  0.00 ! #SUP  0.93
assign  ((resid   68 and name HN   )) ((resid   68 and name HB1  ))   3.44  1.64  0.00 ! #SUP  0.97
assign  ((resid   66 and name HG2* )) ((resid   68 and name HN   ))   3.69  1.89  0.00 ! #SUP  0.93
assign  ((resid   68 and name HN   )) ((resid   68 and name HD1* ))   4.03  2.23  0.00 ! #SUP  1.00
assign  ((resid   68 and name HN   )) ((resid   68 and name HD2* ))   4.03  2.23  0.00 ! #SUP  0.93
assign  ((resid   68 and name HN   )) ((resid   71 and name HG1* ))   4.88  3.08  0.00 ! #SUP  0.79
assign  ((resid   92 and name HN   )) ((resid   93 and name HN   ))   4.87  3.07  0.00 ! #SUP  0.95
assign  ((resid    5 and name HA   )) ((resid   93 and name HN   ))   4.09  2.29  0.00 ! #SUP  0.73
assign  ((resid   92 and name HA2  )) ((resid   93 and name HN   ))   2.97  1.17  0.00 ! #SUP  0.92
assign  ((resid    3 and name HA   )) ((resid   93 and name HN   ))   4.51  2.71  0.00 ! #SUP  0.90
assign  ((resid   92 and name HA1  )) ((resid   93 and name HN   ))   3.06  1.26  0.00 ! #SUP  0.94
assign  ((resid    4 and name HB2  )) ((resid   93 and name HN   ))   4.68  2.88  0.00 ! #SUP  0.98
assign  ((resid   93 and name HN   )) ((resid   93 and name HB1  ))   3.63  1.83  0.00 ! #SUP  0.93
assign  ((resid   93 and name HN   )) ((resid   93 and name HB2  ))   3.63  1.83  0.00 ! #SUP  0.97
assign  ((resid    5 and name HD1* )) ((resid   93 and name HN   ))   3.89  2.09  0.00 ! #SUP  0.76
assign  ((resid   12 and name HN   )) ((resid   87 and name HN   ))   4.47  2.67  0.00 ! #SUP  0.82
assign  ((resid   46 and name HN   )) ((resid   49 and name HN   ))   4.86  3.06  0.00 ! #SUP  0.97
assign  ((resid   49 and name HN   )) ((resid   51 and name HN   ))   4.50  2.70  0.00 ! #SUP  0.99
assign  ((resid   12 and name HE*  )) ((resid   49 and name HN   ))   3.99  2.19  0.00 ! #SUP  0.81
assign  ((resid   49 and name HN   )) ((resid   49 and name HB*  ))   3.17  1.37  0.00 ! #SUP  0.96
assign  ((resid   48 and name HB*  )) ((resid   49 and name HN   ))   3.20  1.40  0.00 ! #SUP  0.95
assign  ((resid   12 and name HN   )) ((resid   13 and name HN   ))   4.76  2.96  0.00 ! #SUP  0.97
assign  ((resid   11 and name HA   )) ((resid   12 and name HN   ))   2.70  0.90  0.00 ! #SUP  0.60
assign  ((resid   12 and name HN   )) ((resid   85 and name HA2  ))   4.00  2.20  0.00 ! #SUP  0.55
assign  ((resid   12 and name HN   )) ((resid   12 and name HB1  ))   3.63  1.83  0.00 ! #SUP  0.99
assign  ((resid   12 and name HN   )) ((resid   12 and name HB2  ))   2.96  1.16  0.00 ! #SUP  0.89
assign  ((resid   12 and name HN   )) ((resid   12 and name HG2  ))   3.21  1.41  0.00 ! #SUP  0.90
assign  ((resid   38 and name HN   )) ((resid   59 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.83
assign  ((resid   24 and name HN   )) ((resid   38 and name HN   ))   4.08  2.28  0.00 ! #SUP  0.66
assign  ((resid   38 and name HN   )) ((resid   38 and name HB2  ))   3.38  1.58  0.00 ! #SUP  0.90
assign  ((resid   37 and name HB   )) ((resid   38 and name HN   ))   4.53  2.73  0.00 ! #SUP  0.79
assign  ((resid   21 and name HB   )) ((resid   38 and name HN   ))   4.43  2.63  0.00 ! #SUP  0.51
assign  ((resid   22 and name HG2* )) ((resid   38 and name HN   ))   4.03  2.23  0.00 ! #SUP  0.72
assign  ((resid   37 and name HG2* )) ((resid   38 and name HN   ))   3.37  1.57  0.00 ! #SUP  0.89
assign  ((resid   37 and name HD1* )) ((resid   38 and name HN   ))   3.92  2.12  0.00 ! #SUP  0.91
assign  ((resid   64 and name HN   )) ((resid   66 and name HN   ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   64 and name HA   )) ((resid   66 and name HN   ))   4.55  2.75  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   66 and name HA   ))   2.94  1.14  0.00 ! #SUP  0.94
assign  ((resid   65 and name HA1  )) ((resid   66 and name HN   ))   3.51  1.71  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   66 and name HB   ))   2.70  0.90  0.00 ! #SUP  0.93
assign  ((resid   63 and name HB   )) ((resid   66 and name HN   ))   5.00  3.20  0.00 ! #SUP  0.76
assign  ((resid   66 and name HN   )) ((resid   66 and name HG2* ))   3.20  1.40  0.00 ! #SUP  0.90
assign  ((resid   66 and name HN   )) ((resid   66 and name HD1* ))   4.29  2.49  0.00 ! #SUP  1.00
assign  ((resid   69 and name HN   )) ((resid   70 and name HN   ))   4.47  2.67  0.00 ! #SUP  0.81
assign  ((resid   68 and name HN   )) ((resid   69 and name HN   ))   3.17  1.37  0.00 ! #SUP  0.98
assign  ((resid   68 and name HA   )) ((resid   69 and name HN   ))   3.21  1.41  0.00 ! #SUP  0.94
assign  ((resid   67 and name HA   )) ((resid   69 and name HN   ))   3.50  1.70  0.00 ! #SUP  0.83
assign  ((resid   69 and name HN   )) ((resid   69 and name HB   ))   2.77  0.97  0.00 ! #SUP  0.40
assign  ((resid   68 and name HD1* )) ((resid   69 and name HN   ))   4.38  2.58  0.00 ! #SUP  0.99
assign  ((resid   68 and name HD2* )) ((resid   69 and name HN   ))   4.38  2.58  0.00 ! #SUP  0.83
assign  ((resid   69 and name HN   )) ((resid   71 and name HG1* ))   4.22  2.42  0.00 ! #SUP  0.71
assign  ((resid   28 and name HN   )) ((resid   29 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   28 and name HN   )) ((resid   28 and name HB*  ))   2.89  1.09  0.00 ! #SUP  0.97
assign  ((resid   17 and name HN   )) ((resid   17 and name HG   ))   4.60  2.80  0.00 ! #SUP  0.83
assign  ((resid    3 and name HN   )) ((resid    4 and name HN   ))   4.75  2.95  0.00 ! #SUP  0.99
assign  ((resid    2 and name HB*  )) ((resid    3 and name HN   ))   4.00  2.20  0.00 ! #SUP  0.96
assign  ((resid   29 and name HN   )) ((resid   30 and name HN   ))   3.25  1.45  0.00 ! #SUP  0.93
assign  ((resid   30 and name HN   )) ((resid   31 and name HN   ))   3.55  1.75  0.00 ! #SUP  0.93
assign  ((resid   29 and name HB2  )) ((resid   30 and name HN   ))   4.59  2.79  0.00 ! #SUP  0.99
assign  ((resid   29 and name HB1  )) ((resid   30 and name HN   ))   4.59  2.79  0.00 ! #SUP  0.91
assign  ((resid   30 and name HN   )) ((resid   30 and name HB*  ))   2.72  0.92  0.00 ! #SUP  0.89
assign  ((resid   35 and name HN   )) ((resid   36 and name HN   ))   4.75  2.95  0.00 ! #SUP  0.90
assign  ((resid   34 and name HA   )) ((resid   35 and name HN   ))   2.84  1.04  0.00 ! #SUP  0.65
assign  ((resid   35 and name HN   )) ((resid   35 and name HD1* ))   4.93  3.13  0.00 ! #SUP  0.46
assign  ((resid   35 and name HN   )) ((resid   35 and name HD2* ))   4.93  3.13  0.00 ! #SUP  0.79
assign  ((resid    5 and name HN   )) ((resid   92 and name HA2  ))   4.65  2.85  0.00 ! #SUP  0.86
assign  ((resid    5 and name HN   )) ((resid    6 and name HN   ))   4.61  2.81  0.00 ! #SUP  0.99
assign  ((resid    4 and name HN   )) ((resid    5 and name HN   ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid    4 and name HA   )) ((resid    5 and name HN   ))   2.40  0.60  0.00 ! #SUP  0.72
assign  ((resid    4 and name HG2  )) ((resid    5 and name HN   ))   4.61  2.81  0.00 ! #SUP  0.88
assign  ((resid    4 and name HB1  )) ((resid    5 and name HN   ))   4.53  2.73  0.00 ! #SUP  0.87
assign  ((resid    5 and name HN   )) ((resid    5 and name HB2  ))   2.94  1.14  0.00 ! #SUP  0.94
assign  ((resid    5 and name HN   )) ((resid    5 and name HB1  ))   3.75  1.95  0.00 ! #SUP  0.89
assign  ((resid    5 and name HN   )) ((resid    5 and name HD2* ))   3.65  1.85  0.00 ! #SUP  1.00
assign  ((resid    5 and name HN   )) ((resid    5 and name HD1* ))   3.63  1.83  0.00 ! #SUP  0.98
assign  ((resid   13 and name HN   )) ((resid   15 and name HN   ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   13 and name HN   )) ((resid   17 and name HA   ))   5.49  3.69  0.00 ! #SUP  0.95
assign  ((resid   13 and name HN   )) ((resid   16 and name HA2  ))   5.21  3.41  0.00 ! #SUP  0.90
assign  ((resid   13 and name HN   )) ((resid   13 and name HB2  ))   3.68  1.88  0.00 ! #SUP  0.99
assign  ((resid   13 and name HN   )) ((resid   13 and name HB1  ))   3.68  1.88  0.00 ! #SUP  0.95
assign  ((resid   12 and name HB1  )) ((resid   13 and name HN   ))   3.36  1.56  0.00 ! #SUP  0.95
assign  ((resid   12 and name HD*  )) ((resid   13 and name HN   ))   3.87  2.07  0.00 ! #SUP  0.99
assign  ((resid   13 and name HN   )) ((resid   47 and name HB*  ))   4.27  2.47  0.00 ! #SUP  0.39
assign  ((resid   12 and name HG1  )) ((resid   13 and name HN   ))   4.51  2.71  0.00 ! #SUP  0.94
assign  ((resid   43 and name HN   )) ((resid   44 and name HN   ))   4.86  3.06  0.00 ! #SUP  0.93
assign  ((resid   19 and name HA   )) ((resid   43 and name HN   ))   3.46  1.66  0.00 ! #SUP  0.44
assign  ((resid   42 and name HA   )) ((resid   43 and name HN   ))   2.55  0.75  0.00 ! #SUP  0.63
assign  ((resid   43 and name HN   )) ((resid   43 and name HB   ))   2.99  1.19  0.00 ! #SUP  0.81
assign  ((resid   43 and name HN   )) ((resid   43 and name HG2* ))   3.97  2.17  0.00 ! #SUP  0.95
assign  ((resid   19 and name HG2* )) ((resid   43 and name HN   ))   3.50  1.70  0.00 ! #SUP  0.83
assign  ((resid   42 and name HG2* )) ((resid   43 and name HN   ))   4.07  2.27  0.00 ! #SUP  0.69
assign  ((resid   75 and name HN   )) ((resid   75 and name HB1  ))   2.89  1.09  0.00 ! #SUP  0.52
assign  ((resid   10 and name HN   )) ((resid   11 and name HN   ))   4.69  2.89  0.00 ! #SUP  0.87
assign  ((resid   10 and name HA   )) ((resid   11 and name HN   ))   2.70  0.90  0.00 ! #SUP  0.76
assign  ((resid   11 and name HN   )) ((resid   11 and name HG*  ))   4.29  2.49  0.00 ! #SUP  0.87
assign  ((resid   10 and name HD1* )) ((resid   11 and name HN   ))   3.94  2.14  0.00 ! #SUP  0.45
assign  ((resid   88 and name HN   )) ((resid   89 and name HN   ))   4.57  2.77  0.00 ! #SUP  0.97
assign  ((resid    9 and name HA   )) ((resid   89 and name HN   ))   4.17  2.37  0.00 ! #SUP  0.98
assign  ((resid   88 and name HA   )) ((resid   89 and name HN   ))   2.55  0.75  0.00 ! #SUP  0.62
assign  ((resid   63 and name HA   )) ((resid   89 and name HN   ))   5.15  3.35  0.00 ! #SUP  0.88
assign  ((resid   89 and name HN   )) ((resid   89 and name HB2  ))   3.18  1.38  0.00 ! #SUP  0.94
assign  ((resid   89 and name HN   )) ((resid   89 and name HB1  ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid    8 and name HB   )) ((resid   89 and name HN   ))   3.73  1.93  0.00 ! #SUP  0.98
assign  ((resid   88 and name HG2  )) ((resid   89 and name HN   ))   5.27  3.47  0.00 ! #SUP  0.99
assign  ((resid    8 and name HG1* )) ((resid   89 and name HN   ))   4.06  2.26  0.00 ! #SUP  0.76
assign  ((resid   89 and name HN   )) ((resid   91 and name HD1* ))   5.45  3.65  0.00 ! #SUP  0.92
assign  ((resid   10 and name HN   )) ((resid   89 and name HN   ))   4.38  2.58  0.00 ! #SUP  0.98
assign  ((resid   10 and name HN   )) ((resid   87 and name HN   ))   3.58  1.78  0.00 ! #SUP  0.97
assign  ((resid    9 and name HA   )) ((resid   10 and name HN   ))   2.47  0.67  0.00 ! #SUP  0.71
assign  ((resid    9 and name HG*  )) ((resid   10 and name HN   ))   3.78  1.98  0.00 ! #SUP  0.96
assign  ((resid   10 and name HN   )) ((resid   87 and name HB   ))   3.70  1.90  0.00 ! #SUP  0.31
assign  ((resid   10 and name HN   )) ((resid   10 and name HB2  ))   3.06  1.26  0.00 ! #SUP  0.87
assign  ((resid   10 and name HN   )) ((resid   10 and name HB1  ))   3.60  1.80  0.00 ! #SUP  0.78
assign  ((resid   10 and name HN   )) ((resid   86 and name HA   ))   4.81  3.01  0.00 ! #SUP  0.97
assign  ((resid   33 and name HN   )) ((resid   34 and name HN   ))   3.59  1.79  0.00 ! #SUP  0.85
assign  ((resid   33 and name HA   )) ((resid   34 and name HN   ))   2.68  0.88  0.00 ! #SUP  0.69
assign  ((resid   37 and name HN   )) ((resid   38 and name HN   ))   5.15  3.35  0.00 ! #SUP  1.00
assign  ((resid   37 and name HN   )) ((resid   59 and name HE21 ))   4.97  3.17  0.00 ! #SUP  0.97
assign  ((resid   36 and name HA2  )) ((resid   37 and name HN   ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD1* )) ((resid   37 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   77 and name HN   )) ((resid   79 and name HN   ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   75 and name HD*  )) ((resid   79 and name HN   ))   4.74  2.94  0.00 ! #SUP  0.28
assign  ((resid   78 and name HB   )) ((resid   79 and name HN   ))   3.04  1.24  0.00 ! #SUP  0.95
assign  ((resid   79 and name HN   )) ((resid   80 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   79 and name HN   ))   3.62  1.82  0.00 ! #SUP  0.84
assign  ((resid   79 and name HN   )) ((resid   79 and name HB   ))   2.72  0.92  0.00 ! #SUP  0.95
assign  ((resid   76 and name HB*  )) ((resid   79 and name HN   ))   4.75  2.95  0.00 ! #SUP  0.93
assign  ((resid   66 and name HD1* )) ((resid   79 and name HN   ))   4.60  2.80  0.00 ! #SUP  0.66
assign  ((resid   79 and name HN   )) ((resid   80 and name HD2* ))   4.86  3.06  0.00 ! #SUP  0.66
assign  ((resid   23 and name HA2  )) ((resid   24 and name HN   ))   2.84  1.04  0.00 ! #SUP  0.83
assign  ((resid   24 and name HN   )) ((resid   24 and name HB*  ))   3.88  2.08  0.00 ! #SUP  0.98
assign  ((resid   24 and name HN   )) ((resid   37 and name HG12 ))   4.48  2.68  0.00 ! #SUP  0.93
assign  ((resid   24 and name HN   )) ((resid   37 and name HG2* ))   5.16  3.36  0.00 ! #SUP  0.98
assign  ((resid   58 and name HN   )) ((resid   59 and name HN   ))   4.49  2.69  0.00 ! #SUP  0.99
assign  ((resid   58 and name HB2  )) ((resid   59 and name HN   ))   3.72  1.92  0.00 ! #SUP  0.98
assign  ((resid   58 and name HB1  )) ((resid   59 and name HN   ))   3.72  1.92  0.00 ! #SUP  0.92
assign  ((resid   59 and name HN   )) ((resid   59 and name HB1  ))   3.44  1.64  0.00 ! #SUP  0.84
assign  ((resid   41 and name HN   )) ((resid   42 and name HN   ))   4.67  2.87  0.00 ! #SUP  0.99
assign  ((resid   41 and name HA   )) ((resid   42 and name HN   ))   2.55  0.75  0.00 ! #SUP  0.76
assign  ((resid   42 and name HN   )) ((resid   42 and name HB   ))   3.49  1.69  0.00 ! #SUP  0.90
assign  ((resid   42 and name HN   )) ((resid   43 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.30
assign  ((resid   81 and name HN   )) ((resid   82 and name HB2  ))   4.37  2.57  0.00 ! #SUP  0.87
assign  ((resid   78 and name HA   )) ((resid   81 and name HN   ))   3.67  1.87  0.00 ! #SUP  0.92
assign  ((resid   79 and name HA   )) ((resid   81 and name HN   ))   4.17  2.37  0.00 ! #SUP  0.89
assign  ((resid   81 and name HN   )) ((resid   81 and name HB1  ))   2.97  1.17  0.00 ! #SUP  0.77
assign  ((resid   80 and name HB1  )) ((resid   81 and name HN   ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   80 and name HD2* )) ((resid   81 and name HN   ))   4.44  2.64  0.00 ! #SUP  1.00
assign  ((resid   57 and name HB2  )) ((resid   58 and name HN   ))   4.43  2.63  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   58 and name HB1  ))   3.65  1.85  0.00 ! #SUP  0.75
assign  ((resid   57 and name HN   )) ((resid   58 and name HN   ))   3.05  1.25  0.00 ! #SUP  0.95
assign  ((resid   57 and name HA   )) ((resid   58 and name HN   ))   3.30  1.50  0.00 ! #SUP  0.96
assign  ((resid   39 and name HB   )) ((resid   58 and name HN   ))   3.79  1.99  0.00 ! #SUP  0.40
assign  ((resid   56 and name HG1* )) ((resid   58 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   56 and name HG2* )) ((resid   58 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   83 and name HB   )) ((resid   84 and name HN   ))   2.81  1.01  0.00 ! #SUP  0.61
assign  ((resid   84 and name HN   )) ((resid   84 and name HB*  ))   3.68  1.88  0.00 ! #SUP  1.00
assign  ((resid   84 and name HN   )) ((resid   84 and name HD*  ))   4.05  2.25  0.00 ! #SUP  0.94
assign  ((resid   84 and name HN   )) ((resid   87 and name HG2* ))   4.30  2.50  0.00 ! #SUP  0.54
assign  ((resid   72 and name HB   )) ((resid   73 and name HN   ))   2.77  0.97  0.00 ! #SUP  0.81
assign  ((resid   73 and name HN   )) ((resid   73 and name HG2  ))   4.48  2.68  0.00 ! #SUP  0.97
assign  ((resid   73 and name HN   )) ((resid   73 and name HB1  ))   2.84  1.04  0.00 ! #SUP  0.78
assign  ((resid   21 and name HD1* )) ((resid   73 and name HN   ))   4.28  2.48  0.00 ! #SUP  0.45
assign  ((resid   32 and name HN   )) ((resid   33 and name HN   ))   3.00  1.20  0.00 ! #SUP  0.83
assign  ((resid   31 and name HN   )) ((resid   32 and name HN   ))   3.33  1.53  0.00 ! #SUP  0.89
assign  ((resid   32 and name HN   )) ((resid   33 and name HA   ))   4.77  2.97  0.00 ! #SUP  0.92
assign  ((resid   32 and name HN   )) ((resid   32 and name HB2  ))   2.55  0.75  0.00 ! #SUP  0.43
assign  ((resid   30 and name HB*  )) ((resid   32 and name HN   ))   4.21  2.41  0.00 ! #SUP  0.89
assign  ((resid   33 and name HN   )) ((resid   33 and name HG2  ))   4.29  2.49  0.00 ! #SUP  0.85
assign  ((resid   63 and name HA   )) ((resid   90 and name HN   ))   3.94  2.14  0.00 ! #SUP  0.84
assign  ((resid   89 and name HB2  )) ((resid   90 and name HN   ))   4.53  2.73  0.00 ! #SUP  0.98
assign  ((resid   90 and name HN   )) ((resid   90 and name HB   ))   3.53  1.73  0.00 ! #SUP  0.95
assign  ((resid   90 and name HN   )) ((resid   91 and name HN   ))   4.13  2.33  0.00 ! #SUP  0.76
assign  ((resid   89 and name HA   )) ((resid   90 and name HN   ))   2.63  0.83  0.00 ! #SUP  0.69
assign  ((resid   89 and name HB1  )) ((resid   90 and name HN   ))   3.73  1.93  0.00 ! #SUP  0.96
assign  ((resid   90 and name HN   )) ((resid   90 and name HG2* ))   3.28  1.48  0.00 ! #SUP  0.61
assign  ((resid   33 and name HN   )) ((resid   33 and name HA   ))   2.94  1.14  0.00 ! #SUP  0.99
assign  ((resid   33 and name HN   )) ((resid   33 and name HB2  ))   4.09  2.29  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB2  )) ((resid   33 and name HN   ))   3.15  1.35  0.00 ! #SUP  0.62
assign  ((resid   72 and name HN   )) ((resid   76 and name HN   ))   4.18  2.38  0.00 ! #SUP  0.97
assign  ((resid   73 and name HA   )) ((resid   76 and name HN   ))   3.84  2.04  0.00 ! #SUP  0.85
assign  ((resid   75 and name HB1  )) ((resid   76 and name HN   ))   3.08  1.28  0.00 ! #SUP  0.88
assign  ((resid   76 and name HN   )) ((resid   76 and name HB*  ))   2.71  0.91  0.00 ! #SUP  0.89
assign  ((resid   71 and name HG2* )) ((resid   76 and name HN   ))   3.40  1.60  0.00 ! #SUP  0.78
assign  ((resid   72 and name HA   )) ((resid   76 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   74 and name HA   )) ((resid   76 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   21 and name HD1* )) ((resid   76 and name HN   ))   4.36  2.56  0.00 ! #SUP  0.77
assign  ((resid   37 and name HG2* )) ((resid   76 and name HN   ))   4.81  3.01  0.00 ! #SUP  0.77
assign  ((resid   39 and name HN   )) ((resid   60 and name HN   ))   4.85  3.05  0.00 ! #SUP  0.85
assign  ((resid   39 and name HN   )) ((resid   58 and name HN   ))   4.65  2.85  0.00 ! #SUP  0.92
assign  ((resid   38 and name HA   )) ((resid   39 and name HN   ))   2.76  0.96  0.00 ! #SUP  0.66
assign  ((resid   39 and name HN   )) ((resid   59 and name HA   ))   3.57  1.77  0.00 ! #SUP  0.62
assign  ((resid   39 and name HN   )) ((resid   56 and name HA   ))   5.20  3.40  0.00 ! #SUP  0.89
assign  ((resid   39 and name HN   )) ((resid   39 and name HB   ))   2.97  1.17  0.00 ! #SUP  0.90
assign  ((resid   54 and name HN   )) ((resid   55 and name HN   ))   4.79  2.99  0.00 ! #SUP  0.98
assign  ((resid   54 and name HN   )) ((resid   54 and name HD1* ))   4.51  2.71  0.00 ! #SUP  0.91
assign  ((resid   46 and name HN   )) ((resid   47 and name HN   ))   3.88  2.08  0.00 ! #SUP  0.97
assign  ((resid   66 and name HN   )) ((resid   67 and name HN   ))   3.20  1.40  0.00 ! #SUP  0.81
assign  ((resid   67 and name HN   )) ((resid   68 and name HN   ))   3.49  1.69  0.00 ! #SUP  0.94
assign  ((resid   66 and name HB   )) ((resid   67 and name HN   ))   4.09  2.29  0.00 ! #SUP  0.91
assign  ((resid   62 and name HG*  )) ((resid   67 and name HN   ))   4.30  2.50  0.00 ! #SUP  0.98
assign  ((resid   62 and name HA   )) ((resid   67 and name HN   ))   4.10  2.30  0.00 ! #SUP  0.87
assign  ((resid   67 and name HN   )) ((resid   68 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.77
assign  ((resid   13 and name HN   )) ((resid   14 and name HN   ))   4.62  2.82  0.00 ! #SUP  0.91
assign  ((resid   13 and name HA   )) ((resid   14 and name HN   ))   2.98  1.18  0.00 ! #SUP  0.96
assign  ((resid   13 and name HB2  )) ((resid   14 and name HN   ))   3.42  1.62  0.00 ! #SUP  0.90
assign  ((resid   13 and name HB1  )) ((resid   14 and name HN   ))   3.42  1.62  0.00 ! #SUP  0.96
assign  ((resid   14 and name HN   )) ((resid   14 and name HB*  ))   2.80  1.00  0.00 ! #SUP  0.94
assign  ((resid    8 and name HN   )) ((resid   89 and name HB1  ))   5.06  3.26  0.00 ! #SUP  0.83
assign  ((resid   86 and name HN   )) ((resid   87 and name HN   ))   4.48  2.68  0.00 ! #SUP  0.97
assign  ((resid   85 and name HN   )) ((resid   86 and name HN   ))   3.48  1.68  0.00 ! #SUP  0.98
assign  ((resid   85 and name HA1  )) ((resid   86 and name HN   ))   2.69  0.89  0.00 ! #SUP  0.69
assign  ((resid   86 and name HN   )) ((resid   86 and name HB*  ))   2.56  0.76  0.00 ! #SUP  0.74
assign  ((resid   84 and name HB*  )) ((resid   86 and name HN   ))   4.14  2.34  0.00 ! #SUP  0.87
assign  ((resid   57 and name HN   )) ((resid   57 and name HB2  ))   4.11  2.31  0.00 ! #SUP  0.82
assign  ((resid   39 and name HG2* )) ((resid   57 and name HN   ))   5.13  3.33  0.00 ! #SUP  0.67
assign  ((resid    8 and name HN   )) ((resid   89 and name HN   ))   3.36  1.56  0.00 ! #SUP  0.97
assign  ((resid    7 and name HA   )) ((resid    8 and name HN   ))   2.49  0.69  0.00 ! #SUP  0.59
assign  ((resid   25 and name HA2  )) ((resid   26 and name HN   ))   3.01  1.21  0.00 ! #SUP  0.81
assign  ((resid    8 and name HN   )) ((resid   89 and name HB2  ))   3.77  1.97  0.00 ! #SUP  0.89
assign  ((resid   26 and name HN   )) ((resid   26 and name HB   ))   2.95  1.15  0.00 ! #SUP  0.90
assign  ((resid    7 and name HB2  )) ((resid    8 and name HN   ))   3.52  1.72  0.00 ! #SUP  0.98
assign  ((resid    8 and name HN   )) ((resid    8 and name HB   ))   3.17  1.37  0.00 ! #SUP  0.91
assign  ((resid    8 and name HN   )) ((resid   90 and name HG2* ))   4.40  2.60  0.00 ! #SUP  0.75
assign  ((resid   61 and name HN   )) ((resid   62 and name HN   ))   2.81  1.01  0.00 ! #SUP  0.92
assign  ((resid   62 and name HN   )) ((resid   90 and name HN   ))   3.27  1.47  0.00 ! #SUP  0.82
assign  ((resid   62 and name HN   )) ((resid   89 and name HA   ))   4.78  2.98  0.00 ! #SUP  0.97
assign  ((resid   60 and name HG2* )) ((resid   62 and name HN   ))   3.18  1.38  0.00 ! #SUP  0.71
assign  ((resid   62 and name HN   )) ((resid   91 and name HD1* ))   5.26  3.46  0.00 ! #SUP  0.88
assign  ((resid   84 and name HN   )) ((resid   86 and name HN   ))   5.31  3.51  0.00 ! #SUP  0.79
assign  ((resid   56 and name HN   )) ((resid   57 and name HN   ))   3.63  1.83  0.00 ! #SUP  0.90
assign  ((resid   53 and name HN   )) ((resid   54 and name HN   ))   3.06  1.26  0.00 ! #SUP  0.64
assign  ((resid   52 and name HN   )) ((resid   53 and name HN   ))   3.36  1.56  0.00 ! #SUP  0.99
assign  ((resid   74 and name HN   )) ((resid   77 and name HN   ))   5.13  3.33  0.00 ! #SUP  0.97
assign  ((resid   76 and name HN   )) ((resid   77 and name HN   ))   2.97  1.17  0.00 ! #SUP  0.99
assign  ((resid   77 and name HN   )) ((resid   78 and name HN   ))   2.96  1.16  0.00 ! #SUP  0.99
assign  ((resid   77 and name HN   )) ((resid   78 and name HB   ))   5.08  3.28  0.00 ! #SUP  0.91
assign  ((resid   77 and name HN   )) ((resid   77 and name HA   ))   2.92  1.12  0.00 ! #SUP  0.96
assign  ((resid   73 and name HA   )) ((resid   77 and name HN   ))   3.90  2.10  0.00 ! #SUP  0.84
assign  ((resid   77 and name HN   )) ((resid   77 and name HB*  ))   2.53  0.73  0.00 ! #SUP  0.89
assign  ((resid   76 and name HB*  )) ((resid   77 and name HN   ))   2.88  1.08  0.00 ! #SUP  0.87
assign  ((resid   71 and name HG2* )) ((resid   77 and name HN   ))   5.03  3.23  0.00 ! #SUP  0.96
assign  ((resid   21 and name HG2* )) ((resid   77 and name HN   ))   4.92  3.12  0.00 ! #SUP  0.99
assign  ((resid   37 and name HD1* )) ((resid   77 and name HN   ))   5.38  3.58  0.00 ! #SUP  0.99
assign  ((resid   48 and name HN   )) ((resid   49 and name HN   ))   3.18  1.38  0.00 ! #SUP  0.98
assign  ((resid   47 and name HN   )) ((resid   48 and name HN   ))   3.20  1.40  0.00 ! #SUP  0.94
assign  ((resid   48 and name HN   )) ((resid   49 and name HB*  ))   4.58  2.78  0.00 ! #SUP  0.47
assign  ((resid   48 and name HN   )) ((resid   48 and name HB*  ))   2.55  0.75  0.00 ! #SUP  0.81
assign  ((resid   22 and name HN   )) ((resid   24 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.79
assign  ((resid   21 and name HA   )) ((resid   22 and name HN   ))   2.77  0.97  0.00 ! #SUP  0.89
assign  ((resid   22 and name HN   )) ((resid   23 and name HA2  ))   4.91  3.11  0.00 ! #SUP  0.98
assign  ((resid   22 and name HN   )) ((resid   39 and name HA   ))   4.83  3.03  0.00 ! #SUP  0.75
assign  ((resid   21 and name HB   )) ((resid   22 and name HN   ))   3.06  1.26  0.00 ! #SUP  0.98
assign  ((resid   22 and name HN   )) ((resid   40 and name HB*  ))   4.18  2.38  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   22 and name HG12 ))   5.00  3.20  0.00 ! #SUP  0.88
assign  ((resid   21 and name HG11 )) ((resid   22 and name HN   ))   4.53  2.73  0.00 ! #SUP  0.97
assign  ((resid   22 and name HN   )) ((resid   22 and name HG2* ))   3.23  1.43  0.00 ! #SUP  0.98
assign  ((resid   22 and name HN   )) ((resid   37 and name HD1* ))   4.52  2.72  0.00 ! #SUP  0.98
assign  ((resid   29 and name HN   )) ((resid   29 and name HB1  ))   3.77  1.97  0.00 ! #SUP  0.95
assign  ((resid   29 and name HN   )) ((resid   29 and name HB2  ))   3.77  1.97  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   30 and name HB*  ))   4.38  2.58  0.00 ! #SUP  0.99
assign  ((resid   49 and name HN   )) ((resid   50 and name HN   ))   3.17  1.37  0.00 ! #SUP  0.99
assign  ((resid   48 and name HN   )) ((resid   50 and name HN   ))   4.13  2.33  0.00 ! #SUP  0.93
assign  ((resid   46 and name HN   )) ((resid   50 and name HN   ))   5.16  3.36  0.00 ! #SUP  0.39
assign  ((resid   50 and name HN   )) ((resid   51 and name HN   ))   3.04  1.24  0.00 ! #SUP  0.99
assign  ((resid   50 and name HN   )) ((resid   50 and name HA   ))   2.91  1.11  0.00 ! #SUP  0.96
assign  ((resid   49 and name HB*  )) ((resid   50 and name HN   ))   3.58  1.78  0.00 ! #SUP  0.96
assign  ((resid   50 and name HN   )) ((resid   50 and name HB*  ))   2.54  0.74  0.00 ! #SUP  0.93
assign  ((resid   50 and name HN   )) ((resid   50 and name HG2  ))   4.06  2.26  0.00 ! #SUP  0.97
assign  ((resid   69 and name HB   )) ((resid   70 and name HN   ))   4.80  3.00  0.00 ! #SUP  0.85
assign  ((resid   51 and name HN   )) ((resid   53 and name HN   ))   5.10  3.30  0.00 ! #SUP  0.85
assign  ((resid   48 and name HA   )) ((resid   51 and name HN   ))   3.83  2.03  0.00 ! #SUP  0.73
assign  ((resid   51 and name HN   )) ((resid   51 and name HB2  ))   2.90  1.10  0.00 ! #SUP  0.87
assign  ((resid   51 and name HN   )) ((resid   51 and name HB1  ))   3.03  1.23  0.00 ! #SUP  0.86
assign  ((resid   50 and name HB*  )) ((resid   51 and name HN   ))   3.13  1.33  0.00 ! #SUP  0.80
assign  ((resid   48 and name HB*  )) ((resid   51 and name HN   ))   4.87  3.07  0.00 ! #SUP  0.96
assign  ((resid   10 and name HD2* )) ((resid   51 and name HN   ))   5.24  3.44  0.00 ! #SUP  0.58
assign  ((resid   10 and name HD1* )) ((resid   51 and name HN   ))   5.24  3.44  0.00 ! #SUP  0.70
assign  ((resid   70 and name HN   )) ((resid   71 and name HN   ))   3.16  1.36  0.00 ! #SUP  0.92
assign  ((resid   69 and name HA   )) ((resid   70 and name HN   ))   3.36  1.56  0.00 ! #SUP  0.97
assign  ((resid   70 and name HN   )) ((resid   71 and name HG2* ))   4.23  2.43  0.00 ! #SUP  0.95
assign  ((resid   70 and name HN   )) ((resid   71 and name HG1* ))   4.70  2.90  0.00 ! #SUP  0.78
assign  ((resid   20 and name HN   )) ((resid   42 and name HA   ))   3.73  1.93  0.00 ! #SUP  0.76
assign  ((resid   20 and name HN   )) ((resid   41 and name HG2* ))   4.79  2.99  0.00 ! #SUP  0.97
assign  ((resid   19 and name HD1* )) ((resid   20 and name HN   ))   4.50  2.70  0.00 ! #SUP  0.86
assign  ((resid   80 and name HN   )) ((resid   81 and name HN   ))   3.03  1.23  0.00 ! #SUP  0.69
assign  ((resid   79 and name HN   )) ((resid   80 and name HN   ))   3.12  1.32  0.00 ! #SUP  0.99
assign  ((resid   80 and name HN   )) ((resid   81 and name HA   ))   5.30  3.50  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   80 and name HN   ))   4.08  2.28  0.00 ! #SUP  0.72
assign  ((resid   80 and name HN   )) ((resid   80 and name HB2  ))   2.87  1.07  0.00 ! #SUP  0.94
assign  ((resid   63 and name HB   )) ((resid   80 and name HN   ))   5.23  3.43  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   80 and name HB1  ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   80 and name HN   )) ((resid   83 and name HG2* ))   4.46  2.66  0.00 ! #SUP  0.45
assign  ((resid   80 and name HN   )) ((resid   80 and name HD2* ))   3.18  1.38  0.00 ! #SUP  0.99
assign  ((resid   79 and name HG2* )) ((resid   80 and name HN   ))   3.85  2.05  0.00 ! #SUP  0.94
assign  ((resid   76 and name HN   )) ((resid   78 and name HN   ))   4.21  2.41  0.00 ! #SUP  0.95
assign  ((resid   74 and name HA   )) ((resid   78 and name HN   ))   4.84  3.04  0.00 ! #SUP  0.83
assign  ((resid   78 and name HN   )) ((resid   78 and name HB   ))   2.73  0.93  0.00 ! #SUP  0.89
assign  ((resid   77 and name HA   )) ((resid   78 and name HN   ))   3.53  1.73  0.00 ! #SUP  0.99
assign  ((resid   78 and name HN   )) ((resid   79 and name HA   ))   5.43  3.63  0.00 ! #SUP  0.84
assign  ((resid   78 and name HN   )) ((resid   79 and name HB   ))   5.46  3.66  0.00 ! #SUP  1.00
assign  ((resid   77 and name HB*  )) ((resid   78 and name HN   ))   3.15  1.35  0.00 ! #SUP  0.92
assign  ((resid   78 and name HN   )) ((resid   78 and name HG2* ))   3.72  1.92  0.00 ! #SUP  0.87
assign  ((resid   14 and name HN   )) ((resid   15 and name HN   ))   3.18  1.38  0.00 ! #SUP  0.98
assign  ((resid   15 and name HN   )) ((resid   16 and name HN   ))   2.69  0.89  0.00 ! #SUP  0.95
assign  ((resid   13 and name HA   )) ((resid   15 and name HN   ))   4.46  2.66  0.00 ! #SUP  0.99
assign  ((resid   15 and name HN   )) ((resid   16 and name HA1  ))   5.42  3.62  0.00 ! #SUP  0.91
assign  ((resid   15 and name HN   )) ((resid   16 and name HA2  ))   5.23  3.43  0.00 ! #SUP  0.99
assign  ((resid   15 and name HN   )) ((resid   15 and name HB1  ))   3.05  1.25  0.00 ! #SUP  0.89
assign  ((resid   15 and name HN   )) ((resid   15 and name HB2  ))   3.05  1.25  0.00 ! #SUP  0.90
assign  ((resid   80 and name HN   )) ((resid   82 and name HN   ))   4.36  2.56  0.00 ! #SUP  0.97
assign  ((resid   81 and name HN   )) ((resid   82 and name HN   ))   2.88  1.08  0.00 ! #SUP  0.98
assign  ((resid   82 and name HN   )) ((resid   82 and name HA   ))   2.92  1.12  0.00 ! #SUP  0.99
assign  ((resid   80 and name HA   )) ((resid   82 and name HN   ))   4.47  2.67  0.00 ! #SUP  0.95
assign  ((resid   78 and name HA   )) ((resid   82 and name HN   ))   4.33  2.53  0.00 ! #SUP  0.77
assign  ((resid   79 and name HA   )) ((resid   82 and name HN   ))   3.48  1.68  0.00 ! #SUP  0.90
assign  ((resid   81 and name HD*  )) ((resid   82 and name HN   ))   4.58  2.78  0.00 ! #SUP  0.99
assign  ((resid   82 and name HN   )) ((resid   82 and name HB2  ))   3.08  1.28  0.00 ! #SUP  0.93
assign  ((resid   80 and name HD2* )) ((resid   82 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.79
assign  ((resid   73 and name HN   )) ((resid   74 and name HN   ))   3.88  2.08  0.00 ! #SUP  0.99
assign  ((resid   74 and name HN   )) ((resid   75 and name HN   ))   3.79  1.99  0.00 ! #SUP  0.96
assign  ((resid   72 and name HB   )) ((resid   74 and name HN   ))   2.49  0.69  0.00 ! #SUP  0.44
assign  ((resid   73 and name HB1  )) ((resid   74 and name HN   ))   4.10  2.30  0.00 ! #SUP  0.97
assign  ((resid   72 and name HG2* )) ((resid   74 and name HN   ))   4.45  2.65  0.00 ! #SUP  0.99
assign  ((resid   45 and name HN   )) ((resid   49 and name HE22 ))   5.43  3.63  0.00 ! #SUP  0.76
assign  ((resid   21 and name HN   )) ((resid   22 and name HN   ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   21 and name HN   ))   2.63  0.83  0.00 ! #SUP  0.75
assign  ((resid   20 and name HB1  )) ((resid   21 and name HN   ))   3.67  1.87  0.00 ! #SUP  0.91
assign  ((resid   21 and name HN   )) ((resid   21 and name HB   ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   21 and name HN   )) ((resid   40 and name HB*  ))   4.43  2.63  0.00 ! #SUP  0.55
assign  ((resid   21 and name HN   )) ((resid   21 and name HG11 ))   3.16  1.36  0.00 ! #SUP  0.75
assign  ((resid   21 and name HN   )) ((resid   21 and name HG12 ))   3.79  1.99  0.00 ! #SUP  0.94
assign  ((resid   21 and name HN   )) ((resid   21 and name HD1* ))   4.06  2.26  0.00 ! #SUP  0.89
assign  ((resid   49 and name HN   )) ((resid   49 and name HE21 ))   4.29  2.49  0.00 ! #SUP  0.86
assign  ((resid   43 and name HN   )) ((resid   49 and name HE21 ))   5.50  3.70  0.00 ! #SUP  0.33
assign  ((resid   44 and name HA   )) ((resid   49 and name HE21 ))   4.23  2.43  0.00 ! #SUP  0.86
assign  ((resid   44 and name HA   )) ((resid   49 and name HE22 ))   3.99  2.19  0.00 ! #SUP  0.80
assign  ((resid   22 and name HN   )) ((resid   23 and name HN   ))   4.43  2.63  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   24 and name HN   ))   4.37  2.57  0.00 ! #SUP  0.99
assign  ((resid   22 and name HA   )) ((resid   23 and name HN   ))   2.59  0.79  0.00 ! #SUP  0.76
assign  ((resid   23 and name HN   )) ((resid   73 and name HB1  ))   3.95  2.15  0.00 ! #SUP  0.63
assign  ((resid   21 and name HB   )) ((resid   23 and name HN   ))   5.38  3.58  0.00 ! #SUP  0.84
assign  ((resid   22 and name HG12 )) ((resid   23 and name HN   ))   3.62  1.82  0.00 ! #SUP  0.90
assign  ((resid   22 and name HG11 )) ((resid   23 and name HN   ))   3.62  1.82  0.00 ! #SUP  0.93
assign  ((resid   21 and name HD1* )) ((resid   23 and name HN   ))   4.34  2.54  0.00 ! #SUP  0.86
assign  ((resid   82 and name HA   )) ((resid   82 and name HD22 ))   3.80  2.00  0.00 ! #SUP  0.88
assign  ((resid   82 and name HB2  )) ((resid   82 and name HD22 ))   4.01  2.21  0.00 ! #SUP  0.96
assign  ((resid   27 and name HN   )) ((resid   28 and name HN   ))   4.48  2.68  0.00 ! #SUP  0.81
assign  ((resid   26 and name HA   )) ((resid   27 and name HN   ))   2.60  0.80  0.00 ! #SUP  0.52
assign  ((resid   86 and name HA   )) ((resid   86 and name HD21 ))   4.69  2.89  0.00 ! #SUP  0.98
assign  ((resid   82 and name HA   )) ((resid   82 and name HD21 ))   3.72  1.92  0.00 ! #SUP  0.59
assign  ((resid   86 and name HA   )) ((resid   86 and name HD22 ))   4.69  2.89  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   42 and name HA   ))   5.01  3.21  0.00 ! #SUP  0.90
assign  ((resid   17 and name HB2  )) ((resid   19 and name HN   ))   4.32  2.52  0.00 ! #SUP  0.87
assign  ((resid   17 and name HG   )) ((resid   19 and name HN   ))   4.24  2.44  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB1  )) ((resid   19 and name HN   ))   4.32  2.52  0.00 ! #SUP  0.89
assign  ((resid   19 and name HN   )) ((resid   19 and name HG11 ))   3.68  1.88  0.00 ! #SUP  0.94
assign  ((resid   19 and name HN   )) ((resid   19 and name HG12 ))   3.04  1.24  0.00 ! #SUP  0.93
assign  ((resid   72 and name HB   )) ((resid   73 and name HE21 ))   3.69  1.89  0.00 ! #SUP  0.90
assign  ((resid   73 and name HB2  )) ((resid   73 and name HE21 ))   5.26  3.46  0.00 ! #SUP  1.00
assign  ((resid   21 and name HD1* )) ((resid   73 and name HE21 ))   4.93  3.13  0.00 ! #SUP  0.81
assign  ((resid   72 and name HB   )) ((resid   73 and name HE22 ))   3.21  1.41  0.00 ! #SUP  0.43
assign  ((resid   71 and name HN   )) ((resid   72 and name HN   ))   4.57  2.77  0.00 ! #SUP  0.91
assign  ((resid   71 and name HN   )) ((resid   71 and name HB   ))   3.95  2.15  0.00 ! #SUP  0.57
assign  ((resid   35 and name HB*  )) ((resid   71 and name HN   ))   3.70  1.90  0.00 ! #SUP  0.58
assign  ((resid   71 and name HN   )) ((resid   71 and name HG1* ))   3.09  1.29  0.00 ! #SUP  0.88
assign  ((resid   83 and name HN   )) ((resid   84 and name HN   ))   4.70  2.90  0.00 ! #SUP  1.00
assign  ((resid   81 and name HN   )) ((resid   83 and name HN   ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   82 and name HN   )) ((resid   83 and name HN   ))   2.86  1.06  0.00 ! #SUP  0.98
assign  ((resid   83 and name HN   )) ((resid   83 and name HB   ))   3.66  1.86  0.00 ! #SUP  0.98
assign  ((resid   83 and name HN   )) ((resid   83 and name HA   ))   2.90  1.10  0.00 ! #SUP  1.00
assign  ((resid   82 and name HB1  )) ((resid   83 and name HN   ))   4.02  2.22  0.00 ! #SUP  1.00
assign  ((resid   83 and name HN   )) ((resid   83 and name HG2* ))   2.67  0.87  0.00 ! #SUP  0.81
assign  ((resid   80 and name HA   )) ((resid   83 and name HN   ))   3.92  2.12  0.00 ! #SUP  0.85
assign  ((resid   82 and name HB2  )) ((resid   83 and name HN   ))   4.02  2.22  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   92 and name HN   ))   5.30  3.50  0.00 ! #SUP  0.98
assign  ((resid   91 and name HA   )) ((resid   92 and name HN   ))   2.72  0.92  0.00 ! #SUP  0.78
assign  ((resid   91 and name HG11 )) ((resid   92 and name HN   ))   5.02  3.22  0.00 ! #SUP  0.88
assign  ((resid   91 and name HB   )) ((resid   92 and name HN   ))   3.85  2.05  0.00 ! #SUP  0.96
assign  ((resid   25 and name HN   )) ((resid   26 and name HN   ))   4.39  2.59  0.00 ! #SUP  0.99
assign  ((resid   24 and name HA   )) ((resid   25 and name HN   ))   2.44  0.64  0.00 ! #SUP  0.26
assign  ((resid   24 and name HG2  )) ((resid   25 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.86
assign  ((resid   24 and name HN   )) ((resid   25 and name HN   ))   4.83  3.03  0.00 ! #SUP  0.99
assign  ((resid   35 and name HA   )) ((resid   36 and name HN   ))   2.58  0.78  0.00 ! #SUP  0.65
assign  ((resid   35 and name HB*  )) ((resid   36 and name HN   ))   3.11  1.31  0.00 ! #SUP  0.95
assign  ((resid   36 and name HN   )) ((resid   37 and name HD1* ))   5.05  3.25  0.00 ! #SUP  0.89
assign  ((resid   14 and name HN   )) ((resid   16 and name HN   ))   4.45  2.65  0.00 ! #SUP  0.83
assign  ((resid   13 and name HN   )) ((resid   16 and name HN   ))   3.89  2.09  0.00 ! #SUP  0.90
assign  ((resid   16 and name HN   )) ((resid   16 and name HA2  ))   2.81  1.01  0.00 ! #SUP  0.83
assign  ((resid   15 and name HB1  )) ((resid   16 and name HN   ))   3.83  2.03  0.00 ! #SUP  0.88
assign  ((resid   15 and name HB2  )) ((resid   16 and name HN   ))   3.83  2.03  0.00 ! #SUP  0.86
assign  ((resid   12 and name HB1  )) ((resid   16 and name HN   ))   4.18  2.38  0.00 ! #SUP  0.61
assign  ((resid   12 and name HD*  )) ((resid   16 and name HN   ))   5.38  3.58  0.00 ! #SUP  0.77
assign  ((resid   72 and name HN   )) ((resid   73 and name HN   ))   4.84  3.04  0.00 ! #SUP  0.98
assign  ((resid   71 and name HA   )) ((resid   72 and name HN   ))   2.76  0.96  0.00 ! #SUP  0.91
assign  ((resid   72 and name HN   )) ((resid   75 and name HA   ))   5.38  3.58  0.00 ! #SUP  0.79
assign  ((resid   72 and name HN   )) ((resid   75 and name HB1  ))   3.23  1.43  0.00 ! #SUP  0.81
assign  ((resid   71 and name HB   )) ((resid   72 and name HN   ))   2.76  0.96  0.00 ! #SUP  0.69
assign  ((resid   72 and name HN   )) ((resid   72 and name HG2* ))   3.60  1.80  0.00 ! #SUP  0.86
assign  ((resid   71 and name HG2* )) ((resid   72 and name HN   ))   3.41  1.61  0.00 ! #SUP  0.99
assign  ((resid   84 and name HN   )) ((resid   85 and name HN   ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   85 and name HN   ))   2.85  1.05  0.00 ! #SUP  0.93
assign  ((resid   85 and name HN   )) ((resid   85 and name HA1  ))   2.84  1.04  0.00 ! #SUP  0.99
assign  ((resid   85 and name HN   )) ((resid   85 and name HA2  ))   2.86  1.06  0.00 ! #SUP  0.99
assign  ((resid   84 and name HB*  )) ((resid   85 and name HN   ))   2.76  0.96  0.00 ! #SUP  0.84
assign  ((resid   84 and name HD*  )) ((resid   85 and name HN   ))   3.15  1.35  0.00 ! #SUP  0.31
assign  ((resid   29 and name HA   )) ((resid   31 and name HN   ))   5.07  3.27  0.00 ! #SUP  0.97
assign  ((resid   30 and name HB*  )) ((resid   31 and name HN   ))   3.53  1.73  0.00 ! #SUP  0.99
assign  ((resid   40 and name HN   )) ((resid   41 and name HN   ))   3.42  1.62  0.00 ! #SUP  0.99
assign  ((resid   20 and name HN   )) ((resid   41 and name HN   ))   3.25  1.45  0.00 ! #SUP  0.66
assign  ((resid   21 and name HA   )) ((resid   41 and name HN   ))   4.11  2.31  0.00 ! #SUP  0.79
assign  ((resid   20 and name HB2  )) ((resid   41 and name HN   ))   3.57  1.77  0.00 ! #SUP  0.98
assign  ((resid   40 and name HB*  )) ((resid   41 and name HN   ))   3.08  1.28  0.00 ! #SUP  0.63
assign  ((resid   39 and name HG1* )) ((resid   41 and name HN   ))   3.48  1.68  0.00 ! #SUP  0.66
assign  ((resid   45 and name HN   )) ((resid   46 and name HN   ))   3.16  1.36  0.00 ! #SUP  0.93
assign  ((resid   37 and name HN   )) ((resid   59 and name HE22 ))   4.97  3.17  0.00 ! #SUP  0.99
assign  ((resid   36 and name HA2  )) ((resid   59 and name HE22 ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   36 and name HA1  )) ((resid   59 and name HE22 ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   17 and name HN   )) ((resid   18 and name HN   ))   4.34  2.54  0.00 ! #SUP  0.98
assign  ((resid   18 and name HN   )) ((resid   19 and name HN   ))   3.14  1.34  0.00 ! #SUP  0.75
assign  ((resid   16 and name HA1  )) ((resid   18 and name HN   ))   4.61  2.81  0.00 ! #SUP  0.49
assign  ((resid   17 and name HB2  )) ((resid   18 and name HN   ))   4.68  2.88  0.00 ! #SUP  0.79
assign  ((resid   17 and name HG   )) ((resid   18 and name HN   ))   4.94  3.14  0.00 ! #SUP  0.99
assign  ((resid   17 and name HB1  )) ((resid   18 and name HN   ))   4.68  2.88  0.00 ! #SUP  0.99
assign  ((resid   52 and name HN   )) ((resid   54 and name HN   ))   4.70  2.90  0.00 ! #SUP  0.89
assign  ((resid   50 and name HN   )) ((resid   52 and name HN   ))   4.73  2.93  0.00 ! #SUP  0.96
assign  ((resid   51 and name HB2  )) ((resid   52 and name HN   ))   4.20  2.40  0.00 ! #SUP  0.99
assign  ((resid   51 and name HB1  )) ((resid   52 and name HN   ))   3.39  1.59  0.00 ! #SUP  0.88
assign  ((resid   63 and name HA   )) ((resid   65 and name HN   ))   4.03  2.23  0.00 ! #SUP  0.94
assign  ((resid   64 and name HN   )) ((resid   65 and name HN   ))   3.30  1.50  0.00 ! #SUP  0.99
assign  ((resid   65 and name HN   )) ((resid   66 and name HN   ))   3.13  1.33  0.00 ! #SUP  0.95
assign  ((resid   65 and name HN   )) ((resid   65 and name HA1  ))   2.89  1.09  0.00 ! #SUP  0.99
assign  ((resid   64 and name HB2  )) ((resid   65 and name HN   ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB1  )) ((resid   65 and name HN   ))   4.59  2.79  0.00 ! #SUP  0.85
assign  ((resid   62 and name HG*  )) ((resid   65 and name HN   ))   3.26  1.46  0.00 ! #SUP  0.56
assign  ((resid   65 and name HN   )) ((resid   88 and name HB2  ))   4.83  3.03  0.00 ! #SUP  0.87
assign  ((resid    4 and name HN   )) ((resid   94 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   63 and name HB   )) ((resid   64 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.81
assign  ((resid    4 and name HN   )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   10 and name HN   )) ((resid   88 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   54 and name HG2* )) ((resid   55 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   63 and name HN   )) ((resid   68 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   49 and name HN   )) ((resid   50 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.79
assign  ((resid   63 and name HA   )) ((resid   66 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   62 and name HA   )) ((resid   66 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid    3 and name HG*  )) ((resid    5 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   34 and name HN   )) ((resid   35 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   72 and name HG2* )) ((resid   75 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   60 and name HG2* )) ((resid   63 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   63 and name HN   )) ((resid   66 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.62
assign  ((resid   35 and name HD2* )) ((resid   37 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HN   )) ((resid   37 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.78
assign  ((resid   62 and name HN   )) ((resid   63 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid   38 and name HA   )) ((resid   59 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   78 and name HN   )) ((resid   81 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   81 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   34 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.79
assign  ((resid   72 and name HB   )) ((resid   76 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   28 and name HB*  )) ((resid   33 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.93
assign  ((resid   30 and name HB*  )) ((resid   33 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.93
assign  ((resid   21 and name HG2* )) ((resid   39 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.63
assign  ((resid    8 and name HG1* )) ((resid   54 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.51
assign  ((resid   53 and name HB1  )) ((resid   54 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   53 and name HG*  )) ((resid   54 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   53 and name HB2  )) ((resid   54 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.92
assign  ((resid   39 and name HN   )) ((resid   40 and name HN   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   47 and name HN   )) ((resid   50 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid    6 and name HN   )) ((resid   90 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid    5 and name HD2* )) ((resid    6 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.93
assign  ((resid    6 and name HN   )) ((resid   90 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.93
assign  ((resid    6 and name HN   )) ((resid   91 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.65
assign  ((resid    6 and name HN   )) ((resid    7 and name HD1  ))   5.50  3.70  0.00 ! #SUP  0.67
assign  ((resid    6 and name HN   )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.80
assign  ((resid    6 and name HN   )) ((resid   91 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.73
assign  ((resid   62 and name HN   )) ((resid   90 and name HB   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   62 and name HN   )) ((resid   91 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.79
assign  ((resid   26 and name HN   )) ((resid   35 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.40
assign  ((resid   24 and name HA   )) ((resid   26 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.70
assign  ((resid   26 and name HN   )) ((resid   34 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.69
assign  ((resid   84 and name HD*  )) ((resid   86 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid    8 and name HG1* )) ((resid   53 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.71
assign  ((resid   53 and name HN   )) ((resid   54 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.78
assign  ((resid   51 and name HA   )) ((resid   53 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.72
assign  ((resid   22 and name HN   )) ((resid   37 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.59
assign  ((resid   22 and name HN   )) ((resid   40 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   27 and name HN   )) ((resid   29 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid   12 and name HE*  )) ((resid   50 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   12 and name HE*  )) ((resid   51 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.22
assign  ((resid   35 and name HB*  )) ((resid   70 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   19 and name HG12 )) ((resid   20 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   20 and name HN   )) ((resid   39 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   19 and name HG11 )) ((resid   20 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   19 and name HB   )) ((resid   20 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.90
assign  ((resid   20 and name HN   )) ((resid   40 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.45
assign  ((resid   49 and name HN   )) ((resid   49 and name HE22 ))   5.50  3.70  0.00 ! #SUP  0.50
assign  ((resid   22 and name HG2* )) ((resid   23 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.59
assign  ((resid   23 and name HN   )) ((resid   24 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   23 and name HN   )) ((resid   73 and name HG2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   11 and name HB2  )) ((resid   86 and name HD22 ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid   11 and name HB2  )) ((resid   86 and name HD21 ))   5.50  3.70  0.00 ! #SUP  0.60
assign  ((resid   19 and name HN   )) ((resid   20 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   21 and name HD1* )) ((resid   73 and name HE22 ))   5.50  3.70  0.00 ! #SUP  0.67
assign  ((resid   35 and name HN   )) ((resid   71 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.54
assign  ((resid   36 and name HN   )) ((resid   37 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   13 and name HA   )) ((resid   16 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.71
assign  ((resid   12 and name HE*  )) ((resid   46 and name HN   ))   5.50  3.70  0.00 ! #SUP  0.83
assign  ((resid   36 and name HA2  )) ((resid   59 and name HE21 ))   5.50  3.70  0.00 ! #SUP  0.93
assign  ((resid   36 and name HA1  )) ((resid   59 and name HE21 ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   75 and name HA   )) ((resid   75 and name HE*  ))   4.82  3.02  0.00 ! #SUP  0.99
assign  ((resid   71 and name HB   )) ((resid   75 and name HE*  ))   4.76  2.96  0.00 ! #SUP  0.99
assign  ((resid   75 and name HE*  )) ((resid   79 and name HB   ))   5.10  3.30  0.00 ! #SUP  0.96
assign  ((resid   66 and name HG2* )) ((resid   75 and name HE*  ))   3.02  1.22  0.00 ! #SUP  1.00
assign  ((resid   75 and name HE*  )) ((resid   79 and name HG2* ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   71 and name HG1* )) ((resid   75 and name HE*  ))   3.32  1.52  0.00 ! #SUP  0.96
assign  ((resid   75 and name HE*  )) ((resid   79 and name HG1* ))   4.14  2.34  0.00 ! #SUP  0.90
assign  ((resid   26 and name HB   )) ((resid   38 and name HE*  ))   4.50  2.70  0.00 ! #SUP  0.86
assign  ((resid   36 and name HA2  )) ((resid   38 and name HE*  ))   4.03  2.23  0.00 ! #SUP  0.93
assign  ((resid   36 and name HA1  )) ((resid   38 and name HE*  ))   4.03  2.23  0.00 ! #SUP  0.87
assign  ((resid    4 and name HB1  )) ((resid    6 and name HE*  ))   4.03  2.23  0.00 ! #SUP  0.75
assign  ((resid   24 and name HB*  )) ((resid   38 and name HE*  ))   4.24  2.44  0.00 ! #SUP  0.75
assign  ((resid   26 and name HG2* )) ((resid   38 and name HE*  ))   4.49  2.69  0.00 ! #SUP  0.94
assign  ((resid   24 and name HG2  )) ((resid   38 and name HE*  ))   4.49  2.69  0.00 ! #SUP  0.84
assign  ((resid   24 and name HG1  )) ((resid   38 and name HE*  ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   38 and name HE*  )) ((resid   59 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.63
assign  ((resid    4 and name HG2  )) ((resid    6 and name HE*  ))   5.31  3.51  0.00 ! #SUP  0.95
assign  ((resid    6 and name HE*  )) ((resid   93 and name HB2  ))   4.99  3.19  0.00 ! #SUP  0.92
assign  ((resid    6 and name HE*  )) ((resid   54 and name HA   ))   5.15  3.35  0.00 ! #SUP  0.29
assign  ((resid   60 and name HG2* )) ((resid   89 and name HD*  ))   3.48  1.68  0.00 ! #SUP  0.47
assign  ((resid   87 and name HA   )) ((resid   89 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.48
assign  ((resid   89 and name HA   )) ((resid   89 and name HD*  ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   89 and name HD*  ))   4.44  2.64  0.00 ! #SUP  0.95
assign  ((resid   60 and name HA   )) ((resid   89 and name HD*  ))   4.74  2.94  0.00 ! #SUP  0.95
assign  ((resid    8 and name HA   )) ((resid   89 and name HD*  ))   5.14  3.34  0.00 ! #SUP  1.00
assign  ((resid    8 and name HB   )) ((resid   89 and name HD*  ))   3.53  1.73  0.00 ! #SUP  0.98
assign  ((resid   68 and name HB1  )) ((resid   75 and name HD*  ))   3.89  2.09  0.00 ! #SUP  0.70
assign  ((resid   66 and name HD1* )) ((resid   75 and name HD*  ))   4.78  2.98  0.00 ! #SUP  0.97
assign  ((resid   87 and name HG2* )) ((resid   89 and name HD*  ))   4.97  3.17  0.00 ! #SUP  0.97
assign  ((resid   63 and name HG1* )) ((resid   89 and name HD*  ))   4.34  2.54  0.00 ! #SUP  0.99
assign  ((resid    9 and name HA   )) ((resid   89 and name HD*  ))   4.51  2.71  0.00 ! #SUP  1.00
assign  ((resid   10 and name HB1  )) ((resid   89 and name HD*  ))   5.18  3.38  0.00 ! #SUP  0.97
assign  ((resid   36 and name HA2  )) ((resid   38 and name HD*  ))   4.90  3.10  0.00 ! #SUP  0.99
assign  ((resid   36 and name HA1  )) ((resid   38 and name HD*  ))   4.90  3.10  0.00 ! #SUP  0.92
assign  ((resid   38 and name HA   )) ((resid   38 and name HD*  ))   3.20  1.40  0.00 ! #SUP  1.00
assign  ((resid   38 and name HD*  )) ((resid   59 and name HA   ))   3.57  1.77  0.00 ! #SUP  0.76
assign  ((resid   75 and name HD*  )) ((resid   79 and name HB   ))   4.48  2.68  0.00 ! #SUP  0.30
assign  ((resid   38 and name HD*  )) ((resid   59 and name HB2  ))   3.48  1.68  0.00 ! #SUP  1.00
assign  ((resid   68 and name HG   )) ((resid   75 and name HD*  ))   5.44  3.64  0.00 ! #SUP  0.77
assign  ((resid   38 and name HD*  )) ((resid   59 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   75 and name HD*  )) ((resid   76 and name HB*  ))   4.02  2.22  0.00 ! #SUP  0.66
assign  ((resid   75 and name HD*  )) ((resid   78 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.88
assign  ((resid   66 and name HG2* )) ((resid   75 and name HD*  ))   4.14  2.34  0.00 ! #SUP  0.67
assign  ((resid   37 and name HA   )) ((resid   38 and name HD*  ))   4.02  2.22  0.00 ! #SUP  0.54
assign  ((resid   75 and name HD*  )) ((resid   78 and name HB   ))   4.77  2.97  0.00 ! #SUP  0.63
assign  ((resid   75 and name HA   )) ((resid   75 and name HD*  ))   3.33  1.53  0.00 ! #SUP  0.62
assign  ((resid   75 and name HD*  )) ((resid   76 and name HA   ))   3.58  1.78  0.00 ! #SUP  0.60
assign  ((resid   71 and name HB   )) ((resid   75 and name HD*  ))   3.35  1.55  0.00 ! #SUP  0.62
assign  ((resid   71 and name HG2* )) ((resid   75 and name HD*  ))   2.76  0.96  0.00 ! #SUP  0.62
assign  ((resid   71 and name HG1* )) ((resid   75 and name HD*  ))   3.06  1.26  0.00 ! #SUP  0.60
assign  ((resid   17 and name HD1* )) ((resid   89 and name HZ   ))   3.15  1.35  0.00 ! #SUP  0.90
assign  ((resid   17 and name HD2* )) ((resid   89 and name HZ   ))   3.15  1.35  0.00 ! #SUP  0.46
assign  ((resid   87 and name HG2* )) ((resid   89 and name HZ   ))   3.46  1.66  0.00 ! #SUP  0.76
assign  ((resid   19 and name HD1* )) ((resid   89 and name HZ   ))   4.17  2.37  0.00 ! #SUP  0.92
assign  ((resid   87 and name HG1* )) ((resid   89 and name HZ   ))   3.46  1.66  0.00 ! #SUP  0.92
assign  ((resid   10 and name HG   )) ((resid   89 and name HE*  ))   4.11  2.31  0.00 ! #SUP  0.60
assign  ((resid   10 and name HB1  )) ((resid   89 and name HE*  ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG2* )) ((resid   89 and name HE*  ))   3.74  1.94  0.00 ! #SUP  0.85
assign  ((resid   63 and name HG1* )) ((resid   89 and name HE*  ))   3.81  2.01  0.00 ! #SUP  0.96
assign  ((resid   54 and name HD1* )) ((resid   89 and name HE*  ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   10 and name HA   )) ((resid   89 and name HE*  ))   5.41  3.61  0.00 ! #SUP  0.95
assign  ((resid   88 and name HA   )) ((resid   89 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   87 and name HA   )) ((resid   89 and name HE*  ))   5.05  3.25  0.00 ! #SUP  0.63
assign  ((resid    6 and name HD*  )) ((resid   90 and name HA   ))   5.11  3.31  0.00 ! #SUP  0.94
assign  ((resid   80 and name HA   )) ((resid   89 and name HE*  ))   4.39  2.59  0.00 ! #SUP  0.45
assign  ((resid    4 and name HB1  )) ((resid    6 and name HD*  ))   3.42  1.62  0.00 ! #SUP  0.97
assign  ((resid   87 and name HB   )) ((resid   89 and name HE*  ))   3.02  1.22  0.00 ! #SUP  0.42
assign  ((resid    6 and name HD*  )) ((resid    8 and name HG2* ))   2.47  0.67  0.00 ! #SUP  0.83
assign  ((resid    6 and name HD*  )) ((resid    8 and name HA   ))   4.59  2.79  0.00 ! #SUP  0.96
assign  ((resid    9 and name HA   )) ((resid   87 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid    9 and name HA   )) ((resid   88 and name HA   ))   2.92  1.12  0.00 ! #SUP  0.94
assign  ((resid    9 and name HA   )) ((resid   88 and name HD*  ))   5.32  3.52  0.00 ! #SUP  0.87
assign  ((resid    8 and name HA   )) ((resid    9 and name HA   ))   4.71  2.91  0.00 ! #SUP  1.00
assign  ((resid    9 and name HA   )) ((resid   88 and name HG1  ))   4.28  2.48  0.00 ! #SUP  0.95
assign  ((resid   20 and name HA   )) ((resid   21 and name HA   ))   4.54  2.74  0.00 ! #SUP  0.99
assign  ((resid   21 and name HA   )) ((resid   21 and name HB   ))   2.83  1.03  0.00 ! #SUP  0.99
assign  ((resid   21 and name HA   )) ((resid   40 and name HB*  ))   3.76  1.96  0.00 ! #SUP  0.53
assign  ((resid   21 and name HA   )) ((resid   21 and name HG11 ))   3.61  1.81  0.00 ! #SUP  0.99
assign  ((resid   21 and name HA   )) ((resid   22 and name HG2* ))   3.81  2.01  0.00 ! #SUP  0.92
assign  ((resid   21 and name HA   )) ((resid   21 and name HD1* ))   3.81  2.01  0.00 ! #SUP  0.63
assign  ((resid   20 and name HB1  )) ((resid   21 and name HA   ))   5.15  3.35  0.00 ! #SUP  0.90
assign  ((resid    7 and name HA   )) ((resid   90 and name HA   ))   2.74  0.94  0.00 ! #SUP  0.97
assign  ((resid    7 and name HA   )) ((resid    8 and name HA   ))   4.68  2.88  0.00 ! #SUP  0.97
assign  ((resid   23 and name HA2  )) ((resid   73 and name HA   ))   5.21  3.41  0.00 ! #SUP  1.00
assign  ((resid    7 and name HA   )) ((resid   90 and name HG2* ))   3.17  1.37  0.00 ! #SUP  0.94
assign  ((resid    6 and name HD*  )) ((resid    7 and name HA   ))   4.96  3.16  0.00 ! #SUP  0.99
assign  ((resid   22 and name HG11 )) ((resid   23 and name HA2  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid    7 and name HA   )) ((resid    8 and name HG2* ))   4.01  2.21  0.00 ! #SUP  0.77
assign  ((resid    7 and name HA   )) ((resid   90 and name HG1* ))   3.65  1.85  0.00 ! #SUP  0.98
assign  ((resid   54 and name HD1* )) ((resid   89 and name HA   ))   5.10  3.30  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG2* )) ((resid   89 and name HA   ))   4.68  2.88  0.00 ! #SUP  0.94
assign  ((resid    6 and name HD*  )) ((resid   92 and name HA2  ))   4.43  2.63  0.00 ! #SUP  0.72
assign  ((resid   38 and name HA   )) ((resid   39 and name HG2* ))   3.88  2.08  0.00 ! #SUP  0.91
assign  ((resid   89 and name HA   )) ((resid   90 and name HG2* ))   4.19  2.39  0.00 ! #SUP  0.91
assign  ((resid    6 and name HE*  )) ((resid   92 and name HA2  ))   4.19  2.39  0.00 ! #SUP  0.39
assign  ((resid    3 and name HG*  )) ((resid   92 and name HA2  ))   4.21  2.41  0.00 ! #SUP  0.93
assign  ((resid    6 and name HA   )) ((resid    6 and name HD*  ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid    6 and name HA   )) ((resid   90 and name HA   ))   5.29  3.49  0.00 ! #SUP  0.98
assign  ((resid    9 and name HA   )) ((resid   86 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.34
assign  ((resid   19 and name HA   )) ((resid   42 and name HA   ))   2.89  1.09  0.00 ! #SUP  0.95
assign  ((resid   19 and name HA   )) ((resid   41 and name HB   ))   4.76  2.96  0.00 ! #SUP  0.95
assign  ((resid   19 and name HA   )) ((resid   43 and name HA   ))   4.52  2.72  0.00 ! #SUP  0.95
assign  ((resid   19 and name HA   )) ((resid   19 and name HB   ))   2.84  1.04  0.00 ! #SUP  0.97
assign  ((resid   19 and name HA   )) ((resid   19 and name HG11 ))   3.79  1.99  0.00 ! #SUP  0.88
assign  ((resid   19 and name HA   )) ((resid   19 and name HG2* ))   2.73  0.93  0.00 ! #SUP  1.00
assign  ((resid   19 and name HA   )) ((resid   41 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   62 and name HA   )) ((resid   67 and name HB1  ))   5.36  3.56  0.00 ! #SUP  0.97
assign  ((resid   61 and name HA   )) ((resid   62 and name HA   ))   5.13  3.33  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   62 and name HG*  ))   3.27  1.47  0.00 ! #SUP  0.97
assign  ((resid   62 and name HA   )) ((resid   68 and name HB1  ))   4.75  2.95  0.00 ! #SUP  0.89
assign  ((resid   19 and name HA   )) ((resid   20 and name HA   ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   20 and name HA   )) ((resid   21 and name HG12 ))   4.84  3.04  0.00 ! #SUP  0.66
assign  ((resid   20 and name HA   )) ((resid   21 and name HG2* ))   3.88  2.08  0.00 ! #SUP  0.99
assign  ((resid   19 and name HG11 )) ((resid   20 and name HA   ))   4.84  3.04  0.00 ! #SUP  0.79
assign  ((resid   13 and name HA   )) ((resid   14 and name HA   ))   4.56  2.76  0.00 ! #SUP  0.99
assign  ((resid   13 and name HA   )) ((resid   14 and name HG*  ))   4.94  3.14  0.00 ! #SUP  0.99
assign  ((resid    6 and name HE*  )) ((resid   93 and name HA   ))   5.06  3.26  0.00 ! #SUP  0.94
assign  ((resid   92 and name HA2  )) ((resid   93 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   93 and name HA   )) ((resid   93 and name HD1  ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   38 and name HE*  )) ((resid   58 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.60
assign  ((resid   57 and name HA   )) ((resid   58 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   59 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   58 and name HA   )) ((resid   91 and name HG2* ))   4.04  2.24  0.00 ! #SUP  0.94
assign  ((resid   88 and name HA   )) ((resid   89 and name HA   ))   4.71  2.91  0.00 ! #SUP  0.92
assign  ((resid   88 and name HA   )) ((resid   89 and name HD*  ))   4.13  2.33  0.00 ! #SUP  0.92
assign  ((resid   63 and name HA   )) ((resid   88 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.71
assign  ((resid   87 and name HA   )) ((resid   88 and name HA   ))   4.81  3.01  0.00 ! #SUP  0.94
assign  ((resid   88 and name HA   )) ((resid   88 and name HG2  ))   3.39  1.59  0.00 ! #SUP  0.92
assign  ((resid   88 and name HA   )) ((resid   88 and name HB1  ))   2.84  1.04  0.00 ! #SUP  0.98
assign  ((resid   90 and name HB   )) ((resid   91 and name HA   ))   5.27  3.47  0.00 ! #SUP  0.86
assign  ((resid   68 and name HA   )) ((resid   75 and name HD*  ))   4.25  2.45  0.00 ! #SUP  0.20
assign  ((resid   91 and name HA   )) ((resid   91 and name HG12 ))   2.78  0.98  0.00 ! #SUP  0.41
assign  ((resid   61 and name HG2* )) ((resid   91 and name HA   ))   3.99  2.19  0.00 ! #SUP  0.76
assign  ((resid   88 and name HA   )) ((resid   88 and name HG1  ))   3.18  1.38  0.00 ! #SUP  0.72
assign  ((resid   61 and name HG1* )) ((resid   91 and name HA   ))   3.99  2.19  0.00 ! #SUP  0.93
assign  ((resid   90 and name HA   )) ((resid   91 and name HA   ))   4.89  3.09  0.00 ! #SUP  0.94
assign  ((resid   14 and name HA   )) ((resid   15 and name HA   ))   5.34  3.54  0.00 ! #SUP  0.98
assign  ((resid   91 and name HA   )) ((resid   92 and name HA1  ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   91 and name HA   )) ((resid   91 and name HG2* ))   2.97  1.17  0.00 ! #SUP  0.99
assign  ((resid   15 and name HA   )) ((resid   16 and name HA1  ))   5.06  3.26  0.00 ! #SUP  0.96
assign  ((resid   15 and name HA   )) ((resid   16 and name HA2  ))   5.46  3.66  0.00 ! #SUP  0.88
assign  ((resid   24 and name HA   )) ((resid   38 and name HE*  ))   5.39  3.59  0.00 ! #SUP  0.99
assign  ((resid   14 and name HG*  )) ((resid   15 and name HA   ))   3.90  2.10  0.00 ! #SUP  0.97
assign  ((resid   71 and name HA   )) ((resid   72 and name HG2* ))   4.98  3.18  0.00 ! #SUP  0.89
assign  ((resid   21 and name HA   )) ((resid   22 and name HA   ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   23 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.76
assign  ((resid   22 and name HA   )) ((resid   22 and name HB   ))   2.76  0.96  0.00 ! #SUP  0.98
assign  ((resid   22 and name HA   )) ((resid   22 and name HG12 ))   3.34  1.54  0.00 ! #SUP  0.99
assign  ((resid   22 and name HA   )) ((resid   22 and name HG11 ))   3.34  1.54  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   73 and name HB2  ))   4.27  2.47  0.00 ! #SUP  0.25
assign  ((resid   22 and name HA   )) ((resid   40 and name HD*  ))   4.41  2.61  0.00 ! #SUP  0.76
assign  ((resid   21 and name HG11 )) ((resid   22 and name HA   ))   4.65  2.85  0.00 ! #SUP  0.97
assign  ((resid   21 and name HG12 )) ((resid   22 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.69
assign  ((resid   22 and name HA   )) ((resid   22 and name HD1* ))   3.91  2.11  0.00 ! #SUP  0.66
assign  ((resid   21 and name HD1* )) ((resid   22 and name HA   ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   38 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.22
assign  ((resid   55 and name HA   )) ((resid   55 and name HG2  ))   3.78  1.98  0.00 ! #SUP  0.96
assign  ((resid   54 and name HG2* )) ((resid   55 and name HA   ))   3.30  1.50  0.00 ! #SUP  0.98
assign  ((resid   28 and name HB*  )) ((resid   29 and name HA   ))   4.58  2.78  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   64 and name HA   ))   4.71  2.91  0.00 ! #SUP  0.98
assign  ((resid    4 and name HA   )) ((resid    6 and name HD*  ))   4.78  2.98  0.00 ! #SUP  0.99
assign  ((resid   63 and name HA   )) ((resid   89 and name HA   ))   2.98  1.18  0.00 ! #SUP  1.00
assign  ((resid    4 and name HA   )) ((resid    4 and name HG2  ))   3.67  1.87  0.00 ! #SUP  0.94
assign  ((resid    4 and name HA   )) ((resid    4 and name HG1  ))   3.53  1.73  0.00 ! #SUP  0.96
assign  ((resid    4 and name HA   )) ((resid    4 and name HB2  ))   2.94  1.14  0.00 ! #SUP  0.98
assign  ((resid   63 and name HA   )) ((resid   63 and name HG1* ))   3.04  1.24  0.00 ! #SUP  0.99
assign  ((resid   63 and name HA   )) ((resid   89 and name HB1  ))   5.25  3.45  0.00 ! #SUP  0.92
assign  ((resid   63 and name HA   )) ((resid   90 and name HG2* ))   4.04  2.24  0.00 ! #SUP  0.65
assign  ((resid   41 and name HA   )) ((resid   41 and name HB   ))   2.96  1.16  0.00 ! #SUP  0.99
assign  ((resid   41 and name HA   )) ((resid   41 and name HG2* ))   2.65  0.85  0.00 ! #SUP  0.98
assign  ((resid   62 and name HA   )) ((resid   67 and name HA   ))   2.83  1.03  0.00 ! #SUP  0.98
assign  ((resid   66 and name HG2* )) ((resid   67 and name HA   ))   4.52  2.72  0.00 ! #SUP  0.98
assign  ((resid   72 and name HA   )) ((resid   72 and name HG2* ))   2.68  0.88  0.00 ! #SUP  0.91
assign  ((resid   42 and name HA   )) ((resid   42 and name HG1* ))   3.20  1.40  0.00 ! #SUP  0.95
assign  ((resid   71 and name HA   )) ((resid   72 and name HA   ))   4.58  2.78  0.00 ! #SUP  0.36
assign  ((resid   72 and name HA   )) ((resid   75 and name HB1  ))   5.13  3.33  0.00 ! #SUP  0.98
assign  ((resid   41 and name HG2* )) ((resid   42 and name HA   ))   4.59  2.79  0.00 ! #SUP  0.94
assign  ((resid   51 and name HA   )) ((resid   51 and name HB2  ))   2.91  1.11  0.00 ! #SUP  0.98
assign  ((resid   32 and name HA   )) ((resid   32 and name HG   ))   3.65  1.85  0.00 ! #SUP  0.96
assign  ((resid   83 and name HA   )) ((resid   83 and name HB   ))   2.69  0.89  0.00 ! #SUP  1.00
assign  ((resid   83 and name HB   )) ((resid   87 and name HG1* ))   3.43  1.63  0.00 ! #SUP  0.98
assign  ((resid   34 and name HA   )) ((resid   34 and name HE*  ))   4.77  2.97  0.00 ! #SUP  0.41
assign  ((resid   22 and name HG2* )) ((resid   40 and name HA   ))   2.93  1.13  0.00 ! #SUP  0.62
assign  ((resid   38 and name HA   )) ((resid   59 and name HA   ))   2.89  1.09  0.00 ! #SUP  0.56
assign  ((resid   38 and name HB1  )) ((resid   59 and name HA   ))   4.08  2.28  0.00 ! #SUP  0.92
assign  ((resid   53 and name HA   )) ((resid   53 and name HD1  ))   4.46  2.66  0.00 ! #SUP  0.76
assign  ((resid   77 and name HB*  )) ((resid   78 and name HB   ))   4.70  2.90  0.00 ! #SUP  0.86
assign  ((resid   75 and name HE*  )) ((resid   78 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.58
assign  ((resid   75 and name HB2  )) ((resid   78 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   78 and name HB   )) ((resid   81 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   33 and name HA   )) ((resid   33 and name HG1  ))   3.53  1.73  0.00 ! #SUP  0.99
assign  ((resid    7 and name HB1  )) ((resid   90 and name HA   ))   4.31  2.51  0.00 ! #SUP  0.94
assign  ((resid    7 and name HB2  )) ((resid   90 and name HA   ))   4.65  2.85  0.00 ! #SUP  0.95
assign  ((resid   90 and name HA   )) ((resid   90 and name HG2* ))   2.84  1.04  0.00 ! #SUP  0.90
assign  ((resid   17 and name HA   )) ((resid   17 and name HG   ))   3.96  2.16  0.00 ! #SUP  0.97
assign  ((resid   63 and name HG2* )) ((resid   64 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   17 and name HA   )) ((resid   89 and name HZ   ))   5.50  3.70  0.00 ! #SUP  0.77
assign  ((resid   60 and name HA   )) ((resid   91 and name HG11 ))   3.10  1.30  0.00 ! #SUP  0.63
assign  ((resid   48 and name HA   )) ((resid   89 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.58
assign  ((resid   60 and name HA   )) ((resid   91 and name HA   ))   4.19  2.39  0.00 ! #SUP  0.88
assign  ((resid   81 and name HA   )) ((resid   81 and name HG2  ))   3.91  2.11  0.00 ! #SUP  0.64
assign  ((resid   10 and name HD2* )) ((resid   48 and name HA   ))   3.01  1.21  0.00 ! #SUP  0.26
assign  ((resid   10 and name HD1* )) ((resid   48 and name HA   ))   3.01  1.21  0.00 ! #SUP  0.96
assign  ((resid   82 and name HB2  )) ((resid   83 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.73
assign  ((resid   12 and name HE*  )) ((resid   48 and name HA   ))   4.37  2.57  0.00 ! #SUP  0.26
assign  ((resid   10 and name HG   )) ((resid   48 and name HA   ))   3.94  2.14  0.00 ! #SUP  0.88
assign  ((resid   60 and name HA   )) ((resid   60 and name HG12 ))   3.32  1.52  0.00 ! #SUP  0.98
assign  ((resid   83 and name HA   )) ((resid   83 and name HG2* ))   2.53  0.73  0.00 ! #SUP  0.97
assign  ((resid   66 and name HA   )) ((resid   75 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   62 and name HA   )) ((resid   65 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid    6 and name HD*  )) ((resid    7 and name HD2  ))   4.13  2.33  0.00 ! #SUP  0.99
assign  ((resid   21 and name HG11 )) ((resid   77 and name HA   ))   4.17  2.37  0.00 ! #SUP  0.92
assign  ((resid   76 and name HB*  )) ((resid   77 and name HA   ))   4.50  2.70  0.00 ! #SUP  0.92
assign  ((resid   69 and name HA   )) ((resid   69 and name HG2* ))   3.29  1.49  0.00 ! #SUP  1.00
assign  ((resid   49 and name HA   )) ((resid   49 and name HG2  ))   2.86  1.06  0.00 ! #SUP  0.98
assign  ((resid   49 and name HA   )) ((resid   49 and name HB*  ))   2.82  1.02  0.00 ! #SUP  1.00
assign  ((resid   12 and name HE*  )) ((resid   47 and name HA   ))   4.75  2.95  0.00 ! #SUP  0.31
assign  ((resid   54 and name HA   )) ((resid   54 and name HD1* ))   3.80  2.00  0.00 ! #SUP  0.35
assign  ((resid   54 and name HA   )) ((resid   54 and name HG12 ))   3.25  1.45  0.00 ! #SUP  0.39
assign  ((resid   80 and name HA   )) ((resid   80 and name HD2* ))   3.01  1.21  0.00 ! #SUP  0.54
assign  ((resid   47 and name HA   )) ((resid   51 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.93
assign  ((resid   47 and name HA   )) ((resid   50 and name HB*  ))   3.13  1.33  0.00 ! #SUP  0.38
assign  ((resid   20 and name HB2  )) ((resid   40 and name HE*  ))   5.22  3.42  0.00 ! #SUP  0.49
assign  ((resid   63 and name HB   )) ((resid   80 and name HA   ))   5.01  3.21  0.00 ! #SUP  0.91
assign  ((resid   39 and name HA   )) ((resid   39 and name HG2* ))   2.80  1.00  0.00 ! #SUP  0.92
assign  ((resid   54 and name HA   )) ((resid   54 and name HG2* ))   3.53  1.73  0.00 ! #SUP  0.78
assign  ((resid   43 and name HA   )) ((resid   43 and name HG2* ))   3.20  1.40  0.00 ! #SUP  0.99
assign  ((resid   21 and name HA   )) ((resid   39 and name HA   ))   3.04  1.24  0.00 ! #SUP  0.92
assign  ((resid   50 and name HA   )) ((resid   50 and name HD2  ))   4.15  2.35  0.00 ! #SUP  0.94
assign  ((resid   73 and name HA   )) ((resid   76 and name HB*  ))   3.27  1.47  0.00 ! #SUP  0.90
assign  ((resid   73 and name HA   )) ((resid   73 and name HB1  ))   2.94  1.14  0.00 ! #SUP  1.00
assign  ((resid   12 and name HA   )) ((resid   47 and name HB*  ))   3.13  1.33  0.00 ! #SUP  0.97
assign  ((resid   12 and name HA   )) ((resid   12 and name HE*  ))   4.17  2.37  0.00 ! #SUP  0.33
assign  ((resid   20 and name HB1  )) ((resid   40 and name HG*  ))   4.42  2.62  0.00 ! #SUP  0.70
assign  ((resid    7 and name HD1  )) ((resid   90 and name HG2* ))   4.51  2.71  0.00 ! #SUP  0.35
assign  ((resid   75 and name HE*  )) ((resid   76 and name HA   ))   4.58  2.78  0.00 ! #SUP  0.94
assign  ((resid   71 and name HG2* )) ((resid   76 and name HA   ))   3.52  1.72  0.00 ! #SUP  0.85
assign  ((resid   76 and name HA   )) ((resid   79 and name HG2* ))   4.39  2.59  0.00 ! #SUP  0.94
assign  ((resid   78 and name HA   )) ((resid   81 and name HD*  ))   3.84  2.04  0.00 ! #SUP  0.99
assign  ((resid   68 and name HB1  )) ((resid   76 and name HA   ))   4.34  2.54  0.00 ! #SUP  0.96
assign  ((resid   77 and name HB*  )) ((resid   78 and name HA   ))   4.70  2.90  0.00 ! #SUP  0.96
assign  ((resid   35 and name HD1* )) ((resid   61 and name HA   ))   3.81  2.01  0.00 ! #SUP  0.88
assign  ((resid   85 and name HA2  )) ((resid   86 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.81
assign  ((resid   23 and name HA1  )) ((resid   72 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.33
assign  ((resid   65 and name HA1  )) ((resid   66 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   23 and name HA1  )) ((resid   73 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   23 and name HA1  )) ((resid   73 and name HB1  ))   4.11  2.31  0.00 ! #SUP  0.91
assign  ((resid   53 and name HA   )) ((resid   53 and name HD2  ))   4.46  2.66  0.00 ! #SUP  0.85
assign  ((resid   75 and name HE*  )) ((resid   79 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.85
assign  ((resid   78 and name HB   )) ((resid   79 and name HA   ))   5.19  3.39  0.00 ! #SUP  0.87
assign  ((resid   79 and name HA   )) ((resid   82 and name HB2  ))   4.59  2.79  0.00 ! #SUP  0.90
assign  ((resid   79 and name HA   )) ((resid   83 and name HG2* ))   4.91  3.11  0.00 ! #SUP  0.79
assign  ((resid   66 and name HG2* )) ((resid   79 and name HA   ))   4.78  2.98  0.00 ! #SUP  0.99
assign  ((resid    4 and name HB1  )) ((resid   92 and name HA1  ))   5.12  3.32  0.00 ! #SUP  0.75
assign  ((resid    5 and name HB1  )) ((resid   92 and name HA1  ))   5.50  3.70  0.00 ! #SUP  0.92
assign  ((resid   61 and name HG2* )) ((resid   92 and name HA1  ))   5.45  3.65  0.00 ! #SUP  0.89
assign  ((resid   50 and name HA   )) ((resid   50 and name HD1  ))   4.15  2.35  0.00 ! #SUP  0.93
assign  ((resid   39 and name HA   )) ((resid   56 and name HA   ))   5.17  3.37  0.00 ! #SUP  0.85
assign  ((resid   41 and name HA   )) ((resid   56 and name HA   ))   5.05  3.25  0.00 ! #SUP  1.00
assign  ((resid   56 and name HA   )) ((resid   57 and name HA   ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   39 and name HG2* )) ((resid   56 and name HA   ))   3.69  1.89  0.00 ! #SUP  0.97
assign  ((resid   81 and name HB2  )) ((resid   81 and name HD*  ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid    8 and name HG2* )) ((resid   53 and name HD1  ))   3.87  2.07  0.00 ! #SUP  0.82
assign  ((resid    6 and name HB2  )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.83
assign  ((resid   93 and name HA   )) ((resid   93 and name HD2  ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   54 and name HD1* )) ((resid   89 and name HB2  ))   4.96  3.16  0.00 ! #SUP  0.97
assign  ((resid    8 and name HG2* )) ((resid   89 and name HB2  ))   4.14  2.34  0.00 ! #SUP  0.92
assign  ((resid   84 and name HA   )) ((resid   84 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   84 and name HB*  )) ((resid   84 and name HE*  ))   5.05  3.25  0.00 ! #SUP  0.78
assign  ((resid   83 and name HA   )) ((resid   84 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.90
assign  ((resid    6 and name HB1  )) ((resid    7 and name HD1  ))   4.32  2.52  0.00 ! #SUP  0.94
assign  ((resid   40 and name HE*  )) ((resid   41 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.68
assign  ((resid   40 and name HE*  )) ((resid   41 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.92
assign  ((resid   40 and name HB*  )) ((resid   40 and name HE*  ))   3.55  1.75  0.00 ! #SUP  0.55
assign  ((resid   40 and name HG*  )) ((resid   40 and name HE*  ))   3.56  1.76  0.00 ! #SUP  0.99
assign  ((resid   40 and name HE*  )) ((resid   41 and name HG2* ))   4.65  2.85  0.00 ! #SUP  0.99
assign  ((resid   22 and name HA   )) ((resid   40 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   22 and name HG2* )) ((resid   40 and name HE*  ))   4.83  3.03  0.00 ! #SUP  0.91
assign  ((resid   34 and name HG1  )) ((resid   34 and name HE*  ))   3.42  1.62  0.00 ! #SUP  0.94
assign  ((resid   12 and name HB1  )) ((resid   12 and name HE*  ))   4.20  2.40  0.00 ! #SUP  0.31
assign  ((resid   12 and name HE*  )) ((resid   48 and name HB*  ))   3.58  1.78  0.00 ! #SUP  0.74
assign  ((resid   89 and name HB1  )) ((resid   91 and name HG11 ))   3.74  1.94  0.00 ! #SUP  0.74
assign  ((resid   89 and name HB1  )) ((resid   91 and name HG12 ))   4.55  2.75  0.00 ! #SUP  0.48
assign  ((resid   54 and name HD1* )) ((resid   89 and name HB1  ))   4.36  2.56  0.00 ! #SUP  0.87
assign  ((resid   12 and name HE*  )) ((resid   17 and name HA   ))   3.84  2.04  0.00 ! #SUP  0.24
assign  ((resid   48 and name HA   )) ((resid   51 and name HB2  ))   3.64  1.84  0.00 ! #SUP  0.85
assign  ((resid   12 and name HE*  )) ((resid   47 and name HB*  ))   5.18  3.38  0.00 ! #SUP  0.88
assign  ((resid   12 and name HE*  )) ((resid   17 and name HD2* ))   5.35  3.55  0.00 ! #SUP  0.23
assign  ((resid   10 and name HG   )) ((resid   51 and name HB2  ))   4.71  2.91  0.00 ! #SUP  0.54
assign  ((resid   39 and name HG2* )) ((resid   58 and name HB2  ))   4.68  2.88  0.00 ! #SUP  0.90
assign  ((resid   12 and name HE*  )) ((resid   17 and name HD1* ))   5.35  3.55  0.00 ! #SUP  0.97
assign  ((resid   78 and name HG2* )) ((resid   82 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   28 and name HB*  )) ((resid   29 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   82 and name HB1  )) ((resid   83 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   22 and name HG2* )) ((resid   38 and name HB2  ))   3.67  1.87  0.00 ! #SUP  0.95
assign  ((resid   86 and name HB*  )) ((resid   87 and name HA   ))   4.64  2.84  0.00 ! #SUP  0.97
assign  ((resid   12 and name HE*  )) ((resid   43 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.90
assign  ((resid   29 and name HB1  )) ((resid   30 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   51 and name HB1  )) ((resid   54 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   10 and name HD1* )) ((resid   51 and name HB1  ))   4.14  2.34  0.00 ! #SUP  0.74
assign  ((resid   39 and name HG2* )) ((resid   58 and name HB1  ))   4.68  2.88  0.00 ! #SUP  0.74
assign  ((resid   51 and name HB1  )) ((resid   54 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.62
assign  ((resid   86 and name HB*  )) ((resid   87 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.62
assign  ((resid   49 and name HA   )) ((resid   49 and name HG1  ))   3.11  1.31  0.00 ! #SUP  0.98
assign  ((resid   73 and name HG2  )) ((resid   74 and name HA   ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   73 and name HA   )) ((resid   73 and name HG2  ))   3.67  1.87  0.00 ! #SUP  0.98
assign  ((resid   23 and name HA1  )) ((resid   24 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   23 and name HA1  )) ((resid   73 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   73 and name HG2  )) ((resid   77 and name HB*  ))   4.77  2.97  0.00 ! #SUP  0.99
assign  ((resid   21 and name HG11 )) ((resid   73 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.88
assign  ((resid   24 and name HG2  )) ((resid   37 and name HD1* ))   5.38  3.58  0.00 ! #SUP  0.98
assign  ((resid   24 and name HA   )) ((resid   24 and name HG2  ))   3.68  1.88  0.00 ! #SUP  0.96
assign  ((resid   13 and name HB2  )) ((resid   14 and name HG*  ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   24 and name HG1  )) ((resid   38 and name HB2  ))   4.32  2.52  0.00 ! #SUP  0.80
assign  ((resid   24 and name HB*  )) ((resid   24 and name HG1  ))   3.00  1.20  0.00 ! #SUP  0.99
assign  ((resid   55 and name HA   )) ((resid   55 and name HG1  ))   3.78  1.98  0.00 ! #SUP  0.89
assign  ((resid    3 and name HG*  )) ((resid   93 and name HA   ))   4.81  3.01  0.00 ! #SUP  0.97
assign  ((resid    3 and name HG*  )) ((resid    5 and name HG   ))   4.54  2.74  0.00 ! #SUP  0.99
assign  ((resid    4 and name HG1  )) ((resid    6 and name HB1  ))   5.10  3.30  0.00 ! #SUP  0.63
assign  ((resid   49 and name HB*  )) ((resid   49 and name HG2  ))   2.66  0.86  0.00 ! #SUP  0.72
assign  ((resid   71 and name HB   )) ((resid   75 and name HA   ))   4.75  2.95  0.00 ! #SUP  0.97
assign  ((resid   71 and name HB   )) ((resid   76 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.71
assign  ((resid   71 and name HB   )) ((resid   75 and name HB1  ))   3.73  1.93  0.00 ! #SUP  0.98
assign  ((resid   39 and name HB   )) ((resid   56 and name HA   ))   3.18  1.38  0.00 ! #SUP  0.88
assign  ((resid   39 and name HB   )) ((resid   57 and name HA   ))   5.21  3.41  0.00 ! #SUP  0.97
assign  ((resid   39 and name HB   )) ((resid   59 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   22 and name HA   )) ((resid   73 and name HG1  ))   5.34  3.54  0.00 ! #SUP  0.58
assign  ((resid    4 and name HB2  )) ((resid    6 and name HD*  ))   4.75  2.95  0.00 ! #SUP  0.99
assign  ((resid    6 and name HB2  )) ((resid    7 and name HG2  ))   4.88  3.08  0.00 ! #SUP  0.92
assign  ((resid    6 and name HB1  )) ((resid    7 and name HG2  ))   5.39  3.59  0.00 ! #SUP  0.91
assign  ((resid   22 and name HG2* )) ((resid   24 and name HB*  ))   4.25  2.45  0.00 ! #SUP  0.74
assign  ((resid    6 and name HA   )) ((resid    7 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   24 and name HB*  )) ((resid   38 and name HD*  ))   4.04  2.24  0.00 ! #SUP  0.61
assign  ((resid    6 and name HE*  )) ((resid   93 and name HB1  ))   4.99  3.19  0.00 ! #SUP  0.75
assign  ((resid   88 and name HB1  )) ((resid   89 and name HA   ))   5.35  3.55  0.00 ! #SUP  0.70
assign  ((resid   77 and name HA   )) ((resid   80 and name HB2  ))   3.40  1.60  0.00 ! #SUP  0.47
assign  ((resid   88 and name HB1  )) ((resid   88 and name HG2  ))   2.53  0.73  0.00 ! #SUP  0.93
assign  ((resid   88 and name HB1  )) ((resid   88 and name HD*  ))   3.78  1.98  0.00 ! #SUP  0.86
assign  ((resid   84 and name HA   )) ((resid   84 and name HD*  ))   3.81  2.01  0.00 ! #SUP  0.89
assign  ((resid   38 and name HA   )) ((resid   59 and name HB2  ))   3.93  2.13  0.00 ! #SUP  0.70
assign  ((resid   38 and name HE*  )) ((resid   59 and name HB2  ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG   )) ((resid   89 and name HZ   ))   4.79  2.99  0.00 ! #SUP  0.96
assign  ((resid   87 and name HB   )) ((resid   89 and name HZ   ))   4.99  3.19  0.00 ! #SUP  0.96
assign  ((resid   62 and name HA   )) ((resid   63 and name HB   ))   4.84  3.04  0.00 ! #SUP  0.95
assign  ((resid   62 and name HA   )) ((resid   90 and name HB   ))   5.18  3.38  0.00 ! #SUP  0.95
assign  ((resid   63 and name HB   )) ((resid   89 and name HA   ))   5.36  3.56  0.00 ! #SUP  0.87
assign  ((resid   89 and name HA   )) ((resid   90 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.87
assign  ((resid    5 and name HB2  )) ((resid    5 and name HD2* ))   2.47  0.67  0.00 ! #SUP  0.80
assign  ((resid   11 and name HA   )) ((resid   12 and name HB2  ))   5.18  3.38  0.00 ! #SUP  0.95
assign  ((resid    5 and name HB2  )) ((resid   92 and name HA1  ))   5.34  3.54  0.00 ! #SUP  0.91
assign  ((resid   35 and name HB*  )) ((resid   35 and name HD1* ))   2.92  1.12  0.00 ! #SUP  0.41
assign  ((resid   66 and name HG2* )) ((resid   68 and name HB1  ))   2.79  0.99  0.00 ! #SUP  0.61
assign  ((resid   74 and name HA   )) ((resid   77 and name HB*  ))   3.37  1.57  0.00 ! #SUP  0.97
assign  ((resid   10 and name HG   )) ((resid   54 and name HD1* ))   4.59  2.79  0.00 ! #SUP  0.51
assign  ((resid    5 and name HG   )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   13 and name HA   )) ((resid   47 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid   75 and name HE*  )) ((resid   76 and name HB*  ))   5.28  3.48  0.00 ! #SUP  0.99
assign  ((resid   73 and name HG2  )) ((resid   76 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.83
assign  ((resid   10 and name HB1  )) ((resid   89 and name HZ   ))   4.58  2.78  0.00 ! #SUP  0.53
assign  ((resid   20 and name HA   )) ((resid   40 and name HG*  ))   5.15  3.35  0.00 ! #SUP  0.84
assign  ((resid   83 and name HG2* )) ((resid   89 and name HZ   ))   4.68  2.88  0.00 ! #SUP  0.93
assign  ((resid   83 and name HG2* )) ((resid   89 and name HE*  ))   4.63  2.83  0.00 ! #SUP  0.98
assign  ((resid   72 and name HG2* )) ((resid   75 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.73
assign  ((resid   38 and name HE*  )) ((resid   59 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   19 and name HG11 )) ((resid   21 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.55
assign  ((resid   12 and name HG2  )) ((resid   89 and name HZ   ))   5.13  3.33  0.00 ! #SUP  0.82
assign  ((resid   19 and name HG11 )) ((resid   42 and name HA   ))   4.66  2.86  0.00 ! #SUP  0.60
assign  ((resid   12 and name HG2  )) ((resid   47 and name HB*  ))   3.55  1.75  0.00 ! #SUP  0.66
assign  ((resid   89 and name HD*  )) ((resid   91 and name HG11 ))   4.84  3.04  0.00 ! #SUP  0.91
assign  ((resid   12 and name HG2  )) ((resid   89 and name HE*  ))   5.41  3.61  0.00 ! #SUP  0.79
assign  ((resid   48 and name HB*  )) ((resid   89 and name HE*  ))   5.47  3.67  0.00 ! #SUP  0.79
assign  ((resid   91 and name HA   )) ((resid   91 and name HG11 ))   3.91  2.11  0.00 ! #SUP  0.99
assign  ((resid   89 and name HB2  )) ((resid   91 and name HG11 ))   4.45  2.65  0.00 ! #SUP  0.99
assign  ((resid   12 and name HA   )) ((resid   12 and name HG1  ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   12 and name HG1  )) ((resid   16 and name HA2  ))   5.24  3.44  0.00 ! #SUP  0.81
assign  ((resid   19 and name HA   )) ((resid   43 and name HG2* ))   5.45  3.65  0.00 ! #SUP  0.89
assign  ((resid    5 and name HB1  )) ((resid    6 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   21 and name HA   )) ((resid   21 and name HG12 ))   4.21  2.41  0.00 ! #SUP  0.99
assign  ((resid   78 and name HG2* )) ((resid   81 and name HD*  ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   20 and name HB1  )) ((resid   41 and name HG2* ))   5.04  3.24  0.00 ! #SUP  0.95
assign  ((resid   62 and name HA   )) ((resid   66 and name HG2* ))   4.63  2.83  0.00 ! #SUP  0.99
assign  ((resid   22 and name HD1* )) ((resid   40 and name HE*  ))   3.98  2.18  0.00 ! #SUP  0.46
assign  ((resid   26 and name HG1* )) ((resid   38 and name HE*  ))   4.49  2.69  0.00 ! #SUP  0.93
assign  ((resid   26 and name HG1* )) ((resid   27 and name HA1  ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   22 and name HG2* )) ((resid   38 and name HA   ))   4.28  2.48  0.00 ! #SUP  0.83
assign  ((resid    6 and name HE*  )) ((resid    8 and name HG2* ))   3.82  2.02  0.00 ! #SUP  0.99
assign  ((resid   71 and name HG2* )) ((resid   75 and name HE*  ))   3.72  1.92  0.00 ! #SUP  0.92
assign  ((resid   68 and name HB1  )) ((resid   68 and name HD1* ))   3.50  1.70  0.00 ! #SUP  0.90
assign  ((resid   77 and name HA   )) ((resid   80 and name HD2* ))   4.08  2.28  0.00 ! #SUP  0.43
assign  ((resid    4 and name HA   )) ((resid    5 and name HD2* ))   4.23  2.43  0.00 ! #SUP  0.93
assign  ((resid   21 and name HB   )) ((resid   21 and name HD1* ))   2.70  0.90  0.00 ! #SUP  1.00
assign  ((resid   21 and name HD1* )) ((resid   77 and name HB*  ))   2.92  1.12  0.00 ! #SUP  0.97
assign  ((resid   21 and name HD1* )) ((resid   76 and name HB*  ))   2.93  1.13  0.00 ! #SUP  0.86
assign  ((resid   62 and name HB*  )) ((resid   90 and name HG2* ))   3.13  1.33  0.00 ! #SUP  0.99
assign  ((resid   39 and name HG2* )) ((resid   60 and name HG12 ))   2.56  0.76  0.00 ! #SUP  0.73
assign  ((resid   19 and name HG2* )) ((resid   43 and name HB   ))   3.61  1.81  0.00 ! #SUP  0.66
assign  ((resid   23 and name HA1  )) ((resid   37 and name HG2* ))   5.03  3.23  0.00 ! #SUP  0.33
assign  ((resid   12 and name HE*  )) ((resid   19 and name HG2* ))   4.30  2.50  0.00 ! #SUP  0.34
assign  ((resid   91 and name HG2* )) ((resid   91 and name HD1* ))   3.47  1.67  0.00 ! #SUP  0.99
assign  ((resid   54 and name HG2* )) ((resid   54 and name HD1* ))   2.81  1.01  0.00 ! #SUP  0.70
assign  ((resid   49 and name HA   )) ((resid   54 and name HG2* ))   3.69  1.89  0.00 ! #SUP  0.65
assign  ((resid    6 and name HB2  )) ((resid   90 and name HG1* ))   5.45  3.65  0.00 ! #SUP  0.88
assign  ((resid    7 and name HD2  )) ((resid   90 and name HG1* ))   5.06  3.26  0.00 ! #SUP  0.44
assign  ((resid   19 and name HA   )) ((resid   19 and name HG12 ))   3.78  1.98  0.00 ! #SUP  0.99
assign  ((resid   42 and name HA   )) ((resid   42 and name HG2* ))   3.20  1.40  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   37 and name HD1* ))   4.78  2.98  0.00 ! #SUP  0.82
assign  ((resid   21 and name HG2* )) ((resid   76 and name HB*  ))   3.13  1.33  0.00 ! #SUP  0.89
assign  ((resid   37 and name HD1* )) ((resid   76 and name HB*  ))   3.30  1.50  0.00 ! #SUP  0.89
assign  ((resid   63 and name HG1* )) ((resid   89 and name HA   ))   4.68  2.88  0.00 ! #SUP  0.97
assign  ((resid   62 and name HA   )) ((resid   63 and name HG1* ))   5.41  3.61  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG1* )) ((resid   64 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   71 and name HG1* )) ((resid   75 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   63 and name HG1* )) ((resid   80 and name HA   ))   4.13  2.33  0.00 ! #SUP  0.90
assign  ((resid   19 and name HD1* )) ((resid   20 and name HA   ))   5.27  3.47  0.00 ! #SUP  0.99
assign  ((resid   19 and name HD1* )) ((resid   39 and name HA   ))   4.71  2.91  0.00 ! #SUP  0.58
assign  ((resid   19 and name HD1* )) ((resid   80 and name HA   ))   5.03  3.23  0.00 ! #SUP  0.58
assign  ((resid   17 and name HA   )) ((resid   19 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   63 and name HG2* )) ((resid   89 and name HE*  ))   3.81  2.01  0.00 ! #SUP  0.40
assign  ((resid   21 and name HA   )) ((resid   60 and name HG12 ))   5.39  3.59  0.00 ! #SUP  0.69
assign  ((resid   37 and name HB   )) ((resid   60 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   39 and name HB   )) ((resid   60 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   60 and name HD1* )) ((resid   89 and name HE*  ))   4.15  2.35  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   63 and name HG2* ))   5.41  3.61  0.00 ! #SUP  1.00
assign  ((resid   54 and name HD1* )) ((resid   91 and name HD1* ))   2.88  1.08  0.00 ! #SUP  0.97
assign  ((resid   60 and name HA   )) ((resid   60 and name HD1* ))   3.13  1.33  0.00 ! #SUP  1.00
assign  ((resid   54 and name HD1* )) ((resid   91 and name HG11 ))   4.16  2.36  0.00 ! #SUP  0.49
assign  ((resid    8 and name HG1* )) ((resid   54 and name HD1* ))   3.70  1.90  0.00 ! #SUP  0.68
assign  ((resid   87 and name HG1* )) ((resid   88 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.96
assign  ((resid   54 and name HG2* )) ((resid   89 and name HZ   ))   5.50  3.70  0.00 ! #SUP  0.22
assign  ((resid   38 and name HD*  )) ((resid   59 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.78
assign  ((resid   26 and name HB   )) ((resid   38 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.55
assign  ((resid    4 and name HB2  )) ((resid    6 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid    3 and name HG*  )) ((resid    6 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid    4 and name HG1  )) ((resid    6 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   68 and name HB1  )) ((resid   75 and name HE*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   68 and name HG   )) ((resid   75 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.40
assign  ((resid   66 and name HB   )) ((resid   75 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   80 and name HA   )) ((resid   89 and name HZ   ))   5.50  3.70  0.00 ! #SUP  0.72
assign  ((resid    9 and name HA   )) ((resid   89 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   23 and name HA2  )) ((resid   76 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.83
assign  ((resid    7 and name HA   )) ((resid   88 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.83
assign  ((resid   22 and name HG12 )) ((resid   23 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid    7 and name HA   )) ((resid   90 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid    5 and name HB1  )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid    6 and name HA   )) ((resid   90 and name HG1* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid    6 and name HA   )) ((resid   90 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   62 and name HA   )) ((resid   90 and name HG2* ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   19 and name HB   )) ((resid   20 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   20 and name HA   )) ((resid   40 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   19 and name HG2* )) ((resid   20 and name HA   ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   91 and name HG2* )) ((resid   93 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid    4 and name HB1  )) ((resid   93 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.84
assign  ((resid   64 and name HA   )) ((resid   88 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   88 and name HB1  )) ((resid   90 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.75
assign  ((resid   12 and name HE*  )) ((resid   49 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.32
assign  ((resid   24 and name HB*  )) ((resid   37 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.39
assign  ((resid   21 and name HD1* )) ((resid   73 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.41
assign  ((resid   13 and name HB1  )) ((resid   14 and name HG*  ))   5.50  3.70  0.00 ! #SUP  0.79
assign  ((resid   22 and name HD1* )) ((resid   24 and name HG1  ))   5.50  3.70  0.00 ! #SUP  0.56
assign  ((resid   12 and name HE*  )) ((resid   49 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.36
assign  ((resid   11 and name HB2  )) ((resid   86 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid   38 and name HB1  )) ((resid   39 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.59
assign  ((resid   38 and name HB1  )) ((resid   59 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   21 and name HG12 )) ((resid   73 and name HG2  ))   5.50  3.70  0.00 ! #SUP  0.73
assign  ((resid   86 and name HB*  )) ((resid   88 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.91
assign  ((resid    4 and name HG2  )) ((resid    6 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.80
assign  ((resid   81 and name HD*  )) ((resid   82 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.58
assign  ((resid   62 and name HG*  )) ((resid   90 and name HG1* ))   5.50  3.70  0.00 ! #SUP  0.79
assign  ((resid   62 and name HG*  )) ((resid   66 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.86
assign  ((resid   66 and name HG2* )) ((resid   68 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.86
assign  ((resid   35 and name HB*  )) ((resid   37 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   37 and name HB   )) ((resid   76 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.64
assign  ((resid   30 and name HB*  )) ((resid   32 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.25
assign  ((resid   37 and name HD1* )) ((resid   72 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.42
assign  ((resid   12 and name HG1  )) ((resid   17 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   39 and name HG2* )) ((resid   60 and name HG11 ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   71 and name HG2* )) ((resid   76 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.88
assign  ((resid    8 and name HG2* )) ((resid   53 and name HG*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   37 and name HG2* )) ((resid   68 and name HB2  ))   5.50  3.70  0.00 ! #SUP  0.42
assign  ((resid   39 and name HG1* )) ((resid   60 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.37
assign  ((resid   37 and name HG2* )) ((resid   60 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.34
assign  ((resid   39 and name HG1* )) ((resid   41 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.53
assign  ((resid   17 and name HD1* )) ((resid   19 and name HD1* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   63 and name HG2* )) ((resid   66 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   21 and name HG2* )) ((resid   77 and name HB*  ))   5.50  3.70  0.00 ! #SUP  1.00
assign  ((resid   73 and name HB1  )) ((resid   77 and name HB*  ))   5.50  3.70  0.00 ! #SUP  0.35
assign  ((resid   21 and name HB   )) ((resid   60 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   19 and name HA   )) ((resid   20 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.56
assign  ((resid    7 and name HD1  )) ((resid   90 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.85
assign  ((resid    6 and name HA   )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.70
assign  ((resid   21 and name HA   )) ((resid   38 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.46
assign  ((resid   60 and name HA   )) ((resid   61 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   74 and name HA   )) ((resid   78 and name HB   ))   5.50  3.70  0.00 ! #SUP  0.64
assign  ((resid   32 and name HA   )) ((resid   33 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   33 and name HA   )) ((resid   34 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   67 and name HA   )) ((resid   68 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.35
assign  ((resid   10 and name HA   )) ((resid   11 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.64
assign  ((resid   76 and name HA   )) ((resid   79 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   78 and name HA   )) ((resid   79 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   16 and name HA2  )) ((resid   17 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.85
assign  ((resid   64 and name HA   )) ((resid   65 and name HA1  ))   5.50  3.70  0.00 ! #SUP  0.85
assign  ((resid   42 and name HA   )) ((resid   56 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.46
assign  ((resid   23 and name HA2  )) ((resid   37 and name HG12 ))   5.50  3.70  0.00 ! #SUP  0.93
assign  ((resid   71 and name HG1* )) ((resid   75 and name HB1  ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   71 and name HG2* )) ((resid   72 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.82
assign  ((resid   21 and name HG2* )) ((resid   38 and name HA   ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid   61 and name HG2* )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.95
assign  ((resid    4 and name HB1  )) ((resid   92 and name HA2  ))   5.50  3.70  0.00 ! #SUP  0.97
assign  ((resid   23 and name HA2  )) ((resid   38 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.94
assign  ((resid   12 and name HB2  )) ((resid   89 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   63 and name HB   )) ((resid   89 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.89
assign  ((resid   12 and name HB2  )) ((resid   89 and name HZ   ))   5.50  3.70  0.00 ! #SUP  0.76
assign  ((resid   60 and name HG12 )) ((resid   89 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.74
assign  ((resid   75 and name HE*  )) ((resid   78 and name HG2* ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid   54 and name HB   )) ((resid   89 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid   83 and name HG2* )) ((resid   89 and name HD*  ))   5.50  3.70  0.00 ! #SUP  0.98
assign  ((resid    2 and name HB*  )) ((resid    3 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid    3 and name HN   )) ((resid    3 and name HB*  ))   2.89  1.09  0.00 ! #SUP  1.00
assign  ((resid    3 and name HB*  )) ((resid    4 and name HN   ))   4.37  2.57  0.00 ! #SUP  1.00
assign  ((resid    3 and name HG*  )) ((resid   61 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid    4 and name HN   )) ((resid   93 and name HB*  ))   4.84  3.04  0.00 ! #SUP  1.00
assign  ((resid    4 and name HB2  )) ((resid   93 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid    5 and name HA   )) ((resid   61 and name HG*  ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid    5 and name HB2  )) ((resid   61 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid    5 and name HB1  )) ((resid   61 and name HG*  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid    5 and name HG   )) ((resid   61 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid    6 and name HD*  )) ((resid   53 and name HD*  ))   4.79  2.99  0.00 ! #SUP  1.00
assign  ((resid    6 and name HD*  )) ((resid   93 and name HB*  ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid    6 and name HE*  )) ((resid   53 and name HD*  ))   3.64  1.84  0.00 ! #SUP  1.00
assign  ((resid    8 and name HA   )) ((resid    9 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid    8 and name HB   )) ((resid   10 and name HD*  ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid    8 and name HG1* )) ((resid   53 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid    8 and name HG1* )) ((resid   54 and name HG1* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid    8 and name HG2* )) ((resid   53 and name HB*  ))   3.70  1.90  0.00 ! #SUP  1.00
assign  ((resid    9 and name HN   )) ((resid    9 and name HB*  ))   2.92  1.12  0.00 ! #SUP  1.00
assign  ((resid    9 and name HN   )) ((resid   10 and name HD*  ))   5.35  3.55  0.00 ! #SUP  1.00
assign  ((resid    9 and name HA   )) ((resid   87 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid    9 and name HB*  )) ((resid    9 and name HG*  ))   2.42  0.62  0.00 ! #SUP  1.00
assign  ((resid    9 and name HB*  )) ((resid   10 and name HN   ))   4.11  2.31  0.00 ! #SUP  1.00
assign  ((resid    9 and name HB*  )) ((resid   88 and name HA   ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid    9 and name HB*  )) ((resid   88 and name HG1  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid    9 and name HG*  )) ((resid   86 and name HD2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   10 and name HN   )) ((resid   87 and name HG*  ))   3.49  1.69  0.00 ! #SUP  1.00
assign  ((resid   10 and name HA   )) ((resid   10 and name HD*  ))   3.52  1.72  0.00 ! #SUP  1.00
assign  ((resid   10 and name HB2  )) ((resid   10 and name HD*  ))   2.88  1.08  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   11 and name HN   ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   12 and name HN   ))   3.92  2.12  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   12 and name HA   ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   12 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   12 and name HE*  ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   48 and name HN   ))   3.90  2.10  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   48 and name HA   ))   2.60  0.80  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   51 and name HN   ))   3.95  2.15  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   51 and name HB2  ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   51 and name HB1  ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   52 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   54 and name HD1* ))   3.44  1.64  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   89 and name HD*  ))   3.61  1.81  0.00 ! #SUP  1.00
assign  ((resid   10 and name HD*  )) ((resid   89 and name HE*  ))   4.10  2.30  0.00 ! #SUP  1.00
assign  ((resid   11 and name HA   )) ((resid   87 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   11 and name HG*  )) ((resid   86 and name HD2* ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   12 and name HN   )) ((resid   87 and name HG*  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   12 and name HB1  )) ((resid   87 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   12 and name HD*  )) ((resid   17 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   12 and name HE*  )) ((resid   17 and name HD*  ))   3.93  2.13  0.00 ! #SUP  1.00
assign  ((resid   12 and name HE*  )) ((resid   42 and name HG*  ))   4.47  2.67  0.00 ! #SUP  1.00
assign  ((resid   12 and name HE*  )) ((resid   45 and name HA*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   13 and name HN   )) ((resid   13 and name HB*  ))   3.18  1.38  0.00 ! #SUP  1.00
assign  ((resid   13 and name HN   )) ((resid   17 and name HD*  ))   5.27  3.47  0.00 ! #SUP  1.00
assign  ((resid   13 and name HA   )) ((resid   13 and name HB*  ))   2.65  0.85  0.00 ! #SUP  1.00
assign  ((resid   13 and name HB*  )) ((resid   14 and name HN   ))   2.68  0.88  0.00 ! #SUP  1.00
assign  ((resid   13 and name HB*  )) ((resid   14 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   13 and name HB*  )) ((resid   14 and name HG*  ))   4.69  2.89  0.00 ! #SUP  1.00
assign  ((resid   13 and name HB*  )) ((resid   15 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   14 and name HN   )) ((resid   15 and name HB*  ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   15 and name HN   )) ((resid   15 and name HB*  ))   2.61  0.81  0.00 ! #SUP  1.00
assign  ((resid   16 and name HA1  )) ((resid   17 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   17 and name HA   )) ((resid   17 and name HD*  ))   2.77  0.97  0.00 ! #SUP  1.00
assign  ((resid   17 and name HA   )) ((resid   42 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB*  )) ((resid   17 and name HD*  ))   2.70  0.90  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB*  )) ((resid   18 and name HN   ))   3.80  2.00  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB*  )) ((resid   19 and name HN   ))   3.60  1.80  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB*  )) ((resid   19 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB*  )) ((resid   19 and name HG2* ))   3.73  1.93  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB*  )) ((resid   19 and name HD1* ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB*  )) ((resid   87 and name HG*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   17 and name HB*  )) ((resid   89 and name HZ   ))   4.80  3.00  0.00 ! #SUP  1.00
assign  ((resid   17 and name HG   )) ((resid   18 and name HA*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   19 and name HN   ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   19 and name HG11 ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   63 and name HG*  ))   5.37  3.57  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   80 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   80 and name HB2  ))   4.84  3.04  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   80 and name HB1  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   80 and name HD1* ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   81 and name HN   ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   83 and name HA   ))   4.92  3.12  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   83 and name HB   ))   4.96  3.16  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   87 and name HG*  ))   3.04  1.24  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   89 and name HD*  ))   4.66  2.86  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   89 and name HE*  ))   3.65  1.85  0.00 ! #SUP  1.00
assign  ((resid   17 and name HD*  )) ((resid   89 and name HZ   ))   2.73  0.93  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA*  )) ((resid   19 and name HA   ))   5.07  3.27  0.00 ! #SUP  1.00
assign  ((resid   18 and name HA*  )) ((resid   43 and name HB   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   19 and name HN   )) ((resid   42 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   20 and name HN   )) ((resid   56 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   22 and name HN   )) ((resid   22 and name HG1* ))   4.24  2.44  0.00 ! #SUP  1.00
assign  ((resid   22 and name HA   )) ((resid   22 and name HG1* ))   2.87  1.07  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG1* )) ((resid   23 and name HN   ))   3.15  1.35  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG1* )) ((resid   23 and name HA1  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG1* )) ((resid   24 and name HN   ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG1* )) ((resid   24 and name HA   ))   4.73  2.93  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG1* )) ((resid   24 and name HG2  ))   4.11  2.31  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG1* )) ((resid   24 and name HG1  ))   5.02  3.22  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG1* )) ((resid   38 and name HN   ))   5.19  3.39  0.00 ! #SUP  1.00
assign  ((resid   22 and name HG1* )) ((resid   38 and name HD*  ))   4.98  3.18  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA2  )) ((resid   26 and name HG*  ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   25 and name HA1  )) ((resid   26 and name HG*  ))   5.11  3.31  0.00 ! #SUP  1.00
assign  ((resid   26 and name HN   )) ((resid   26 and name HG*  ))   2.70  0.90  0.00 ! #SUP  1.00
assign  ((resid   26 and name HA   )) ((resid   26 and name HG*  ))   2.62  0.82  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   27 and name HN   ))   4.05  2.25  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   27 and name HA*  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   33 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   34 and name HN   ))   4.42  2.62  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   34 and name HB*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   35 and name HG   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   35 and name HD*  ))   5.37  3.57  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   36 and name HA*  ))   3.97  2.17  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   38 and name HE*  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   26 and name HG*  )) ((resid   59 and name HE2* ))   5.27  3.47  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA*  )) ((resid   28 and name HN   ))   3.11  1.31  0.00 ! #SUP  1.00
assign  ((resid   27 and name HA*  )) ((resid   28 and name HB*  ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   28 and name HB*  )) ((resid   29 and name HB*  ))   4.81  3.01  0.00 ! #SUP  1.00
assign  ((resid   28 and name HB*  )) ((resid   33 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   29 and name HN   )) ((resid   29 and name HB*  ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   29 and name HA   )) ((resid   29 and name HB*  ))   2.55  0.75  0.00 ! #SUP  1.00
assign  ((resid   29 and name HB*  )) ((resid   30 and name HN   ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   30 and name HB*  )) ((resid   32 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   31 and name HA2  )) ((resid   32 and name HD*  ))   4.31  2.51  0.00 ! #SUP  1.00
assign  ((resid   31 and name HA1  )) ((resid   32 and name HD*  ))   3.30  1.50  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   32 and name HD*  ))   3.67  1.87  0.00 ! #SUP  1.00
assign  ((resid   32 and name HN   )) ((resid   33 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   32 and name HA   )) ((resid   32 and name HD*  ))   3.11  1.31  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB2  )) ((resid   32 and name HD*  ))   2.58  0.78  0.00 ! #SUP  1.00
assign  ((resid   32 and name HB2  )) ((resid   34 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   32 and name HD*  )) ((resid   33 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   33 and name HB*  ))   3.33  1.53  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   33 and name HG*  ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   33 and name HN   )) ((resid   34 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   33 and name HA   )) ((resid   33 and name HG*  ))   2.96  1.16  0.00 ! #SUP  1.00
assign  ((resid   33 and name HA   )) ((resid   34 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB*  )) ((resid   34 and name HN   ))   4.31  2.51  0.00 ! #SUP  1.00
assign  ((resid   33 and name HB*  )) ((resid   34 and name HA   ))   4.72  2.92  0.00 ! #SUP  1.00
assign  ((resid   33 and name HG*  )) ((resid   34 and name HN   ))   4.60  2.80  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   34 and name HB*  ))   3.12  1.32  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   34 and name HG*  ))   3.76  1.96  0.00 ! #SUP  1.00
assign  ((resid   34 and name HN   )) ((resid   35 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   34 and name HB*  ))   2.56  0.76  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   34 and name HG*  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   34 and name HA   )) ((resid   35 and name HD*  ))   4.52  2.72  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB*  )) ((resid   34 and name HE*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB*  )) ((resid   35 and name HN   ))   3.00  1.20  0.00 ! #SUP  1.00
assign  ((resid   34 and name HB*  )) ((resid   35 and name HD*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   34 and name HG*  )) ((resid   34 and name HE*  ))   3.00  1.20  0.00 ! #SUP  1.00
assign  ((resid   34 and name HG*  )) ((resid   35 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   34 and name HG*  )) ((resid   35 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   34 and name HD*  )) ((resid   35 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   34 and name HE*  )) ((resid   35 and name HD*  ))   4.01  2.21  0.00 ! #SUP  1.00
assign  ((resid   35 and name HN   )) ((resid   35 and name HD*  ))   3.58  1.78  0.00 ! #SUP  1.00
assign  ((resid   35 and name HN   )) ((resid   69 and name HG*  ))   5.10  3.30  0.00 ! #SUP  1.00
assign  ((resid   35 and name HN   )) ((resid   70 and name HA*  ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   35 and name HA   )) ((resid   70 and name HA*  ))   3.57  1.77  0.00 ! #SUP  1.00
assign  ((resid   35 and name HB*  )) ((resid   35 and name HD*  ))   2.53  0.73  0.00 ! #SUP  1.00
assign  ((resid   35 and name HB*  )) ((resid   36 and name HA*  ))   5.17  3.37  0.00 ! #SUP  1.00
assign  ((resid   35 and name HB*  )) ((resid   61 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HB*  )) ((resid   70 and name HA*  ))   4.41  2.61  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   36 and name HN   ))   3.98  2.18  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   36 and name HA*  ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   37 and name HN   ))   4.24  2.44  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   37 and name HA   ))   4.56  2.76  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   37 and name HB   ))   3.28  1.48  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   37 and name HG2* ))   3.78  1.98  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   37 and name HG12 ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   37 and name HG11 ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   37 and name HD1* ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   38 and name HA   ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   38 and name HD*  ))   5.15  3.35  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   38 and name HE*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   39 and name HG2* ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   59 and name HG*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   59 and name HE2* ))   3.82  2.02  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   60 and name HN   ))   5.08  3.28  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   60 and name HA   ))   5.27  3.47  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   60 and name HG12 ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   60 and name HD1* ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   61 and name HN   ))   4.87  3.07  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   61 and name HA   ))   3.22  1.42  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   61 and name HB   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   61 and name HG*  ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   68 and name HB2  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   68 and name HD*  ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   70 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   35 and name HD*  )) ((resid   71 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   36 and name HN   )) ((resid   70 and name HA*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   36 and name HA*  )) ((resid   37 and name HN   ))   3.05  1.25  0.00 ! #SUP  1.00
assign  ((resid   36 and name HA*  )) ((resid   38 and name HD*  ))   4.14  2.34  0.00 ! #SUP  1.00
assign  ((resid   36 and name HA*  )) ((resid   38 and name HE*  ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   36 and name HA*  )) ((resid   59 and name HE2* ))   4.07  2.27  0.00 ! #SUP  1.00
assign  ((resid   37 and name HN   )) ((resid   59 and name HE2* ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   37 and name HA   )) ((resid   59 and name HE2* ))   4.52  2.72  0.00 ! #SUP  1.00
assign  ((resid   37 and name HB   )) ((resid   68 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   38 and name HA   )) ((resid   59 and name HG*  ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   38 and name HE*  )) ((resid   59 and name HG*  ))   4.68  2.88  0.00 ! #SUP  1.00
assign  ((resid   39 and name HN   )) ((resid   56 and name HG*  ))   5.42  3.62  0.00 ! #SUP  1.00
assign  ((resid   39 and name HB   )) ((resid   56 and name HG*  ))   3.51  1.71  0.00 ! #SUP  1.00
assign  ((resid   39 and name HB   )) ((resid   58 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   39 and name HG1* )) ((resid   56 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   39 and name HG2* )) ((resid   58 and name HB*  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   41 and name HA   )) ((resid   42 and name HG*  ))   3.77  1.97  0.00 ! #SUP  1.00
assign  ((resid   41 and name HA   )) ((resid   56 and name HG*  ))   2.61  0.81  0.00 ! #SUP  1.00
assign  ((resid   41 and name HB   )) ((resid   42 and name HG*  ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   41 and name HB   )) ((resid   56 and name HG*  ))   4.19  2.39  0.00 ! #SUP  1.00
assign  ((resid   42 and name HN   )) ((resid   42 and name HG*  ))   3.10  1.30  0.00 ! #SUP  1.00
assign  ((resid   42 and name HN   )) ((resid   56 and name HG*  ))   3.10  1.30  0.00 ! #SUP  1.00
assign  ((resid   42 and name HA   )) ((resid   42 and name HG*  ))   2.65  0.85  0.00 ! #SUP  1.00
assign  ((resid   42 and name HA   )) ((resid   56 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   42 and name HB   )) ((resid   56 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   43 and name HN   ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   46 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   48 and name HB*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   49 and name HN   ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   49 and name HA   ))   4.67  2.87  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   49 and name HB*  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   49 and name HG2  ))   3.63  1.83  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   49 and name HG1  ))   3.28  1.48  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   49 and name HE21 ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   49 and name HE22 ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   55 and name HA   ))   4.06  2.26  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   56 and name HN   ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   56 and name HA   ))   2.75  0.95  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   56 and name HB   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   42 and name HG*  )) ((resid   56 and name HG*  ))   5.38  3.58  0.00 ! #SUP  1.00
assign  ((resid   43 and name HG2* )) ((resid   44 and name HB*  ))   5.03  3.23  0.00 ! #SUP  1.00
assign  ((resid   43 and name HG2* )) ((resid   45 and name HA*  ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   43 and name HG2* )) ((resid   46 and name HA*  ))   4.46  2.66  0.00 ! #SUP  1.00
assign  ((resid   44 and name HN   )) ((resid   44 and name HB*  ))   2.92  1.12  0.00 ! #SUP  1.00
assign  ((resid   44 and name HA   )) ((resid   45 and name HA*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   44 and name HB*  )) ((resid   44 and name HG*  ))   2.31  0.51  0.00 ! #SUP  1.00
assign  ((resid   44 and name HB*  )) ((resid   45 and name HN   ))   3.62  1.82  0.00 ! #SUP  1.00
assign  ((resid   44 and name HG*  )) ((resid   45 and name HA*  ))   4.19  2.39  0.00 ! #SUP  1.00
assign  ((resid   45 and name HA*  )) ((resid   46 and name HN   ))   3.12  1.32  0.00 ! #SUP  1.00
assign  ((resid   46 and name HA*  )) ((resid   47 and name HN   ))   2.82  1.02  0.00 ! #SUP  1.00
assign  ((resid   46 and name HA*  )) ((resid   48 and name HN   ))   4.49  2.69  0.00 ! #SUP  1.00
assign  ((resid   47 and name HN   )) ((resid   50 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   49 and name HN   )) ((resid   50 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   49 and name HB*  )) ((resid   50 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   50 and name HG*  ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   50 and name HN   )) ((resid   50 and name HD*  ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   50 and name HA   )) ((resid   50 and name HG*  ))   2.69  0.89  0.00 ! #SUP  1.00
assign  ((resid   50 and name HA   )) ((resid   50 and name HD*  ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   50 and name HB*  )) ((resid   50 and name HD*  ))   3.16  1.36  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG*  )) ((resid   50 and name HD*  ))   2.28  0.48  0.00 ! #SUP  1.00
assign  ((resid   50 and name HG*  )) ((resid   51 and name HN   ))   4.77  2.97  0.00 ! #SUP  1.00
assign  ((resid   52 and name HN   )) ((resid   52 and name HA*  ))   2.51  0.71  0.00 ! #SUP  1.00
assign  ((resid   52 and name HA*  )) ((resid   53 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   53 and name HA   )) ((resid   53 and name HD*  ))   3.79  1.99  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   53 and name HD*  ))   3.15  1.35  0.00 ! #SUP  1.00
assign  ((resid   53 and name HB*  )) ((resid   54 and name HG2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   53 and name HD*  )) ((resid   54 and name HA   ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   53 and name HD*  )) ((resid   54 and name HG1* ))   5.18  3.38  0.00 ! #SUP  1.00
assign  ((resid   54 and name HN   )) ((resid   54 and name HG1* ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   54 and name HA   )) ((resid   55 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   54 and name HG2* )) ((resid   55 and name HB*  ))   5.18  3.38  0.00 ! #SUP  1.00
assign  ((resid   54 and name HG1* )) ((resid   55 and name HN   ))   4.16  2.36  0.00 ! #SUP  1.00
assign  ((resid   54 and name HG1* )) ((resid   55 and name HG*  ))   4.76  2.96  0.00 ! #SUP  1.00
assign  ((resid   54 and name HG1* )) ((resid   91 and name HB   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   54 and name HG1* )) ((resid   91 and name HG2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   54 and name HG1* )) ((resid   91 and name HG12 ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   54 and name HG1* )) ((resid   91 and name HD1* ))   3.43  1.63  0.00 ! #SUP  1.00
assign  ((resid   55 and name HN   )) ((resid   55 and name HB*  ))   3.50  1.70  0.00 ! #SUP  1.00
assign  ((resid   55 and name HN   )) ((resid   55 and name HG*  ))   3.96  2.16  0.00 ! #SUP  1.00
assign  ((resid   55 and name HN   )) ((resid   58 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   55 and name HA   )) ((resid   55 and name HE2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   55 and name HA   )) ((resid   56 and name HG*  ))   4.48  2.68  0.00 ! #SUP  1.00
assign  ((resid   55 and name HA   )) ((resid   58 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB*  )) ((resid   55 and name HE2* ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB*  )) ((resid   56 and name HN   ))   2.49  0.69  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB*  )) ((resid   56 and name HG*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB*  )) ((resid   57 and name HN   ))   3.94  2.14  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB*  )) ((resid   57 and name HB*  ))   5.11  3.31  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB*  )) ((resid   58 and name HN   ))   4.45  2.65  0.00 ! #SUP  1.00
assign  ((resid   55 and name HB*  )) ((resid   58 and name HB*  ))   5.18  3.38  0.00 ! #SUP  1.00
assign  ((resid   55 and name HG*  )) ((resid   55 and name HE2* ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   55 and name HG*  )) ((resid   56 and name HN   ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   56 and name HN   )) ((resid   56 and name HG*  ))   2.61  0.81  0.00 ! #SUP  1.00
assign  ((resid   56 and name HA   )) ((resid   56 and name HG*  ))   2.59  0.79  0.00 ! #SUP  1.00
assign  ((resid   56 and name HB   )) ((resid   57 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   56 and name HG*  )) ((resid   57 and name HN   ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   56 and name HG*  )) ((resid   57 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   56 and name HG*  )) ((resid   57 and name HB*  ))   4.18  2.38  0.00 ! #SUP  1.00
assign  ((resid   56 and name HG*  )) ((resid   57 and name HD21 ))   3.91  2.11  0.00 ! #SUP  1.00
assign  ((resid   56 and name HG*  )) ((resid   57 and name HD22 ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   56 and name HG*  )) ((resid   58 and name HN   ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   57 and name HB*  ))   3.33  1.53  0.00 ! #SUP  1.00
assign  ((resid   57 and name HN   )) ((resid   58 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   57 and name HA   )) ((resid   57 and name HB*  ))   2.64  0.84  0.00 ! #SUP  1.00
assign  ((resid   57 and name HB*  )) ((resid   57 and name HD22 ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   57 and name HB*  )) ((resid   58 and name HN   ))   3.88  2.08  0.00 ! #SUP  1.00
assign  ((resid   57 and name HB*  )) ((resid   58 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   58 and name HN   )) ((resid   58 and name HB*  ))   2.98  1.18  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB*  )) ((resid   59 and name HN   ))   3.14  1.34  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB*  )) ((resid   59 and name HB1  ))   4.31  2.51  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB*  )) ((resid   61 and name HG*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB*  )) ((resid   91 and name HB   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB*  )) ((resid   91 and name HG12 ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB*  )) ((resid   91 and name HD1* ))   4.39  2.59  0.00 ! #SUP  1.00
assign  ((resid   58 and name HB*  )) ((resid   92 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   59 and name HA   )) ((resid   59 and name HG*  ))   3.59  1.79  0.00 ! #SUP  1.00
assign  ((resid   59 and name HA   )) ((resid   61 and name HG*  ))   5.31  3.51  0.00 ! #SUP  1.00
assign  ((resid   59 and name HG*  )) ((resid   60 and name HN   ))   3.37  1.57  0.00 ! #SUP  1.00
assign  ((resid   59 and name HG*  )) ((resid   61 and name HN   ))   4.97  3.17  0.00 ! #SUP  1.00
assign  ((resid   59 and name HG*  )) ((resid   61 and name HG*  ))   4.85  3.05  0.00 ! #SUP  1.00
assign  ((resid   59 and name HG*  )) ((resid   91 and name HG12 ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   60 and name HN   )) ((resid   61 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   60 and name HA   )) ((resid   61 and name HG*  ))   4.04  2.24  0.00 ! #SUP  1.00
assign  ((resid   61 and name HN   )) ((resid   61 and name HG*  ))   2.96  1.16  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   61 and name HG*  ))   2.60  0.80  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   68 and name HD*  ))   4.36  2.56  0.00 ! #SUP  1.00
assign  ((resid   61 and name HA   )) ((resid   69 and name HG*  ))   3.53  1.73  0.00 ! #SUP  1.00
assign  ((resid   61 and name HB   )) ((resid   69 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   62 and name HN   ))   3.19  1.39  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   62 and name HA   ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   62 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   67 and name HA   ))   5.06  3.26  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   69 and name HG*  ))   5.38  3.58  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   90 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   91 and name HN   ))   4.33  2.53  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   91 and name HA   ))   2.88  1.08  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   92 and name HN   ))   3.32  1.52  0.00 ! #SUP  1.00
assign  ((resid   61 and name HG*  )) ((resid   92 and name HA1  ))   4.28  2.48  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   63 and name HG*  ))   4.38  2.58  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   67 and name HB*  ))   4.62  2.82  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   68 and name HD*  ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   62 and name HA   )) ((resid   79 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   62 and name HB*  )) ((resid   69 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   62 and name HG*  )) ((resid   67 and name HB*  ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   63 and name HG*  ))   3.65  1.85  0.00 ! #SUP  1.00
assign  ((resid   63 and name HN   )) ((resid   68 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   68 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HA   )) ((resid   87 and name HG*  ))   4.22  2.42  0.00 ! #SUP  1.00
assign  ((resid   63 and name HB   )) ((resid   68 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HB   )) ((resid   79 and name HG*  ))   2.99  1.19  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   64 and name HN   ))   2.98  1.18  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   64 and name HA   ))   4.02  2.22  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   64 and name HB*  ))   3.18  1.38  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   66 and name HN   ))   4.43  2.63  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   66 and name HB   ))   3.85  2.05  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   66 and name HG1* ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   66 and name HD1* ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   68 and name HB1  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   79 and name HG*  ))   3.26  1.46  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   80 and name HN   ))   5.17  3.37  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   80 and name HA   ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   80 and name HD1* ))   2.55  0.75  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   80 and name HD2* ))   3.21  1.41  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   83 and name HB   ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   83 and name HG2* ))   2.55  0.75  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   87 and name HA   ))   4.82  3.02  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   87 and name HG*  ))   2.37  0.57  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   88 and name HB2  ))   5.42  3.62  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   88 and name HB1  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   89 and name HA   ))   3.50  1.70  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   89 and name HB1  ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   89 and name HD*  ))   3.10  1.30  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   89 and name HE*  ))   3.08  1.28  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   89 and name HZ   ))   4.95  3.15  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   90 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   63 and name HG*  )) ((resid   91 and name HN   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   64 and name HN   )) ((resid   79 and name HG*  ))   4.86  3.06  0.00 ! #SUP  1.00
assign  ((resid   64 and name HN   )) ((resid   87 and name HG*  ))   3.43  1.63  0.00 ! #SUP  1.00
assign  ((resid   64 and name HA   )) ((resid   79 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   64 and name HA   )) ((resid   87 and name HG*  ))   4.40  2.60  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB*  )) ((resid   65 and name HN   ))   3.96  2.16  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB*  )) ((resid   66 and name HN   ))   4.00  2.20  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB*  )) ((resid   66 and name HG2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB*  )) ((resid   66 and name HD1* ))   4.57  2.77  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB*  )) ((resid   87 and name HG*  ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   64 and name HB*  )) ((resid   88 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   66 and name HG1* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   66 and name HN   )) ((resid   79 and name HG*  ))   4.26  2.46  0.00 ! #SUP  1.00
assign  ((resid   66 and name HA   )) ((resid   66 and name HG1* ))   2.68  0.88  0.00 ! #SUP  1.00
assign  ((resid   66 and name HA   )) ((resid   67 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   66 and name HA   )) ((resid   79 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   66 and name HB   )) ((resid   79 and name HG*  ))   3.40  1.60  0.00 ! #SUP  1.00
assign  ((resid   66 and name HG2* )) ((resid   67 and name HB*  ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   66 and name HG2* )) ((resid   79 and name HG*  ))   2.39  0.59  0.00 ! #SUP  1.00
assign  ((resid   66 and name HG1* )) ((resid   67 and name HN   ))   5.31  3.51  0.00 ! #SUP  1.00
assign  ((resid   66 and name HG1* )) ((resid   75 and name HD*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   66 and name HD1* )) ((resid   79 and name HG*  ))   2.84  1.04  0.00 ! #SUP  1.00
assign  ((resid   67 and name HN   )) ((resid   67 and name HB*  ))   2.97  1.17  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA   )) ((resid   68 and name HD*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   67 and name HA   )) ((resid   69 and name HG*  ))   4.69  2.89  0.00 ! #SUP  1.00
assign  ((resid   67 and name HB*  )) ((resid   68 and name HN   ))   4.20  2.40  0.00 ! #SUP  1.00
assign  ((resid   67 and name HB*  )) ((resid   68 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   67 and name HB*  )) ((resid   68 and name HD*  ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   67 and name HB*  )) ((resid   69 and name HN   ))   4.45  2.65  0.00 ! #SUP  1.00
assign  ((resid   67 and name HB*  )) ((resid   69 and name HG*  ))   3.56  1.76  0.00 ! #SUP  1.00
assign  ((resid   68 and name HN   )) ((resid   68 and name HD*  ))   3.43  1.63  0.00 ! #SUP  1.00
assign  ((resid   68 and name HN   )) ((resid   69 and name HG*  ))   4.07  2.27  0.00 ! #SUP  1.00
assign  ((resid   68 and name HB2  )) ((resid   68 and name HD*  ))   2.88  1.08  0.00 ! #SUP  1.00
assign  ((resid   68 and name HB1  )) ((resid   68 and name HD*  ))   2.95  1.15  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   69 and name HN   ))   3.71  1.91  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   69 and name HA   ))   4.54  2.74  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   71 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   71 and name HG1* ))   3.55  1.75  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   75 and name HD*  ))   3.81  2.01  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   75 and name HE*  ))   4.59  2.79  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   76 and name HA   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   76 and name HB*  ))   3.10  1.30  0.00 ! #SUP  1.00
assign  ((resid   68 and name HD*  )) ((resid   79 and name HB   ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   69 and name HN   )) ((resid   69 and name HG*  ))   2.64  0.84  0.00 ! #SUP  1.00
assign  ((resid   69 and name HA   )) ((resid   69 and name HG*  ))   2.60  0.80  0.00 ! #SUP  1.00
assign  ((resid   69 and name HG*  )) ((resid   70 and name HN   ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   69 and name HG*  )) ((resid   70 and name HA*  ))   3.89  2.09  0.00 ! #SUP  1.00
assign  ((resid   69 and name HG*  )) ((resid   71 and name HG1* ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA*  )) ((resid   71 and name HN   ))   3.04  1.24  0.00 ! #SUP  1.00
assign  ((resid   70 and name HA*  )) ((resid   71 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   72 and name HB   )) ((resid   74 and name HD2* ))   2.79  0.99  0.00 ! #SUP  1.00
assign  ((resid   72 and name HG2* )) ((resid   74 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   72 and name HG2* )) ((resid   74 and name HD2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   73 and name HE21 )) ((resid   74 and name HD2* ))   4.90  3.10  0.00 ! #SUP  1.00
assign  ((resid   73 and name HE22 )) ((resid   74 and name HD2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   74 and name HN   )) ((resid   74 and name HB*  ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   74 and name HA   )) ((resid   74 and name HB*  ))   2.55  0.75  0.00 ! #SUP  1.00
assign  ((resid   74 and name HB*  )) ((resid   75 and name HN   ))   3.75  1.95  0.00 ! #SUP  1.00
assign  ((resid   74 and name HB*  )) ((resid   77 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   74 and name HD2* )) ((resid   75 and name HA   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   75 and name HD*  )) ((resid   79 and name HG*  ))   3.05  1.25  0.00 ! #SUP  1.00
assign  ((resid   75 and name HE*  )) ((resid   79 and name HG*  ))   3.07  1.27  0.00 ! #SUP  1.00
assign  ((resid   76 and name HA   )) ((resid   79 and name HG*  ))   3.04  1.24  0.00 ! #SUP  1.00
assign  ((resid   78 and name HN   )) ((resid   79 and name HG*  ))   4.17  2.37  0.00 ! #SUP  1.00
assign  ((resid   78 and name HN   )) ((resid   81 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   78 and name HA   )) ((resid   81 and name HB*  ))   3.02  1.22  0.00 ! #SUP  1.00
assign  ((resid   78 and name HB   )) ((resid   79 and name HG*  ))   3.87  2.07  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   79 and name HG*  ))   4.13  2.33  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   81 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   78 and name HG2* )) ((resid   81 and name HG*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   79 and name HN   )) ((resid   79 and name HG*  ))   2.47  0.67  0.00 ! #SUP  1.00
assign  ((resid   79 and name HA   )) ((resid   79 and name HG*  ))   2.30  0.50  0.00 ! #SUP  1.00
assign  ((resid   79 and name HG*  )) ((resid   80 and name HN   ))   3.22  1.42  0.00 ! #SUP  1.00
assign  ((resid   79 and name HG*  )) ((resid   80 and name HA   ))   3.42  1.62  0.00 ! #SUP  1.00
assign  ((resid   79 and name HG*  )) ((resid   82 and name HB2  ))   4.65  2.85  0.00 ! #SUP  1.00
assign  ((resid   79 and name HG*  )) ((resid   83 and name HN   ))   4.61  2.81  0.00 ! #SUP  1.00
assign  ((resid   79 and name HG*  )) ((resid   83 and name HG2* ))   3.41  1.61  0.00 ! #SUP  1.00
assign  ((resid   79 and name HG*  )) ((resid   87 and name HG*  ))   5.38  3.58  0.00 ! #SUP  1.00
assign  ((resid   80 and name HA   )) ((resid   87 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   80 and name HD1* )) ((resid   87 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   81 and name HN   )) ((resid   81 and name HB*  ))   2.50  0.70  0.00 ! #SUP  1.00
assign  ((resid   81 and name HA   )) ((resid   81 and name HG*  ))   3.23  1.43  0.00 ! #SUP  1.00
assign  ((resid   81 and name HB*  )) ((resid   81 and name HD*  ))   2.72  0.92  0.00 ! #SUP  1.00
assign  ((resid   81 and name HB*  )) ((resid   82 and name HN   ))   3.14  1.34  0.00 ! #SUP  1.00
assign  ((resid   81 and name HB*  )) ((resid   83 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   81 and name HG*  )) ((resid   81 and name HD*  ))   2.39  0.59  0.00 ! #SUP  1.00
assign  ((resid   81 and name HG*  )) ((resid   82 and name HN   ))   5.11  3.31  0.00 ! #SUP  1.00
assign  ((resid   83 and name HA   )) ((resid   87 and name HG*  ))   3.96  2.16  0.00 ! #SUP  1.00
assign  ((resid   83 and name HB   )) ((resid   87 and name HG*  ))   2.94  1.14  0.00 ! #SUP  1.00
assign  ((resid   83 and name HG2* )) ((resid   87 and name HG*  ))   2.61  0.81  0.00 ! #SUP  1.00
assign  ((resid   84 and name HN   )) ((resid   84 and name HG*  ))   3.86  2.06  0.00 ! #SUP  1.00
assign  ((resid   84 and name HN   )) ((resid   87 and name HG*  ))   3.48  1.68  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   84 and name HG*  ))   3.45  1.65  0.00 ! #SUP  1.00
assign  ((resid   84 and name HA   )) ((resid   87 and name HG*  ))   5.15  3.35  0.00 ! #SUP  1.00
assign  ((resid   84 and name HB*  )) ((resid   87 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   84 and name HG*  )) ((resid   84 and name HE*  ))   3.39  1.59  0.00 ! #SUP  1.00
assign  ((resid   84 and name HG*  )) ((resid   85 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   85 and name HA1  )) ((resid   87 and name HG*  ))   5.44  3.64  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   86 and name HD2* ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   86 and name HN   )) ((resid   87 and name HG*  ))   4.75  2.95  0.00 ! #SUP  1.00
assign  ((resid   86 and name HA   )) ((resid   86 and name HD2* ))   3.99  2.19  0.00 ! #SUP  1.00
assign  ((resid   86 and name HA   )) ((resid   87 and name HG*  ))   3.74  1.94  0.00 ! #SUP  1.00
assign  ((resid   86 and name HB*  )) ((resid   86 and name HD2* ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   86 and name HD2* )) ((resid   87 and name HN   ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   87 and name HN   )) ((resid   87 and name HG*  ))   3.03  1.23  0.00 ! #SUP  1.00
assign  ((resid   87 and name HA   )) ((resid   87 and name HG*  ))   2.63  0.83  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG*  )) ((resid   88 and name HN   ))   2.85  1.05  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG*  )) ((resid   88 and name HA   ))   4.27  2.47  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG*  )) ((resid   89 and name HN   ))   4.40  2.60  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG*  )) ((resid   89 and name HA   ))   5.28  3.48  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG*  )) ((resid   89 and name HD*  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG*  )) ((resid   89 and name HE*  ))   2.90  1.10  0.00 ! #SUP  1.00
assign  ((resid   87 and name HG*  )) ((resid   89 and name HZ   ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   91 and name HG2* )) ((resid   93 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   92 and name HA2  )) ((resid   93 and name HB*  ))   5.34  3.54  0.00 ! #SUP  1.00
assign  ((resid   93 and name HN   )) ((resid   93 and name HB*  ))   3.01  1.21  0.00 ! #SUP  1.00
assign  ((resid   93 and name HN   )) ((resid   93 and name HG*  ))   4.34  2.54  0.00 ! #SUP  1.00
assign  ((resid   93 and name HN   )) ((resid   93 and name HD*  ))   5.14  3.34  0.00 ! #SUP  1.00
assign  ((resid   93 and name HA   )) ((resid   93 and name HG*  ))   3.25  1.45  0.00 ! #SUP  1.00
assign  ((resid   93 and name HA   )) ((resid   93 and name HD*  ))   3.84  2.04  0.00 ! #SUP  1.00
assign  ((resid   93 and name HB*  )) ((resid   93 and name HD*  ))   3.10  1.30  0.00 ! #SUP  1.00
assign  ((resid   93 and name HG*  )) ((resid   94 and name HN   ))   3.72  1.92  0.00 ! #SUP  1.00
assign  ((resid   93 and name HD*  )) ((resid   94 and name HN   ))   4.35  2.55  0.00 ! #SUP  1.00
assign  ((resid   94 and name HN   )) ((resid   94 and name HB*  ))   2.78  0.98  0.00 ! #SUP  1.00
assign  ((resid   94 and name HN   )) ((resid   94 and name HG*  ))   3.24  1.44  0.00 ! #SUP  1.00
assign  ((resid   94 and name HA   )) ((resid   94 and name HG*  ))   3.50  1.70  0.00 ! #SUP  1.00

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1  14.180 -16.075   2.855
    2   2H    GLY   1          2H        GLY   1  13.198 -16.081   4.223
    3   3H    GLY   1          3H        GLY   1  13.567 -14.626   3.432
    4   1HA   GLY   1          1HA       GLY   1  11.974 -16.827   2.290
    5   2HA   GLY   1          2HA       GLY   1  11.349 -15.295   2.891
    6    H    HIS   2           H        HIS   2  10.538 -14.713   0.880
    7    HA   HIS   2           HA       HIS   2  12.517 -13.561  -0.885
    8   1HB   HIS   2          1HB       HIS   2  11.413 -14.464  -2.912
    9   2HB   HIS   2          2HB       HIS   2  12.042 -15.769  -1.922
   10    HD1  HIS   2           HD1      HIS   2   8.888 -14.476  -3.419
   11    HD2  HIS   2           HD2      HIS   2  10.027 -17.291  -0.590
   12    HE1  HIS   2           HE1      HIS   2   6.867 -15.886  -2.997
   13    H    MET   3           H        MET   3  11.717 -11.662  -1.817
   14    HA   MET   3           HA       MET   3   9.353 -10.656  -0.559
   15   1HB   MET   3          1HB       MET   3  11.274  -9.158  -0.885
   16   2HB   MET   3          2HB       MET   3  11.146  -9.365  -2.629
   17   1HG   MET   3          1HG       MET   3   8.987  -8.284  -2.637
   18   2HG   MET   3          2HG       MET   3   9.015  -8.148  -0.883
   19   1HE   MET   3          1HE       MET   3  10.689  -6.989  -4.254
   20   2HE   MET   3          2HE       MET   3  12.078  -7.552  -3.324
   21   3HE   MET   3          3HE       MET   3  11.890  -5.835  -3.676
   22    H    GLU   4           H        GLU   4   7.492 -11.205  -1.225
   23    HA   GLU   4           HA       GLU   4   6.940 -12.107  -3.908
   24   1HB   GLU   4          1HB       GLU   4   6.043 -13.162  -1.728
   25   2HB   GLU   4          2HB       GLU   4   5.197 -11.650  -1.567
   26   1HG   GLU   4          1HG       GLU   4   3.910 -11.976  -3.550
   27   2HG   GLU   4          2HG       GLU   4   4.799 -13.440  -3.919
   28    H    LEU   5           H        LEU   5   6.527 -10.456  -5.348
   29    HA   LEU   5           HA       LEU   5   5.125  -8.115  -4.359
   30   1HB   LEU   5          1HB       LEU   5   5.968  -8.675  -7.228
   31   2HB   LEU   5          2HB       LEU   5   5.420  -7.152  -6.540
   32    HG   LEU   5           HG       LEU   5   7.652  -6.871  -6.822
   33   1HD1  LEU   5          11HD      LEU   5   8.589  -6.613  -4.593
   34   2HD1  LEU   5          12HD      LEU   5   7.310  -7.664  -3.981
   35   3HD1  LEU   5          13HD      LEU   5   6.894  -6.102  -4.692
   36   1HD2  LEU   5          21HD      LEU   5   8.374  -9.154  -7.248
   37   2HD2  LEU   5          22HD      LEU   5   8.213  -9.540  -5.533
   38   3HD2  LEU   5          23HD      LEU   5   9.434  -8.389  -6.064
   39    H    PHE   6           H        PHE   6   3.019  -8.300  -4.160
   40    HA   PHE   6           HA       PHE   6   1.680 -10.127  -5.981
   41   1HB   PHE   6          1HB       PHE   6   0.162 -10.623  -4.059
   42   2HB   PHE   6          2HB       PHE   6   1.737 -11.389  -4.006
   43    HD1  PHE   6           HD1      PHE   6  -0.582  -9.004  -2.623
   44    HD2  PHE   6           HD2      PHE   6   3.307 -10.607  -2.193
   45    HE1  PHE   6           HE1      PHE   6  -0.427  -8.020  -0.343
   46    HE2  PHE   6           HE2      PHE   6   3.495  -9.664   0.031
   47    HZ   PHE   6           HZ       PHE   6   1.626  -8.353   0.985
   48    HA   PRO   7           HA       PRO   7  -1.344  -6.872  -6.406
   49   1HB   PRO   7          1HB       PRO   7  -2.969  -8.108  -8.005
   50   2HB   PRO   7          2HB       PRO   7  -1.356  -7.670  -8.563
   51   1HG   PRO   7          1HG       PRO   7  -2.309 -10.368  -7.575
   52   2HG   PRO   7          2HG       PRO   7  -1.308 -10.013  -9.016
   53   1HD   PRO   7          1HD       PRO   7  -0.405 -10.825  -6.535
   54   2HD   PRO   7          2HD       PRO   7   0.570  -9.903  -7.717
   55    H    VAL   8           H        VAL   8  -2.891  -6.409  -5.016
   56    HA   VAL   8           HA       VAL   8  -4.734  -8.539  -4.238
   57    HB   VAL   8           HB       VAL   8  -4.068  -6.083  -2.600
   58   1HG1  VAL   8          11HG      VAL   8  -5.640  -8.539  -1.877
   59   2HG1  VAL   8          12HG      VAL   8  -6.278  -6.918  -2.169
   60   3HG1  VAL   8          13HG      VAL   8  -5.236  -7.217  -0.777
   61   1HG2  VAL   8          21HG      VAL   8  -3.086  -8.897  -2.216
   62   2HG2  VAL   8          22HG      VAL   8  -2.846  -7.562  -1.077
   63   3HG2  VAL   8          23HG      VAL   8  -2.136  -7.490  -2.697
   64    H    GLU   9           H        GLU   9  -6.484  -8.133  -5.523
   65    HA   GLU   9           HA       GLU   9  -7.216  -5.353  -5.831
   66   1HB   GLU   9          1HB       GLU   9  -7.312  -6.835  -7.855
   67   2HB   GLU   9          2HB       GLU   9  -8.586  -7.754  -7.060
   68   1HG   GLU   9          1HG       GLU   9 -10.025  -5.797  -7.021
   69   2HG   GLU   9          2HG       GLU   9  -8.729  -4.831  -7.730
   70    H    LEU  10           H        LEU  10  -8.188  -4.559  -4.233
   71    HA   LEU  10           HA       LEU  10  -9.715  -6.202  -2.376
   72   1HB   LEU  10          1HB       LEU  10  -7.841  -4.300  -2.064
   73   2HB   LEU  10          2HB       LEU  10  -9.260  -3.283  -2.105
   74    HG   LEU  10           HG       LEU  10  -8.673  -3.638   0.161
   75   1HD1  LEU  10          11HD      LEU  10 -11.060  -3.690  -0.277
   76   2HD1  LEU  10          12HD      LEU  10 -10.619  -4.681   1.111
   77   3HD1  LEU  10          13HD      LEU  10 -10.983  -5.436  -0.436
   78   1HD2  LEU  10          21HD      LEU  10  -8.459  -5.848   1.170
   79   2HD2  LEU  10          22HD      LEU  10  -7.267  -5.584  -0.101
   80   3HD2  LEU  10          23HD      LEU  10  -8.684  -6.591  -0.413
   81    H    GLU  11           H        GLU  11 -11.948  -5.797  -2.139
   82    HA   GLU  11           HA       GLU  11 -13.030  -3.778  -3.945
   83   1HB   GLU  11          1HB       GLU  11 -13.746  -6.059  -4.513
   84   2HB   GLU  11          2HB       GLU  11 -14.384  -6.266  -2.888
   85   1HG   GLU  11          1HG       GLU  11 -15.997  -4.491  -3.289
   86   2HG   GLU  11          2HG       GLU  11 -15.347  -4.263  -4.909
   87    H    LYS  12           H        LYS  12 -12.833  -2.111  -2.575
   88    HA   LYS  12           HA       LYS  12 -13.915  -2.242   0.075
   89   1HB   LYS  12          1HB       LYS  12 -12.319  -0.248  -1.425
   90   2HB   LYS  12          2HB       LYS  12 -13.210   0.320  -0.034
   91   1HG   LYS  12          1HG       LYS  12 -11.070  -1.803  -0.152
   92   2HG   LYS  12          2HG       LYS  12 -10.939  -0.207   0.587
   93   1HD   LYS  12          1HD       LYS  12 -13.165  -1.497   1.733
   94   2HD   LYS  12          2HD       LYS  12 -11.833  -2.668   1.763
   95   1HE   LYS  12          1HE       LYS  12 -11.687  -1.522   3.800
   96   2HE   LYS  12          2HE       LYS  12 -10.480  -0.782   2.806
   97   1HZ   LYS  12          1HZ       LYS  12 -13.170   0.389   3.368
   98   2HZ   LYS  12          2HZ       LYS  12 -12.199   0.991   2.194
   99   3HZ   LYS  12          3HZ       LYS  12 -11.699   1.048   3.792
  100    H    ASP  13           H        ASP  13 -14.909  -0.021   0.712
  101    HA   ASP  13           HA       ASP  13 -17.591  -0.038  -0.238
  102   1HB   ASP  13          1HB       ASP  13 -16.867   0.236   2.151
  103   2HB   ASP  13          2HB       ASP  13 -16.171   1.795   1.687
  104    H    GLU  14           H        GLU  14 -18.377   2.370  -0.171
  105    HA   GLU  14           HA       GLU  14 -17.501   3.475  -2.706
  106   1HB   GLU  14          1HB       GLU  14 -19.540   4.859  -2.542
  107   2HB   GLU  14          2HB       GLU  14 -19.891   3.147  -2.358
  108   1HG   GLU  14          1HG       GLU  14 -19.860   3.517   0.126
  109   2HG   GLU  14          2HG       GLU  14 -19.768   5.240  -0.214
  110    H    ASP  15           H        ASP  15 -17.235   4.115   0.649
  111    HA   ASP  15           HA       ASP  15 -16.416   6.843   0.458
  112   1HB   ASP  15          1HB       ASP  15 -16.994   5.847   2.648
  113   2HB   ASP  15          2HB       ASP  15 -15.611   4.764   2.517
  114    H    GLY  16           H        GLY  16 -14.699   3.767   0.454
  115   1HA   GLY  16          1HA       GLY  16 -12.826   3.873  -1.248
  116   2HA   GLY  16          2HA       GLY  16 -12.254   5.207  -0.256
  117    H    LEU  17           H        LEU  17 -10.622   4.577   0.981
  118    HA   LEU  17           HA       LEU  17 -10.551   1.751   1.796
  119   1HB   LEU  17          1HB       LEU  17  -8.212   3.585   2.034
  120   2HB   LEU  17          2HB       LEU  17  -8.252   1.848   1.904
  121    HG   LEU  17           HG       LEU  17  -8.714   3.832  -0.246
  122   1HD1  LEU  17          11HD      LEU  17  -6.414   3.592   0.311
  123   2HD1  LEU  17          12HD      LEU  17  -6.698   2.776  -1.230
  124   3HD1  LEU  17          13HD      LEU  17  -6.531   1.836   0.253
  125   1HD2  LEU  17          21HD      LEU  17  -8.900   1.957  -1.787
  126   2HD2  LEU  17          22HD      LEU  17 -10.192   1.928  -0.585
  127   3HD2  LEU  17          23HD      LEU  17  -8.823   0.822  -0.436
  128    H    GLY  18           H        GLY  18  -9.879   5.037   2.931
  129   1HA   GLY  18          1HA       GLY  18  -9.983   5.936   5.005
  130   2HA   GLY  18          2HA       GLY  18 -10.822   4.481   5.550
  131    H    ILE  19           H        ILE  19  -7.722   4.474   3.935
  132    HA   ILE  19           HA       ILE  19  -6.611   3.473   6.458
  133    HB   ILE  19           HB       ILE  19  -5.061   2.065   5.293
  134   1HG1  ILE  19          11HG      ILE  19  -6.099   3.216   2.698
  135   2HG1  ILE  19          12HG      ILE  19  -4.563   3.645   3.443
  136   1HG2  ILE  19          21HG      ILE  19  -7.727   1.846   3.906
  137   2HG2  ILE  19          22HG      ILE  19  -7.374   1.235   5.504
  138   3HG2  ILE  19          23HG      ILE  19  -6.547   0.545   4.094
  139   1HD1  ILE  19          11HD      ILE  19  -5.327   0.901   2.453
  140   2HD1  ILE  19          12HD      ILE  19  -3.793   1.335   3.203
  141   3HD1  ILE  19          13HD      ILE  19  -4.238   2.030   1.646
  142    H    SER  20           H        SER  20  -4.173   3.727   6.544
  143    HA   SER  20           HA       SER  20  -3.374   6.393   5.605
  144   1HB   SER  20          1HB       SER  20  -3.067   5.275   8.403
  145   2HB   SER  20          2HB       SER  20  -2.498   6.849   7.871
  146    HG   SER  20           HG       SER  20  -4.580   6.710   9.010
  147    H    ILE  21           H        ILE  21  -1.098   6.650   5.548
  148    HA   ILE  21           HA       ILE  21   0.450   4.140   5.442
  149    HB   ILE  21           HB       ILE  21   1.700   5.175   3.560
  150   1HG1  ILE  21          11HG      ILE  21   0.187   6.999   2.309
  151   2HG1  ILE  21          12HG      ILE  21  -0.341   7.300   3.948
  152   1HG2  ILE  21          21HG      ILE  21  -1.231   4.733   3.062
  153   2HG2  ILE  21          22HG      ILE  21   0.028   3.498   3.107
  154   3HG2  ILE  21          23HG      ILE  21   0.030   4.714   1.829
  155   1HD1  ILE  21          11HD      ILE  21   1.905   7.841   4.636
  156   2HD1  ILE  21          12HD      ILE  21   1.444   8.841   3.273
  157   3HD1  ILE  21          13HD      ILE  21   2.519   7.478   3.035
  158    H    ILE  22           H        ILE  22   2.838   4.645   5.531
  159    HA   ILE  22           HA       ILE  22   3.278   7.108   6.918
  160    HB   ILE  22           HB       ILE  22   3.061   5.523   8.687
  161   1HG1  ILE  22          11HG      ILE  22   5.999   6.142   8.308
  162   2HG1  ILE  22          12HG      ILE  22   4.805   7.234   8.996
  163   1HG2  ILE  22          21HG      ILE  22   3.482   3.472   7.492
  164   2HG2  ILE  22          22HG      ILE  22   4.485   3.553   8.944
  165   3HG2  ILE  22          23HG      ILE  22   5.196   3.887   7.361
  166   1HD1  ILE  22          11HD      ILE  22   4.487   5.678  10.870
  167   2HD1  ILE  22          12HD      ILE  22   6.165   6.208  10.734
  168   3HD1  ILE  22          13HD      ILE  22   5.698   4.605  10.168
  169    H    GLY  23           H        GLY  23   5.107   8.150   6.332
  170   1HA   GLY  23          1HA       GLY  23   6.676   6.834   4.291
  171   2HA   GLY  23          2HA       GLY  23   6.586   8.589   4.540
  172    H    MET  24           H        MET  24   8.213   5.763   5.024
  173    HA   MET  24           HA       MET  24  10.241   7.110   6.584
  174   1HB   MET  24          1HB       MET  24  10.395   5.193   8.206
  175   2HB   MET  24          2HB       MET  24   8.984   6.226   8.404
  176   1HG   MET  24          1HG       MET  24   7.611   4.595   7.270
  177   2HG   MET  24          2HG       MET  24   8.990   3.540   7.025
  178   1HE   MET  24          1HE       MET  24  10.479   3.951   9.924
  179   2HE   MET  24          2HE       MET  24  10.342   2.422   9.058
  180   3HE   MET  24          3HE       MET  24   9.843   2.526  10.746
  181    H    GLY  25           H        GLY  25  11.697   7.092   5.157
  182   1HA   GLY  25          1HA       GLY  25  12.191   5.251   3.164
  183   2HA   GLY  25          2HA       GLY  25  13.407   6.316   3.855
  184    H    VAL  26           H        VAL  26  12.560   3.214   3.351
  185    HA   VAL  26           HA       VAL  26  13.459   2.134   5.812
  186    HB   VAL  26           HB       VAL  26  11.703   0.967   4.635
  187   1HG1  VAL  26          11HG      VAL  26  13.682   0.465   2.423
  188   2HG1  VAL  26          12HG      VAL  26  12.246   1.486   2.339
  189   3HG1  VAL  26          13HG      VAL  26  12.076  -0.255   2.551
  190   1HG2  VAL  26          21HG      VAL  26  12.611  -1.322   4.644
  191   2HG2  VAL  26          22HG      VAL  26  13.108  -0.384   6.054
  192   3HG2  VAL  26          23HG      VAL  26  14.241  -0.654   4.729
  193    H    GLY  27           H        GLY  27  15.434   2.002   6.425
  194   1HA   GLY  27          1HA       GLY  27  17.647   1.939   4.597
  195   2HA   GLY  27          2HA       GLY  27  17.726   1.793   6.359
  196    H    ALA  28           H        ALA  28  16.793   0.122   3.482
  197    HA   ALA  28           HA       ALA  28  16.250  -2.412   4.482
  198   1HB   ALA  28          1HB       ALA  28  17.339  -1.768   1.763
  199   2HB   ALA  28          2HB       ALA  28  15.648  -1.646   2.252
  200   3HB   ALA  28          3HB       ALA  28  16.449  -3.218   2.231
  201    H    ASP  29           H        ASP  29  19.319  -0.952   3.965
  202    HA   ASP  29           HA       ASP  29  21.408  -1.529   4.652
  203   1HB   ASP  29          1HB       ASP  29  20.298  -2.726   6.515
  204   2HB   ASP  29          2HB       ASP  29  20.203  -4.162   5.519
  205    H    ALA  30           H        ALA  30  19.630  -3.803   2.830
  206    HA   ALA  30           HA       ALA  30  21.592  -5.337   1.609
  207   1HB   ALA  30          1HB       ALA  30  19.228  -5.848   1.520
  208   2HB   ALA  30          2HB       ALA  30  19.882  -5.741  -0.124
  209   3HB   ALA  30          3HB       ALA  30  18.951  -4.400   0.562
  210    H    GLY  31           H        GLY  31  20.447  -2.099   0.854
  211   1HA   GLY  31          1HA       GLY  31  22.203  -0.718  -0.225
  212   2HA   GLY  31          2HA       GLY  31  22.390  -2.047  -1.358
  213    H    LEU  32           H        LEU  32  19.425  -2.473  -1.413
  214    HA   LEU  32           HA       LEU  32  18.960  -0.764  -3.640
  215   1HB   LEU  32          1HB       LEU  32  17.060  -2.646  -2.205
  216   2HB   LEU  32          2HB       LEU  32  16.696  -1.817  -3.700
  217    HG   LEU  32           HG       LEU  32  18.642  -3.109  -4.725
  218   1HD1  LEU  32          11HD      LEU  32  19.759  -3.797  -2.691
  219   2HD1  LEU  32          12HD      LEU  32  19.286  -5.194  -3.656
  220   3HD1  LEU  32          13HD      LEU  32  18.355  -4.758  -2.221
  221   1HD2  LEU  32          21HD      LEU  32  17.285  -5.122  -5.060
  222   2HD2  LEU  32          22HD      LEU  32  16.323  -3.651  -5.189
  223   3HD2  LEU  32          23HD      LEU  32  16.243  -4.629  -3.725
  224    H    GLU  33           H        GLU  33  17.140  -1.253  -0.643
  225    HA   GLU  33           HA       GLU  33  16.033   0.082   0.709
  226   1HB   GLU  33          1HB       GLU  33  17.957   2.189  -0.288
  227   2HB   GLU  33          2HB       GLU  33  16.918   2.362   1.127
  228   1HG   GLU  33          1HG       GLU  33  18.020   0.494   2.203
  229   2HG   GLU  33          2HG       GLU  33  19.013   0.236   0.775
  230    H    LYS  34           H        LYS  34  14.347  -0.352  -0.515
  231    HA   LYS  34           HA       LYS  34  13.403   1.188  -2.703
  232   1HB   LYS  34          1HB       LYS  34  11.411  -0.229  -2.416
  233   2HB   LYS  34          2HB       LYS  34  12.899  -1.171  -2.421
  234   1HG   LYS  34          1HG       LYS  34  12.812  -1.134   0.103
  235   2HG   LYS  34          2HG       LYS  34  11.217  -0.418  -0.039
  236   1HD   LYS  34          1HD       LYS  34  12.057  -3.119  -1.089
  237   2HD   LYS  34          2HD       LYS  34  11.078  -2.819   0.344
  238   1HE   LYS  34          1HE       LYS  34   9.429  -1.676  -1.170
  239   2HE   LYS  34          2HE       LYS  34  10.365  -2.300  -2.529
  240   1HZ   LYS  34          1HZ       LYS  34   9.997  -4.556  -1.616
  241   2HZ   LYS  34          2HZ       LYS  34   8.584  -3.779  -2.069
  242   3HZ   LYS  34          3HZ       LYS  34   9.016  -3.868  -0.423
  243    H    LEU  35           H        LEU  35  10.849   1.737  -2.363
  244    HA   LEU  35           HA       LEU  35  10.482   4.047  -1.028
  245   1HB   LEU  35          1HB       LEU  35   8.122   3.588  -1.320
  246   2HB   LEU  35          2HB       LEU  35   9.037   3.088  -2.729
  247    HG   LEU  35           HG       LEU  35   8.959   0.776  -1.347
  248   1HD1  LEU  35          11HD      LEU  35   6.385   2.161  -0.708
  249   2HD1  LEU  35          12HD      LEU  35   7.611   1.536   0.407
  250   3HD1  LEU  35          13HD      LEU  35   6.671   0.427  -0.578
  251   1HD2  LEU  35          21HD      LEU  35   6.865   1.723  -3.291
  252   2HD2  LEU  35          22HD      LEU  35   7.247   0.043  -2.867
  253   3HD2  LEU  35          23HD      LEU  35   8.449   1.036  -3.676
  254    H    GLY  36           H        GLY  36   9.762   4.578   1.028
  255   1HA   GLY  36          1HA       GLY  36   9.790   2.378   2.955
  256   2HA   GLY  36          2HA       GLY  36  10.227   4.046   3.310
  257    H    ILE  37           H        ILE  37   7.498   3.106   1.375
  258    HA   ILE  37           HA       ILE  37   5.855   4.453   3.331
  259    HB   ILE  37           HB       ILE  37   5.062   3.517   0.565
  260   1HG1  ILE  37          11HG      ILE  37   6.794   5.349   0.706
  261   2HG1  ILE  37          12HG      ILE  37   5.325   5.818  -0.183
  262   1HG2  ILE  37          21HG      ILE  37   3.170   3.625   2.086
  263   2HG2  ILE  37          22HG      ILE  37   3.068   4.970   0.946
  264   3HG2  ILE  37          23HG      ILE  37   3.640   5.240   2.596
  265   1HD1  ILE  37          11HD      ILE  37   6.055   7.639   1.195
  266   2HD1  ILE  37          12HD      ILE  37   6.293   6.548   2.541
  267   3HD1  ILE  37          13HD      ILE  37   4.652   6.932   2.015
  268    H    PHE  38           H        PHE  38   5.397   3.183   4.858
  269    HA   PHE  38           HA       PHE  38   4.459   0.462   4.322
  270   1HB   PHE  38          1HB       PHE  38   5.159   1.879   6.885
  271   2HB   PHE  38          2HB       PHE  38   4.578   0.225   6.814
  272    HD1  PHE  38           HD1      PHE  38   7.400   2.441   6.263
  273    HD2  PHE  38           HD2      PHE  38   5.996  -1.552   5.972
  274    HE1  PHE  38           HE1      PHE  38   9.709   1.681   6.030
  275    HE2  PHE  38           HE2      PHE  38   8.291  -2.364   5.739
  276    HZ   PHE  38           HZ       PHE  38  10.183  -0.751   5.766
  277    H    VAL  39           H        VAL  39   2.539  -0.201   5.598
  278    HA   VAL  39           HA       VAL  39   0.530   1.822   5.311
  279    HB   VAL  39           HB       VAL  39   0.275  -1.003   6.419
  280   1HG1  VAL  39          11HG      VAL  39  -1.820   0.901   5.374
  281   2HG1  VAL  39          12HG      VAL  39  -1.584   0.440   7.061
  282   3HG1  VAL  39          13HG      VAL  39  -2.111  -0.762   5.881
  283   1HG2  VAL  39          21HG      VAL  39  -0.546  -1.633   4.185
  284   2HG2  VAL  39          22HG      VAL  39   1.118  -1.044   4.126
  285   3HG2  VAL  39          23HG      VAL  39  -0.198  -0.002   3.607
  286    H    LYS  40           H        LYS  40  -0.279   2.979   6.925
  287    HA   LYS  40           HA       LYS  40   1.093   2.781   9.483
  288   1HB   LYS  40          1HB       LYS  40   1.092   4.974   8.511
  289   2HB   LYS  40          2HB       LYS  40  -0.629   4.914   8.252
  290   1HG   LYS  40          1HG       LYS  40  -0.319   6.409  10.027
  291   2HG   LYS  40          2HG       LYS  40  -0.899   4.932  10.763
  292   1HD   LYS  40          1HD       LYS  40   2.017   5.725  10.674
  293   2HD   LYS  40          2HD       LYS  40   0.937   6.158  11.988
  294   1HE   LYS  40          1HE       LYS  40   0.536   3.685  12.313
  295   2HE   LYS  40          2HE       LYS  40   1.825   3.412  11.140
  296   1HZ   LYS  40          1HZ       LYS  40   3.325   4.682  12.573
  297   2HZ   LYS  40          2HZ       LYS  40   2.747   3.325  13.352
  298   3HZ   LYS  40          3HZ       LYS  40   2.110   4.843  13.717
  299    H    THR  41           H        THR  41  -2.173   2.990   8.140
  300    HA   THR  41           HA       THR  41  -3.213   1.535  10.415
  301    HB   THR  41           HB       THR  41  -4.647   3.926   9.540
  302    HG1  THR  41           HG1      THR  41  -3.477   5.239  11.133
  303   1HG2  THR  41          21HG      THR  41  -5.398   3.971  11.905
  304   2HG2  THR  41          22HG      THR  41  -4.364   2.573  12.214
  305   3HG2  THR  41          23HG      THR  41  -5.716   2.441  11.085
  306    H    VAL  42           H        VAL  42  -5.396   0.909   9.883
  307    HA   VAL  42           HA       VAL  42  -6.184   1.263   7.133
  308    HB   VAL  42           HB       VAL  42  -6.314  -1.386   8.671
  309   1HG1  VAL  42          11HG      VAL  42  -7.182  -0.690   5.889
  310   2HG1  VAL  42          12HG      VAL  42  -8.229  -1.161   7.230
  311   3HG1  VAL  42          13HG      VAL  42  -7.109  -2.333   6.508
  312   1HG2  VAL  42          21HG      VAL  42  -4.659  -0.684   6.249
  313   2HG2  VAL  42          22HG      VAL  42  -4.788  -2.283   6.978
  314   3HG2  VAL  42          23HG      VAL  42  -4.049  -0.959   7.880
  315    H    THR  43           H        THR  43  -8.609   1.014   7.051
  316    HA   THR  43           HA       THR  43  -9.973   2.129   9.191
  317    HB   THR  43           HB       THR  43 -10.941   2.104   6.884
  318    HG1  THR  43           HG1      THR  43 -12.536   2.390   8.257
  319   1HG2  THR  43          21HG      THR  43 -11.315  -0.834   7.375
  320   2HG2  THR  43          22HG      THR  43 -10.172  -0.133   6.225
  321   3HG2  THR  43          23HG      THR  43 -11.915   0.054   5.969
  322    H    GLU  44           H        GLU  44 -11.541   1.033  10.597
  323    HA   GLU  44           HA       GLU  44 -10.461  -0.872  12.181
  324   1HB   GLU  44          1HB       GLU  44 -12.718  -1.108  13.118
  325   2HB   GLU  44          2HB       GLU  44 -12.166   0.548  12.981
  326   1HG   GLU  44          1HG       GLU  44 -13.480   0.807  10.962
  327   2HG   GLU  44          2HG       GLU  44 -14.044  -0.859  11.126
  328    H    GLY  45           H        GLY  45 -12.448  -1.365   9.392
  329   1HA   GLY  45          1HA       GLY  45 -11.512  -4.054   9.226
  330   2HA   GLY  45          2HA       GLY  45 -13.232  -3.969   9.581
  331    H    GLY  46           H        GLY  46 -14.171  -2.096   8.185
  332   1HA   GLY  46          1HA       GLY  46 -15.379  -2.040   6.299
  333   2HA   GLY  46          2HA       GLY  46 -13.798  -1.667   5.615
  334    H    ALA  47           H        ALA  47 -13.219  -2.791   4.279
  335    HA   ALA  47           HA       ALA  47 -13.849  -5.676   4.069
  336   1HB   ALA  47          1HB       ALA  47 -13.660  -3.755   1.743
  337   2HB   ALA  47          2HB       ALA  47 -15.141  -4.509   2.354
  338   3HB   ALA  47          3HB       ALA  47 -13.881  -5.497   1.621
  339    H    ALA  48           H        ALA  48 -11.543  -3.706   4.843
  340    HA   ALA  48           HA       ALA  48  -9.451  -4.747   3.045
  341   1HB   ALA  48          1HB       ALA  48  -7.972  -3.070   4.068
  342   2HB   ALA  48          2HB       ALA  48  -9.299  -2.538   5.102
  343   3HB   ALA  48          3HB       ALA  48  -9.405  -2.346   3.348
  344    H    GLN  49           H        GLN  49  -9.953  -4.186   6.573
  345    HA   GLN  49           HA       GLN  49  -7.995  -6.237   7.047
  346   1HB   GLN  49          1HB       GLN  49  -9.615  -4.460   8.792
  347   2HB   GLN  49          2HB       GLN  49  -8.709  -5.810   9.506
  348   1HG   GLN  49          1HG       GLN  49  -6.678  -4.831   8.376
  349   2HG   GLN  49          2HG       GLN  49  -7.710  -3.460   7.958
  350   1HE2  GLN  49          21HE      GLN  49  -9.156  -3.367  10.399
  351   2HE2  GLN  49          22HE      GLN  49  -8.080  -2.843  11.623
  352    H    ARG  50           H        ARG  50 -11.232  -6.031   6.464
  353    HA   ARG  50           HA       ARG  50 -11.758  -8.602   7.619
  354   1HB   ARG  50          1HB       ARG  50 -13.459  -6.696   6.092
  355   2HB   ARG  50          2HB       ARG  50 -14.025  -8.293   6.570
  356   1HG   ARG  50          1HG       ARG  50 -13.021  -6.184   8.444
  357   2HG   ARG  50          2HG       ARG  50 -14.743  -6.471   8.149
  358   1HD   ARG  50          1HD       ARG  50 -14.273  -7.602  10.165
  359   2HD   ARG  50          2HD       ARG  50 -14.214  -8.880   8.959
  360    HE   ARG  50           HE       ARG  50 -11.691  -7.604   9.597
  361   1HH1  ARG  50          11HH      ARG  50 -13.792 -10.384  10.279
  362   2HH1  ARG  50          12HH      ARG  50 -12.559 -11.298  10.999
  363   1HH2  ARG  50          21HH      ARG  50  -9.992  -8.906  10.594
  364   2HH2  ARG  50          22HH      ARG  50 -10.383 -10.455  11.166
  365    H    ASP  51           H        ASP  51 -10.524  -7.336   4.703
  366    HA   ASP  51           HA       ASP  51 -11.288  -9.478   2.965
  367   1HB   ASP  51          1HB       ASP  51 -10.303  -7.437   2.002
  368   2HB   ASP  51          2HB       ASP  51  -8.792  -7.738   2.850
  369    H    GLY  52           H        GLY  52  -8.144  -8.834   4.433
  370   1HA   GLY  52          1HA       GLY  52  -7.285 -10.486   6.010
  371   2HA   GLY  52          2HA       GLY  52  -7.964 -11.724   4.966
  372    H    ARG  53           H        ARG  53  -6.903 -10.175   2.537
  373    HA   ARG  53           HA       ARG  53  -4.374 -11.557   2.600
  374   1HB   ARG  53          1HB       ARG  53  -6.112 -11.150   0.590
  375   2HB   ARG  53          2HB       ARG  53  -5.098  -9.747   0.329
  376   1HG   ARG  53          1HG       ARG  53  -4.184 -12.635   0.303
  377   2HG   ARG  53          2HG       ARG  53  -4.435 -11.605  -1.100
  378   1HD   ARG  53          1HD       ARG  53  -2.615 -10.163  -0.383
  379   2HD   ARG  53          2HD       ARG  53  -2.411 -11.125   1.077
  380    HE   ARG  53           HE       ARG  53  -2.142 -12.510  -1.463
  381   1HH1  ARG  53          11HH      ARG  53  -0.499 -11.040   1.319
  382   2HH1  ARG  53          12HH      ARG  53   1.004 -11.752   0.982
  383   1HH2  ARG  53          21HH      ARG  53  -0.047 -13.455  -1.935
  384   2HH2  ARG  53          22HH      ARG  53   1.308 -13.128  -0.966
  385    H    ILE  54           H        ILE  54  -5.514  -8.247   2.722
  386    HA   ILE  54           HA       ILE  54  -2.771  -7.254   2.647
  387    HB   ILE  54           HB       ILE  54  -4.687  -6.088   1.377
  388   1HG1  ILE  54          11HG      ILE  54  -3.194  -4.367   3.379
  389   2HG1  ILE  54          12HG      ILE  54  -2.483  -5.009   1.904
  390   1HG2  ILE  54          21HG      ILE  54  -6.058  -4.507   2.757
  391   2HG2  ILE  54          22HG      ILE  54  -5.387  -5.316   4.196
  392   3HG2  ILE  54          23HG      ILE  54  -6.399  -6.217   3.074
  393   1HD1  ILE  54          11HD      ILE  54  -4.067  -3.735   0.577
  394   2HD1  ILE  54          12HD      ILE  54  -3.135  -2.684   1.635
  395   3HD1  ILE  54          13HD      ILE  54  -4.810  -3.102   2.047
  396    H    GLN  55           H        GLN  55  -1.851  -6.084   4.403
  397    HA   GLN  55           HA       GLN  55  -3.319  -6.301   6.898
  398   1HB   GLN  55          1HB       GLN  55  -0.427  -6.868   6.355
  399   2HB   GLN  55          2HB       GLN  55  -1.074  -6.715   7.976
  400   1HG   GLN  55          1HG       GLN  55  -2.473  -8.655   7.629
  401   2HG   GLN  55          2HG       GLN  55  -1.948  -8.766   5.949
  402   1HE2  GLN  55          21HE      GLN  55   0.845  -8.151   6.485
  403   2HE2  GLN  55          22HE      GLN  55   1.500  -9.510   7.295
  404    H    VAL  56           H        VAL  56  -2.337  -4.845   8.606
  405    HA   VAL  56           HA       VAL  56  -1.878  -2.178   7.555
  406    HB   VAL  56           HB       VAL  56  -3.314  -2.725   9.593
  407   1HG1  VAL  56          11HG      VAL  56  -2.000  -4.299  10.742
  408   2HG1  VAL  56          12HG      VAL  56  -2.171  -2.881  11.785
  409   3HG1  VAL  56          13HG      VAL  56  -0.668  -3.158  10.910
  410   1HG2  VAL  56          21HG      VAL  56  -2.649  -0.397   9.161
  411   2HG2  VAL  56          22HG      VAL  56  -1.139  -0.673  10.012
  412   3HG2  VAL  56          23HG      VAL  56  -2.665  -0.734  10.886
  413    H    ASN  57           H        ASN  57   0.060  -4.784   8.238
  414    HA   ASN  57           HA       ASN  57   2.311  -3.066   9.021
  415   1HB   ASN  57          1HB       ASN  57   3.413  -5.008   9.934
  416   2HB   ASN  57          2HB       ASN  57   1.753  -4.901  10.541
  417   1HD2  ASN  57          21HD      ASN  57   0.302  -6.555  10.080
  418   2HD2  ASN  57          22HD      ASN  57   0.792  -7.989   9.266
  419    H    ASP  58           H        ASP  58   1.076  -3.840   6.347
  420    HA   ASP  58           HA       ASP  58   3.410  -4.982   5.027
  421   1HB   ASP  58          1HB       ASP  58   0.661  -4.314   3.934
  422   2HB   ASP  58          2HB       ASP  58   1.987  -4.911   2.955
  423    H    GLN  59           H        GLN  59   3.432  -3.858   2.624
  424    HA   GLN  59           HA       GLN  59   3.901  -1.024   3.078
  425   1HB   GLN  59          1HB       GLN  59   6.018  -2.006   3.475
  426   2HB   GLN  59          2HB       GLN  59   5.844  -3.090   2.102
  427   1HG   GLN  59          1HG       GLN  59   6.086  -1.290   0.579
  428   2HG   GLN  59          2HG       GLN  59   6.075  -0.115   1.892
  429   1HE2  GLN  59          21HE      GLN  59   7.860   0.182   3.074
  430   2HE2  GLN  59          22HE      GLN  59   9.404  -0.466   2.637
  431    H    ILE  60           H        ILE  60   3.172   0.189   1.442
  432    HA   ILE  60           HA       ILE  60   1.735  -1.031  -0.731
  433    HB   ILE  60           HB       ILE  60   2.390   1.898  -0.298
  434   1HG1  ILE  60          11HG      ILE  60   1.136   1.068   1.647
  435   2HG1  ILE  60          12HG      ILE  60   0.128   2.107   0.641
  436   1HG2  ILE  60          21HG      ILE  60   0.217   0.612  -1.915
  437   2HG2  ILE  60          22HG      ILE  60   1.712   1.250  -2.565
  438   3HG2  ILE  60          23HG      ILE  60   0.544   2.348  -1.801
  439   1HD1  ILE  60          11HD      ILE  60  -1.126   0.201   1.457
  440   2HD1  ILE  60          12HD      ILE  60   0.043  -0.896   0.729
  441   3HD1  ILE  60          13HD      ILE  60  -0.961   0.128  -0.302
  442    H    VAL  61           H        VAL  61   2.804  -1.726  -2.539
  443    HA   VAL  61           HA       VAL  61   5.342  -0.467  -3.245
  444    HB   VAL  61           HB       VAL  61   4.002  -2.995  -4.249
  445   1HG1  VAL  61          11HG      VAL  61   5.250  -1.987  -6.089
  446   2HG1  VAL  61          12HG      VAL  61   5.953  -3.499  -5.534
  447   3HG1  VAL  61          13HG      VAL  61   6.710  -1.960  -5.084
  448   1HG2  VAL  61          21HG      VAL  61   4.924  -3.175  -2.046
  449   2HG2  VAL  61          22HG      VAL  61   6.490  -2.576  -2.612
  450   3HG2  VAL  61          23HG      VAL  61   5.863  -4.127  -3.189
  451    H    GLU  62           H        GLU  62   2.293  -1.329  -4.749
  452    HA   GLU  62           HA       GLU  62   2.340   1.107  -6.279
  453   1HB   GLU  62          1HB       GLU  62   3.466  -0.206  -7.875
  454   2HB   GLU  62          2HB       GLU  62   2.474  -1.619  -7.572
  455   1HG   GLU  62          1HG       GLU  62   0.598  -0.618  -8.617
  456   2HG   GLU  62          2HG       GLU  62   1.410   0.931  -8.736
  457    H    VAL  63           H        VAL  63   0.392   1.948  -6.223
  458    HA   VAL  63           HA       VAL  63  -1.879   0.126  -6.026
  459    HB   VAL  63           HB       VAL  63  -1.362   2.777  -4.638
  460   1HG1  VAL  63          11HG      VAL  63  -3.750   2.965  -4.167
  461   2HG1  VAL  63          12HG      VAL  63  -4.073   1.602  -5.259
  462   3HG1  VAL  63          13HG      VAL  63  -3.389   3.109  -5.891
  463   1HG2  VAL  63          21HG      VAL  63  -0.973   0.629  -3.526
  464   2HG2  VAL  63          22HG      VAL  63  -2.663   0.208  -3.798
  465   3HG2  VAL  63          23HG      VAL  63  -2.251   1.582  -2.768
  466    H    ASP  64           H        ASP  64  -3.262   0.191  -7.567
  467    HA   ASP  64           HA       ASP  64  -4.475   0.770  -9.404
  468   1HB   ASP  64          1HB       ASP  64  -4.972   2.760  -7.873
  469   2HB   ASP  64          2HB       ASP  64  -3.773   3.658  -8.791
  470    H    GLY  65           H        GLY  65  -1.450   0.558  -9.478
  471   1HA   GLY  65          1HA       GLY  65   0.045   0.337 -11.225
  472   2HA   GLY  65          2HA       GLY  65  -1.146   1.068 -12.298
  473    H    ILE  66           H        ILE  66  -0.480   2.837  -9.431
  474    HA   ILE  66           HA       ILE  66   0.548   4.969 -11.021
  475    HB   ILE  66           HB       ILE  66  -1.044   4.999  -8.836
  476   1HG1  ILE  66          11HG      ILE  66   1.022   7.135  -9.426
  477   2HG1  ILE  66          12HG      ILE  66  -0.454   6.878 -10.357
  478   1HG2  ILE  66          21HG      ILE  66   0.610   4.100  -7.316
  479   2HG2  ILE  66          22HG      ILE  66   0.194   5.760  -6.870
  480   3HG2  ILE  66          23HG      ILE  66   1.715   5.421  -7.699
  481   1HD1  ILE  66          11HD      ILE  66  -0.714   8.721  -8.823
  482   2HD1  ILE  66          12HD      ILE  66  -0.255   7.661  -7.488
  483   3HD1  ILE  66          13HD      ILE  66  -1.766   7.371  -8.358
  484    H    SER  67           H        SER  67   2.010   2.426  -9.387
  485    HA   SER  67           HA       SER  67   3.926   2.116  -8.206
  486   1HB   SER  67          1HB       SER  67   5.913   2.555  -9.978
  487   2HB   SER  67          2HB       SER  67   4.763   1.216 -10.089
  488    HG   SER  67           HG       SER  67   3.769   2.102 -11.629
  489    H    LEU  68           H        LEU  68   3.818   3.354  -6.522
  490    HA   LEU  68           HA       LEU  68   5.085   5.890  -6.623
  491   1HB   LEU  68          1HB       LEU  68   4.072   6.236  -4.408
  492   2HB   LEU  68          2HB       LEU  68   2.937   5.819  -5.654
  493    HG   LEU  68           HG       LEU  68   2.141   4.869  -3.744
  494   1HD1  LEU  68          11HD      LEU  68   1.869   2.629  -3.990
  495   2HD1  LEU  68          12HD      LEU  68   3.309   2.471  -4.944
  496   3HD1  LEU  68          13HD      LEU  68   1.913   3.390  -5.580
  497   1HD2  LEU  68          21HD      LEU  68   4.817   3.678  -3.084
  498   2HD2  LEU  68          22HD      LEU  68   3.327   3.362  -2.192
  499   3HD2  LEU  68          23HD      LEU  68   3.999   4.993  -2.240
  500    H    VAL  69           H        VAL  69   6.780   3.807  -6.992
  501    HA   VAL  69           HA       VAL  69   8.074   2.912  -4.622
  502    HB   VAL  69           HB       VAL  69   9.139   2.865  -7.450
  503   1HG1  VAL  69          11HG      VAL  69  10.899   2.513  -5.805
  504   2HG1  VAL  69          12HG      VAL  69  10.576   1.027  -6.693
  505   3HG1  VAL  69          13HG      VAL  69   9.968   1.219  -5.049
  506   1HG2  VAL  69          21HG      VAL  69   7.575   0.757  -5.954
  507   2HG2  VAL  69          22HG      VAL  69   8.303   0.550  -7.545
  508   3HG2  VAL  69          23HG      VAL  69   6.998   1.713  -7.317
  509    H    GLY  70           H        GLY  70   8.600   4.703  -3.473
  510   1HA   GLY  70          1HA       GLY  70  10.698   5.710  -2.730
  511   2HA   GLY  70          2HA       GLY  70  11.038   6.074  -4.419
  512    H    VAL  71           H        VAL  71   7.952   6.509  -2.895
  513    HA   VAL  71           HA       VAL  71   8.278   9.389  -3.407
  514    HB   VAL  71           HB       VAL  71   5.858   9.639  -3.449
  515   1HG1  VAL  71          11HG      VAL  71   6.938   9.077  -5.525
  516   2HG1  VAL  71          12HG      VAL  71   5.334   8.348  -5.446
  517   3HG1  VAL  71          13HG      VAL  71   6.767   7.356  -5.179
  518   1HG2  VAL  71          21HG      VAL  71   4.342   7.770  -3.215
  519   2HG2  VAL  71          22HG      VAL  71   5.327   7.925  -1.762
  520   3HG2  VAL  71          23HG      VAL  71   5.692   6.664  -2.943
  521    H    THR  72           H        THR  72   6.740  10.745  -1.911
  522    HA   THR  72           HA       THR  72   7.595  10.143   0.785
  523    HB   THR  72           HB       THR  72   6.655  12.405   1.276
  524    HG1  THR  72           HG1      THR  72   6.621  13.171  -1.352
  525   1HG2  THR  72          21HG      THR  72   8.454  13.643   0.133
  526   2HG2  THR  72          22HG      THR  72   8.737  12.228  -0.902
  527   3HG2  THR  72          23HG      THR  72   8.979  12.121   0.851
  528    H    GLN  73           H        GLN  73   5.930  10.887   2.406
  529    HA   GLN  73           HA       GLN  73   3.741   9.125   2.147
  530   1HB   GLN  73          1HB       GLN  73   3.387   9.376   4.404
  531   2HB   GLN  73          2HB       GLN  73   4.974  10.099   4.308
  532   1HG   GLN  73          1HG       GLN  73   2.424  11.659   4.260
  533   2HG   GLN  73          2HG       GLN  73   3.318  11.310   5.733
  534   1HE2  GLN  73          21HE      GLN  73   5.916  11.642   4.396
  535   2HE2  GLN  73          22HE      GLN  73   6.091  13.322   4.133
  536    H    ASN  74           H        ASN  74   4.157  12.432   1.387
  537    HA   ASN  74           HA       ASN  74   1.444  13.276   1.422
  538   1HB   ASN  74          1HB       ASN  74   3.485  14.270  -0.579
  539   2HB   ASN  74          2HB       ASN  74   2.078  15.125   0.025
  540   1HD2  ASN  74          21HD      ASN  74   5.317  14.269   0.500
  541   2HD2  ASN  74          22HD      ASN  74   5.631  15.215   1.907
  542    H    PHE  75           H        PHE  75   3.555  11.989  -1.059
  543    HA   PHE  75           HA       PHE  75   1.709  12.062  -3.141
  544   1HB   PHE  75          1HB       PHE  75   4.211  11.795  -3.382
  545   2HB   PHE  75          2HB       PHE  75   4.000  10.138  -2.841
  546    HD1  PHE  75           HD1      PHE  75   2.647   8.533  -4.264
  547    HD2  PHE  75           HD2      PHE  75   3.816  12.394  -5.634
  548    HE1  PHE  75           HE1      PHE  75   2.234   7.829  -6.544
  549    HE2  PHE  75           HE2      PHE  75   3.396  11.688  -7.952
  550    HZ   PHE  75           HZ       PHE  75   2.606   9.405  -8.421
  551    H    ALA  76           H        ALA  76   2.821   9.469  -1.015
  552    HA   ALA  76           HA       ALA  76   1.200   7.451  -2.053
  553   1HB   ALA  76          1HB       ALA  76   2.310   7.646   0.732
  554   2HB   ALA  76          2HB       ALA  76   3.154   7.018  -0.692
  555   3HB   ALA  76          3HB       ALA  76   1.722   6.188  -0.075
  556    H    ALA  77           H        ALA  77   0.574   9.617   0.744
  557    HA   ALA  77           HA       ALA  77  -1.861   8.456   1.509
  558   1HB   ALA  77          1HB       ALA  77  -0.658  10.085   2.909
  559   2HB   ALA  77          2HB       ALA  77  -2.331  10.581   2.643
  560   3HB   ALA  77          3HB       ALA  77  -1.028  11.354   1.741
  561    H    THR  78           H        THR  78  -1.048  10.774  -0.930
  562    HA   THR  78           HA       THR  78  -3.656  11.519  -1.657
  563    HB   THR  78           HB       THR  78  -1.059  11.520  -3.211
  564    HG1  THR  78           HG1      THR  78  -1.019  12.882  -1.490
  565   1HG2  THR  78          21HG      THR  78  -2.946  11.497  -4.755
  566   2HG2  THR  78          22HG      THR  78  -2.179  13.092  -4.761
  567   3HG2  THR  78          23HG      THR  78  -3.699  12.834  -3.895
  568    H    VAL  79           H        VAL  79  -1.480   8.995  -2.852
  569    HA   VAL  79           HA       VAL  79  -3.129   8.006  -4.906
  570    HB   VAL  79           HB       VAL  79  -1.182   6.346  -3.257
  571   1HG1  VAL  79          11HG      VAL  79  -2.204   5.975  -6.055
  572   2HG1  VAL  79          12HG      VAL  79  -2.677   5.048  -4.635
  573   3HG1  VAL  79          13HG      VAL  79  -1.017   4.960  -5.228
  574   1HG2  VAL  79          21HG      VAL  79  -0.035   8.289  -4.061
  575   2HG2  VAL  79          22HG      VAL  79  -0.727   8.085  -5.654
  576   3HG2  VAL  79          23HG      VAL  79   0.450   6.905  -5.045
  577    H    LEU  80           H        LEU  80  -2.740   6.839  -1.581
  578    HA   LEU  80           HA       LEU  80  -4.849   4.933  -1.760
  579   1HB   LEU  80          1HB       LEU  80  -3.369   6.070   0.613
  580   2HB   LEU  80          2HB       LEU  80  -4.651   4.900   0.795
  581    HG   LEU  80           HG       LEU  80  -2.611   3.717   0.982
  582   1HD1  LEU  80          11HD      LEU  80  -2.711   2.101  -0.757
  583   2HD1  LEU  80          12HD      LEU  80  -3.573   3.227  -1.797
  584   3HD1  LEU  80          13HD      LEU  80  -4.343   2.631  -0.327
  585   1HD2  LEU  80          21HD      LEU  80  -1.730   4.908  -1.640
  586   2HD2  LEU  80          22HD      LEU  80  -0.847   3.700  -0.706
  587   3HD2  LEU  80          23HD      LEU  80  -1.088   5.321  -0.052
  588    H    ARG  81           H        ARG  81  -5.051   8.135  -1.729
  589    HA   ARG  81           HA       ARG  81  -7.642   8.413  -0.330
  590   1HB   ARG  81          1HB       ARG  81  -5.968  10.116  -0.014
  591   2HB   ARG  81          2HB       ARG  81  -5.811  10.312  -1.746
  592   1HG   ARG  81          1HG       ARG  81  -8.306  10.953  -1.663
  593   2HG   ARG  81          2HG       ARG  81  -8.001  11.212   0.064
  594   1HD   ARG  81          1HD       ARG  81  -6.512  12.332  -2.229
  595   2HD   ARG  81          2HD       ARG  81  -7.631  13.256  -1.203
  596    HE   ARG  81           HE       ARG  81  -5.830  12.256   0.570
  597   1HH1  ARG  81          11HH      ARG  81  -5.450  14.347  -2.273
  598   2HH1  ARG  81          12HH      ARG  81  -3.913  14.910  -1.839
  599   1HH2  ARG  81          21HH      ARG  81  -3.770  13.071   1.209
  600   2HH2  ARG  81          22HH      ARG  81  -2.926  14.184   0.227
  601    H    ASN  82           H        ASN  82  -6.072   8.518  -3.447
  602    HA   ASN  82           HA       ASN  82  -8.318   9.484  -4.920
  603   1HB   ASN  82          1HB       ASN  82  -5.583   8.509  -5.707
  604   2HB   ASN  82          2HB       ASN  82  -6.835   8.750  -6.901
  605   1HD2  ASN  82          21HD      ASN  82  -6.287  10.778  -4.100
  606   2HD2  ASN  82          22HD      ASN  82  -5.895  12.190  -5.017
  607    H    THR  83           H        THR  83  -7.534   6.480  -3.715
  608    HA   THR  83           HA       THR  83  -8.299   4.796  -5.814
  609    HB   THR  83           HB       THR  83  -8.454   3.196  -3.808
  610    HG1  THR  83           HG1      THR  83  -8.681   4.784  -2.215
  611   1HG2  THR  83          21HG      THR  83  -5.911   4.707  -4.420
  612   2HG2  THR  83          22HG      THR  83  -6.543   3.350  -5.349
  613   3HG2  THR  83          23HG      THR  83  -6.006   3.109  -3.687
  614    H    LYS  84           H        LYS  84 -10.074   3.312  -5.700
  615    HA   LYS  84           HA       LYS  84 -12.523   4.441  -4.573
  616   1HB   LYS  84          1HB       LYS  84 -11.995   3.079  -7.215
  617   2HB   LYS  84          2HB       LYS  84 -13.617   3.252  -6.569
  618   1HG   LYS  84          1HG       LYS  84 -11.754   5.539  -7.155
  619   2HG   LYS  84          2HG       LYS  84 -13.043   4.977  -8.225
  620   1HD   LYS  84          1HD       LYS  84 -14.672   5.393  -6.426
  621   2HD   LYS  84          2HD       LYS  84 -13.369   6.016  -5.426
  622   1HE   LYS  84          1HE       LYS  84 -12.935   7.805  -6.979
  623   2HE   LYS  84          2HE       LYS  84 -14.139   7.172  -8.102
  624   1HZ   LYS  84          1HZ       LYS  84 -14.721   8.181  -5.366
  625   2HZ   LYS  84          2HZ       LYS  84 -15.854   7.630  -6.476
  626   3HZ   LYS  84          3HZ       LYS  84 -14.983   9.029  -6.796
  627    H    GLY  85           H        GLY  85 -14.131   2.243  -5.174
  628   1HA   GLY  85          1HA       GLY  85 -13.738   0.475  -3.098
  629   2HA   GLY  85          2HA       GLY  85 -14.733   0.170  -4.514
  630    H    ASN  86           H        ASN  86 -13.290  -0.369  -6.533
  631    HA   ASN  86           HA       ASN  86 -11.809  -2.709  -5.695
  632   1HB   ASN  86          1HB       ASN  86 -12.455  -1.684  -8.461
  633   2HB   ASN  86          2HB       ASN  86 -11.597  -3.186  -8.141
  634   1HD2  ASN  86          21HD      ASN  86 -12.769  -4.959  -7.282
  635   2HD2  ASN  86          22HD      ASN  86 -14.490  -4.986  -7.315
  636    H    VAL  87           H        VAL  87  -9.840  -2.485  -5.096
  637    HA   VAL  87           HA       VAL  87  -8.133  -0.483  -6.457
  638    HB   VAL  87           HB       VAL  87  -7.496  -1.567  -3.790
  639   1HG1  VAL  87          11HG      VAL  87  -6.894   1.054  -5.107
  640   2HG1  VAL  87          12HG      VAL  87  -5.814  -0.327  -4.923
  641   3HG1  VAL  87          13HG      VAL  87  -6.357   0.559  -3.497
  642   1HG2  VAL  87          21HG      VAL  87  -9.751  -0.846  -3.572
  643   2HG2  VAL  87          22HG      VAL  87  -9.348   0.764  -4.205
  644   3HG2  VAL  87          23HG      VAL  87  -8.659   0.189  -2.667
  645    H    ARG  88           H        ARG  88  -6.293  -1.265  -7.286
  646    HA   ARG  88           HA       ARG  88  -5.546  -3.997  -6.553
  647   1HB   ARG  88          1HB       ARG  88  -4.942  -2.352  -8.998
  648   2HB   ARG  88          2HB       ARG  88  -4.063  -3.830  -8.610
  649   1HG   ARG  88          1HG       ARG  88  -6.058  -5.120  -8.708
  650   2HG   ARG  88          2HG       ARG  88  -7.051  -3.676  -8.934
  651   1HD   ARG  88          1HD       ARG  88  -6.072  -3.269 -11.040
  652   2HD   ARG  88          2HD       ARG  88  -4.894  -4.587 -10.827
  653    HE   ARG  88           HE       ARG  88  -7.697  -5.318 -10.712
  654   1HH1  ARG  88          11HH      ARG  88  -4.861  -4.997 -12.805
  655   2HH1  ARG  88          12HH      ARG  88  -5.438  -6.069 -13.992
  656   1HH2  ARG  88          21HH      ARG  88  -8.486  -6.766 -12.285
  657   2HH2  ARG  88          22HH      ARG  88  -7.606  -7.118 -13.688
  658    H    PHE  89           H        PHE  89  -4.553  -3.866  -4.804
  659    HA   PHE  89           HA       PHE  89  -2.378  -1.978  -4.406
  660   1HB   PHE  89          1HB       PHE  89  -3.390  -4.227  -2.639
  661   2HB   PHE  89          2HB       PHE  89  -2.167  -3.055  -2.201
  662    HD1  PHE  89           HD1      PHE  89  -2.792  -0.769  -1.690
  663    HD2  PHE  89           HD2      PHE  89  -5.706  -3.720  -2.564
  664    HE1  PHE  89           HE1      PHE  89  -4.520   0.656  -0.690
  665    HE2  PHE  89           HE2      PHE  89  -7.452  -2.283  -1.571
  666    HZ   PHE  89           HZ       PHE  89  -6.853  -0.100  -0.632
  667    H    VAL  90           H        VAL  90  -0.606  -2.594  -5.544
  668    HA   VAL  90           HA       VAL  90   0.023  -5.415  -5.560
  669    HB   VAL  90           HB       VAL  90   1.385  -3.115  -7.009
  670   1HG1  VAL  90          11HG      VAL  90   2.563  -4.872  -8.283
  671   2HG1  VAL  90          12HG      VAL  90   1.794  -6.100  -7.277
  672   3HG1  VAL  90          13HG      VAL  90   2.929  -4.958  -6.559
  673   1HG2  VAL  90          21HG      VAL  90   0.385  -4.028  -9.050
  674   2HG2  VAL  90          22HG      VAL  90  -0.852  -3.532  -7.892
  675   3HG2  VAL  90          23HG      VAL  90  -0.457  -5.243  -8.088
  676    H    ILE  91           H        ILE  91   0.539  -5.547  -3.472
  677    HA   ILE  91           HA       ILE  91   2.696  -3.940  -2.397
  678    HB   ILE  91           HB       ILE  91   0.572  -5.720  -1.253
  679   1HG1  ILE  91          11HG      ILE  91   1.250  -2.858  -0.747
  680   2HG1  ILE  91          12HG      ILE  91   0.036  -3.379  -1.907
  681   1HG2  ILE  91          21HG      ILE  91   2.826  -4.494   0.337
  682   2HG2  ILE  91          22HG      ILE  91   2.588  -6.214   0.035
  683   3HG2  ILE  91          23HG      ILE  91   1.412  -5.320   0.998
  684   1HD1  ILE  91          11HD      ILE  91  -0.911  -2.630   0.093
  685   2HD1  ILE  91          12HD      ILE  91   0.024  -3.827   1.031
  686   3HD1  ILE  91          13HD      ILE  91  -1.203  -4.359  -0.161
  687    H    GLY  92           H        GLY  92   4.421  -5.003  -1.494
  688   1HA   GLY  92          1HA       GLY  92   4.663  -7.765  -2.263
  689   2HA   GLY  92          2HA       GLY  92   5.906  -6.673  -2.840
  690    H    ARG  93           H        ARG  93   5.627  -8.902  -0.760
  691    HA   ARG  93           HA       ARG  93   7.381  -7.718   1.244
  692   1HB   ARG  93          1HB       ARG  93   4.796  -7.443   1.693
  693   2HB   ARG  93          2HB       ARG  93   5.018  -9.125   2.179
  694   1HG   ARG  93          1HG       ARG  93   7.037  -8.230   3.524
  695   2HG   ARG  93          2HG       ARG  93   6.238  -6.664   3.360
  696   1HD   ARG  93          1HD       ARG  93   5.636  -7.682   5.363
  697   2HD   ARG  93          2HD       ARG  93   4.219  -7.649   4.276
  698    HE   ARG  93           HE       ARG  93   5.932 -10.041   4.532
  699   1HH1  ARG  93          11HH      ARG  93   2.646  -8.620   4.679
  700   2HH1  ARG  93          12HH      ARG  93   1.900 -10.128   4.711
  701   1HH2  ARG  93          21HH      ARG  93   4.911 -12.011   4.572
  702   2HH2  ARG  93          22HH      ARG  93   3.209 -12.151   4.636
  703    H    GLU  94           H        GLU  94   8.210  -9.446   2.591
  704    HA   GLU  94           HA       GLU  94   7.994 -12.025   1.345
  705   1HB   GLU  94          1HB       GLU  94   9.976 -12.626   2.751
  706   2HB   GLU  94          2HB       GLU  94  10.260 -11.301   1.644
  707   1HG   GLU  94          1HG       GLU  94   9.675 -10.961   4.563
  708   2HG   GLU  94          2HG       GLU  94  11.300 -11.065   3.888
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1  12.568 -15.369  -3.963
    2   2H    GLY   1          2H        GLY   1  13.823 -14.238  -4.123
    3   3H    GLY   1          3H        GLY   1  12.290 -13.865  -4.702
    4   1HA   GLY   1          1HA       GLY   1  11.411 -13.850  -2.508
    5   2HA   GLY   1          2HA       GLY   1  13.004 -14.246  -1.872
    6    H    HIS   2           H        HIS   2  13.251 -12.332  -0.741
    7    HA   HIS   2           HA       HIS   2  13.600 -10.186  -0.305
    8   1HB   HIS   2          1HB       HIS   2  14.851 -10.266  -3.053
    9   2HB   HIS   2          2HB       HIS   2  14.932  -8.850  -2.012
   10    HD1  HIS   2           HD1      HIS   2  16.638 -12.018  -2.701
   11    HD2  HIS   2           HD2      HIS   2  16.310  -9.364   0.477
   12    HE1  HIS   2           HE1      HIS   2  18.569 -12.528  -1.163
   13    H    MET   3           H        MET   3  11.306 -10.257  -0.376
   14    HA   MET   3           HA       MET   3   9.391  -9.330  -0.581
   15   1HB   MET   3          1HB       MET   3  10.441  -7.245  -0.163
   16   2HB   MET   3          2HB       MET   3  10.858  -7.041  -1.858
   17   1HG   MET   3          1HG       MET   3   8.612  -6.735  -2.490
   18   2HG   MET   3          2HG       MET   3   8.020  -7.309  -0.935
   19   1HE   MET   3          1HE       MET   3   8.768  -4.360   1.455
   20   2HE   MET   3          2HE       MET   3   9.728  -5.813   1.203
   21   3HE   MET   3          3HE       MET   3   7.968  -5.916   1.246
   22    H    GLU   4           H        GLU   4   8.368 -10.630  -1.497
   23    HA   GLU   4           HA       GLU   4   8.200 -11.035  -4.362
   24   1HB   GLU   4          1HB       GLU   4   8.198 -12.901  -2.804
   25   2HB   GLU   4          2HB       GLU   4   6.822 -12.195  -1.973
   26   1HG   GLU   4          1HG       GLU   4   5.390 -12.651  -3.791
   27   2HG   GLU   4          2HG       GLU   4   6.740 -13.106  -4.830
   28    H    LEU   5           H        LEU   5   6.987  -9.727  -5.473
   29    HA   LEU   5           HA       LEU   5   4.948  -8.202  -4.127
   30   1HB   LEU   5          1HB       LEU   5   5.722  -8.079  -7.053
   31   2HB   LEU   5          2HB       LEU   5   4.720  -6.943  -6.174
   32    HG   LEU   5           HG       LEU   5   6.693  -5.842  -6.421
   33   1HD1  LEU   5          1HD1      LEU   5   5.873  -5.690  -4.185
   34   2HD1  LEU   5          2HD1      LEU   5   7.634  -5.547  -4.230
   35   3HD1  LEU   5          3HD1      LEU   5   6.880  -7.061  -3.716
   36   1HD2  LEU   5          1HD2      LEU   5   8.934  -6.711  -5.965
   37   2HD2  LEU   5          2HD2      LEU   5   8.123  -7.683  -7.196
   38   3HD2  LEU   5          3HD2      LEU   5   8.240  -8.270  -5.536
   39    H    PHE   6           H        PHE   6   2.841  -8.474  -4.314
   40    HA   PHE   6           HA       PHE   6   1.796 -10.333  -6.249
   41   1HB   PHE   6          1HB       PHE   6   0.335 -11.173  -4.289
   42   2HB   PHE   6          2HB       PHE   6   1.914 -11.912  -4.515
   43    HD1  PHE   6           HD1      PHE   6  -0.228  -9.713  -2.578
   44    HD2  PHE   6           HD2      PHE   6   3.620 -11.504  -2.796
   45    HE1  PHE   6           HE1      PHE   6   0.194  -9.093  -0.213
   46    HE2  PHE   6           HE2      PHE   6   4.051 -10.913  -0.483
   47    HZ   PHE   6           HZ       PHE   6   2.342  -9.697   0.835
   48    HA   PRO   7           HA       PRO   7  -1.342  -7.249  -6.279
   49   1HB   PRO   7          1HB       PRO   7  -3.086  -8.389  -7.830
   50   2HB   PRO   7          2HB       PRO   7  -1.495  -7.935  -8.437
   51   1HG   PRO   7          1HG       PRO   7  -2.436 -10.674  -7.573
   52   2HG   PRO   7          2HG       PRO   7  -1.487 -10.244  -9.019
   53   1HD   PRO   7          1HD       PRO   7  -0.476 -11.192  -6.627
   54   2HD   PRO   7          2HD       PRO   7   0.448 -10.216  -7.803
   55    H    VAL   8           H        VAL   8  -2.756  -6.774  -4.785
   56    HA   VAL   8           HA       VAL   8  -4.579  -8.840  -3.887
   57    HB   VAL   8           HB       VAL   8  -3.965  -6.240  -2.484
   58   1HG1  VAL   8          1HG1      VAL   8  -4.987  -7.289  -0.523
   59   2HG1  VAL   8          2HG1      VAL   8  -5.400  -8.686  -1.526
   60   3HG1  VAL   8          3HG1      VAL   8  -6.088  -7.101  -1.889
   61   1HG2  VAL   8          1HG2      VAL   8  -2.774  -8.954  -1.954
   62   2HG2  VAL   8          2HG2      VAL   8  -2.596  -7.544  -0.898
   63   3HG2  VAL   8          3HG2      VAL   8  -1.946  -7.511  -2.543
   64    H    GLU   9           H        GLU   9  -6.402  -8.582  -5.036
   65    HA   GLU   9           HA       GLU   9  -7.213  -5.934  -5.904
   66   1HB   GLU   9          1HB       GLU   9  -7.367  -7.826  -7.499
   67   2HB   GLU   9          2HB       GLU   9  -8.461  -8.652  -6.402
   68   1HG   GLU   9          1HG       GLU   9 -10.111  -6.873  -6.702
   69   2HG   GLU   9          2HG       GLU   9  -9.009  -6.034  -7.790
   70    H    LEU  10           H        LEU  10  -8.202  -4.782  -4.389
   71    HA   LEU  10           HA       LEU  10  -9.712  -6.186  -2.306
   72   1HB   LEU  10          1HB       LEU  10  -7.805  -4.313  -2.166
   73   2HB   LEU  10          2HB       LEU  10  -9.203  -3.273  -2.346
   74    HG   LEU  10           HG       LEU  10  -8.724  -3.368  -0.050
   75   1HD1  LEU  10          1HD1      LEU  10 -10.663  -4.419   0.986
   76   2HD1  LEU  10          2HD1      LEU  10 -10.972  -5.287  -0.510
   77   3HD1  LEU  10          3HD1      LEU  10 -11.082  -3.532  -0.480
   78   1HD2  LEU  10          1HD2      LEU  10  -8.446  -5.438   1.209
   79   2HD2  LEU  10          2HD2      LEU  10  -7.231  -5.256  -0.055
   80   3HD2  LEU  10          3HD2      LEU  10  -8.587  -6.361  -0.286
   81    H    GLU  11           H        GLU  11 -11.920  -5.844  -2.251
   82    HA   GLU  11           HA       GLU  11 -12.968  -3.850  -4.100
   83   1HB   GLU  11          1HB       GLU  11 -13.723  -6.176  -4.500
   84   2HB   GLU  11          2HB       GLU  11 -14.367  -6.237  -2.868
   85   1HG   GLU  11          1HG       GLU  11 -15.976  -4.510  -3.415
   86   2HG   GLU  11          2HG       GLU  11 -15.298  -4.370  -5.038
   87    H    LYS  12           H        LYS  12 -12.444  -2.205  -2.594
   88    HA   LYS  12           HA       LYS  12 -13.616  -2.176  -0.076
   89   1HB   LYS  12          1HB       LYS  12 -11.633  -0.700  -1.506
   90   2HB   LYS  12          2HB       LYS  12 -12.786   0.409  -0.802
   91   1HG   LYS  12          1HG       LYS  12 -11.503  -1.813   0.630
   92   2HG   LYS  12          2HG       LYS  12 -10.824  -0.164   0.672
   93   1HD   LYS  12          1HD       LYS  12 -13.212   0.560   1.405
   94   2HD   LYS  12          2HD       LYS  12 -13.476  -1.148   1.759
   95   1HE   LYS  12          1HE       LYS  12 -12.306  -1.021   3.693
   96   2HE   LYS  12          2HE       LYS  12 -11.221   0.257   3.139
   97   1HZ   LYS  12          1HZ       LYS  12 -13.090   1.780   3.170
   98   2HZ   LYS  12          2HZ       LYS  12 -12.953   1.185   4.696
   99   3HZ   LYS  12          3HZ       LYS  12 -14.145   0.589   3.618
  100    H    ASP  13           H        ASP  13 -14.743  -0.103   0.566
  101    HA   ASP  13           HA       ASP  13 -17.356  -0.037  -0.503
  102   1HB   ASP  13          1HB       ASP  13 -16.061   1.858   1.482
  103   2HB   ASP  13          2HB       ASP  13 -17.762   1.479   1.318
  104    H    GLU  14           H        GLU  14 -18.355   2.193  -1.039
  105    HA   GLU  14           HA       GLU  14 -16.853   3.468  -3.112
  106   1HB   GLU  14          1HB       GLU  14 -18.720   5.051  -3.302
  107   2HB   GLU  14          2HB       GLU  14 -19.310   3.399  -3.224
  108   1HG   GLU  14          1HG       GLU  14 -20.025   3.683  -0.981
  109   2HG   GLU  14          2HG       GLU  14 -19.207   5.242  -0.853
  110    H    ASP  15           H        ASP  15 -17.173   3.950   0.202
  111    HA   ASP  15           HA       ASP  15 -16.446   6.648   0.546
  112   1HB   ASP  15          1HB       ASP  15 -17.372   5.197   2.300
  113   2HB   ASP  15          2HB       ASP  15 -15.889   4.265   2.305
  114    H    GLY  16           H        GLY  16 -14.628   3.759  -0.026
  115   1HA   GLY  16          1HA       GLY  16 -12.475   3.931  -1.131
  116   2HA   GLY  16          2HA       GLY  16 -12.132   5.333  -0.103
  117    H    LEU  17           H        LEU  17 -10.206   4.233   0.566
  118    HA   LEU  17           HA       LEU  17 -10.477   1.690   1.918
  119   1HB   LEU  17          1HB       LEU  17  -8.053   3.446   2.055
  120   2HB   LEU  17          2HB       LEU  17  -8.175   1.712   2.225
  121    HG   LEU  17           HG       LEU  17  -8.393   3.309  -0.247
  122   1HD1  LEU  17          1HD1      LEU  17  -6.155   3.146   0.501
  123   2HD1  LEU  17          2HD1      LEU  17  -6.331   2.001  -0.839
  124   3HD1  LEU  17          3HD1      LEU  17  -6.326   1.426   0.821
  125   1HD2  LEU  17          1HD2      LEU  17  -8.462   1.138  -1.439
  126   2HD2  LEU  17          2HD2      LEU  17  -9.897   1.437  -0.460
  127   3HD2  LEU  17          3HD2      LEU  17  -8.654   0.318   0.113
  128    H    GLY  18           H        GLY  18  -9.667   5.014   2.639
  129   1HA   GLY  18          1HA       GLY  18  -9.710   6.227   4.572
  130   2HA   GLY  18          2HA       GLY  18 -10.718   4.959   5.267
  131    H    ILE  19           H        ILE  19  -7.535   4.388   3.889
  132    HA   ILE  19           HA       ILE  19  -6.718   3.516   6.568
  133    HB   ILE  19           HB       ILE  19  -5.015   2.126   5.605
  134   1HG1  ILE  19          1HG1      ILE  19  -5.806   3.209   2.892
  135   2HG1  ILE  19          2HG1      ILE  19  -4.356   3.663   3.784
  136   1HG2  ILE  19          1HG2      ILE  19  -6.386   0.599   4.236
  137   2HG2  ILE  19          2HG2      ILE  19  -7.587   1.885   4.069
  138   3HG2  ILE  19          3HG2      ILE  19  -7.263   1.202   5.646
  139   1HD1  ILE  19          1HD1      ILE  19  -4.998   0.898   2.771
  140   2HD1  ILE  19          2HD1      ILE  19  -3.561   1.353   3.683
  141   3HD1  ILE  19          3HD1      ILE  19  -3.827   2.019   2.073
  142    H    SER  20           H        SER  20  -4.078   3.566   6.632
  143    HA   SER  20           HA       SER  20  -3.219   6.316   6.048
  144   1HB   SER  20          1HB       SER  20  -3.091   4.922   8.731
  145   2HB   SER  20          2HB       SER  20  -2.476   6.536   8.403
  146    HG   SER  20           HG       SER  20  -4.936   6.481   7.556
  147    H    ILE  21           H        ILE  21  -0.981   6.542   5.930
  148    HA   ILE  21           HA       ILE  21   0.542   4.028   5.642
  149    HB   ILE  21           HB       ILE  21   1.800   5.084   3.841
  150   1HG1  ILE  21          1HG1      ILE  21   0.448   7.337   2.959
  151   2HG1  ILE  21          2HG1      ILE  21   0.318   7.490   4.684
  152   1HG2  ILE  21          1HG2      ILE  21  -0.141   3.810   3.199
  153   2HG2  ILE  21          2HG2      ILE  21   0.067   5.183   2.110
  154   3HG2  ILE  21          3HG2      ILE  21  -1.165   5.236   3.370
  155   1HD1  ILE  21          1HD1      ILE  21   2.246   8.710   3.809
  156   2HD1  ILE  21          2HD1      ILE  21   2.937   7.228   3.202
  157   3HD1  ILE  21          3HD1      ILE  21   2.740   7.459   4.934
  158    H    ILE  22           H        ILE  22   2.847   4.279   6.026
  159    HA   ILE  22           HA       ILE  22   3.519   6.691   7.487
  160    HB   ILE  22           HB       ILE  22   3.152   4.962   9.156
  161   1HG1  ILE  22          1HG1      ILE  22   6.108   5.526   8.869
  162   2HG1  ILE  22          2HG1      ILE  22   4.928   6.622   9.575
  163   1HG2  ILE  22          1HG2      ILE  22   4.544   2.953   9.303
  164   2HG2  ILE  22          2HG2      ILE  22   5.248   3.371   7.737
  165   3HG2  ILE  22          3HG2      ILE  22   3.527   2.991   7.857
  166   1HD1  ILE  22          1HD1      ILE  22   4.500   5.009  11.359
  167   2HD1  ILE  22          2HD1      ILE  22   6.201   5.466  11.286
  168   3HD1  ILE  22          3HD1      ILE  22   5.679   3.910  10.642
  169    H    GLY  23           H        GLY  23   5.347   7.658   6.912
  170   1HA   GLY  23          1HA       GLY  23   6.647   6.428   4.636
  171   2HA   GLY  23          2HA       GLY  23   6.727   8.137   5.049
  172    H    MET  24           H        MET  24   8.119   5.061   5.354
  173    HA   MET  24           HA       MET  24  10.112   6.114   7.233
  174   1HB   MET  24          1HB       MET  24   9.540   3.258   6.403
  175   2HB   MET  24          2HB       MET  24  10.806   3.742   7.516
  176   1HG   MET  24          1HG       MET  24   7.851   4.090   7.921
  177   2HG   MET  24          2HG       MET  24   8.830   2.854   8.688
  178   1HE   MET  24          1HE       MET  24  11.206   5.170  10.922
  179   2HE   MET  24          2HE       MET  24  11.532   4.717   9.253
  180   3HE   MET  24          3HE       MET  24  10.910   3.517  10.386
  181    H    GLY  25           H        GLY  25  12.362   5.470   6.700
  182   1HA   GLY  25          1HA       GLY  25  12.673   5.279   3.799
  183   2HA   GLY  25          2HA       GLY  25  13.726   6.269   4.797
  184    H    VAL  26           H        VAL  26  12.621   2.989   4.279
  185    HA   VAL  26           HA       VAL  26  15.124   2.044   5.389
  186    HB   VAL  26           HB       VAL  26  13.155   1.047   6.468
  187   1HG1  VAL  26          1HG1      VAL  26  11.569  -0.363   5.286
  188   2HG1  VAL  26          2HG1      VAL  26  12.284   0.154   3.755
  189   3HG1  VAL  26          3HG1      VAL  26  11.501   1.333   4.808
  190   1HG2  VAL  26          1HG2      VAL  26  14.498  -0.969   4.663
  191   2HG2  VAL  26          2HG2      VAL  26  13.607  -1.347   6.135
  192   3HG2  VAL  26          3HG2      VAL  26  15.101  -0.410   6.223
  193    H    GLY  27           H        GLY  27  16.528   2.198   3.850
  194   1HA   GLY  27          1HA       GLY  27  16.032   0.713   1.410
  195   2HA   GLY  27          2HA       GLY  27  16.300   2.440   1.209
  196    H    ALA  28           H        ALA  28  18.330   3.280   2.158
  197    HA   ALA  28           HA       ALA  28  20.552   1.852   1.127
  198   1HB   ALA  28          1HB       ALA  28  20.508   4.294   1.240
  199   2HB   ALA  28          2HB       ALA  28  21.902   3.665   2.124
  200   3HB   ALA  28          3HB       ALA  28  20.477   4.222   3.000
  201    H    ASP  29           H        ASP  29  19.162   2.240   4.251
  202    HA   ASP  29           HA       ASP  29  21.186   1.017   5.803
  203   1HB   ASP  29          1HB       ASP  29  19.314   0.910   7.502
  204   2HB   ASP  29          2HB       ASP  29  19.718   2.516   6.902
  205    H    ALA  30           H        ALA  30  18.716  -0.183   3.805
  206    HA   ALA  30           HA       ALA  30  18.803  -2.832   5.046
  207   1HB   ALA  30          1HB       ALA  30  16.598  -1.975   4.392
  208   2HB   ALA  30          2HB       ALA  30  17.015  -3.414   3.459
  209   3HB   ALA  30          3HB       ALA  30  17.149  -1.816   2.725
  210    H    GLY  31           H        GLY  31  19.734  -1.062   2.190
  211   1HA   GLY  31          1HA       GLY  31  21.765  -1.631   1.051
  212   2HA   GLY  31          2HA       GLY  31  21.430  -3.325   1.390
  213    H    LEU  32           H        LEU  32  18.638  -3.074   0.711
  214    HA   LEU  32           HA       LEU  32  18.882  -3.638  -2.099
  215   1HB   LEU  32          1HB       LEU  32  16.445  -3.606  -0.309
  216   2HB   LEU  32          2HB       LEU  32  16.423  -4.081  -1.986
  217    HG   LEU  32           HG       LEU  32  17.971  -5.983  -1.366
  218   1HD1  LEU  32          1HD1      LEU  32  18.054  -6.683   0.963
  219   2HD1  LEU  32          2HD1      LEU  32  17.237  -5.197   1.449
  220   3HD1  LEU  32          3HD1      LEU  32  18.847  -5.125   0.733
  221   1HD2  LEU  32          1HD2      LEU  32  15.267  -5.887  -0.056
  222   2HD2  LEU  32          2HD2      LEU  32  16.177  -7.349  -0.433
  223   3HD2  LEU  32          3HD2      LEU  32  15.599  -6.312  -1.735
  224    H    GLU  33           H        GLU  33  17.583  -1.116  -0.120
  225    HA   GLU  33           HA       GLU  33  16.652   0.871  -0.451
  226   1HB   GLU  33          1HB       GLU  33  17.974   0.710  -3.134
  227   2HB   GLU  33          2HB       GLU  33  17.131   2.130  -2.545
  228   1HG   GLU  33          1HG       GLU  33  18.699   2.201  -0.639
  229   2HG   GLU  33          2HG       GLU  33  19.585   0.864  -1.377
  230    H    LYS  34           H        LYS  34  14.528   0.500  -0.272
  231    HA   LYS  34           HA       LYS  34  13.158   0.895  -2.737
  232   1HB   LYS  34          1HB       LYS  34  11.576  -0.860  -2.544
  233   2HB   LYS  34          2HB       LYS  34  13.097  -1.650  -2.200
  234   1HG   LYS  34          1HG       LYS  34  11.137  -0.701  -0.131
  235   2HG   LYS  34          2HG       LYS  34  11.248  -2.341  -0.751
  236   1HD   LYS  34          1HD       LYS  34  13.313  -2.704   0.261
  237   2HD   LYS  34          2HD       LYS  34  13.592  -0.974   0.503
  238   1HE   LYS  34          1HE       LYS  34  12.958  -2.008   2.597
  239   2HE   LYS  34          2HE       LYS  34  11.769  -0.853   1.952
  240   1HZ   LYS  34          1HZ       LYS  34  10.293  -2.573   1.349
  241   2HZ   LYS  34          2HZ       LYS  34  10.827  -3.018   2.889
  242   3HZ   LYS  34          3HZ       LYS  34  11.475  -3.761   1.536
  243    H    LEU  35           H        LEU  35  10.735   1.229  -2.026
  244    HA   LEU  35           HA       LEU  35  10.608   3.529  -0.515
  245   1HB   LEU  35          1HB       LEU  35   8.239   3.253  -0.486
  246   2HB   LEU  35          2HB       LEU  35   8.861   2.765  -2.050
  247    HG   LEU  35           HG       LEU  35   8.363   0.692   0.035
  248   1HD1  LEU  35          1HD1      LEU  35   6.266   1.924  -1.746
  249   2HD1  LEU  35          2HD1      LEU  35   6.348   1.966   0.025
  250   3HD1  LEU  35          3HD1      LEU  35   6.067   0.448  -0.795
  251   1HD2  LEU  35          1HD2      LEU  35   7.802  -0.684  -1.941
  252   2HD2  LEU  35          2HD2      LEU  35   9.443  -0.066  -1.962
  253   3HD2  LEU  35          3HD2      LEU  35   8.205   0.684  -2.984
  254    H    GLY  36           H        GLY  36   9.900   3.941   1.564
  255   1HA   GLY  36          1HA       GLY  36   9.931   1.649   3.375
  256   2HA   GLY  36          2HA       GLY  36  10.433   3.288   3.814
  257    H    ILE  37           H        ILE  37   7.740   3.010   1.742
  258    HA   ILE  37           HA       ILE  37   6.062   4.118   3.785
  259    HB   ILE  37           HB       ILE  37   5.172   3.105   1.070
  260   1HG1  ILE  37          1HG1      ILE  37   6.974   4.831   0.957
  261   2HG1  ILE  37          2HG1      ILE  37   5.462   5.355   0.186
  262   1HG2  ILE  37          1HG2      ILE  37   3.902   5.026   3.014
  263   2HG2  ILE  37          2HG2      ILE  37   3.382   3.384   2.679
  264   3HG2  ILE  37          3HG2      ILE  37   3.264   4.616   1.419
  265   1HD1  ILE  37          1HD1      ILE  37   6.712   6.177   2.781
  266   2HD1  ILE  37          2HD1      ILE  37   5.042   6.575   2.370
  267   3HD1  ILE  37          3HD1      ILE  37   6.362   7.187   1.374
  268    H    PHE  38           H        PHE  38   5.189   2.939   5.212
  269    HA   PHE  38           HA       PHE  38   4.384   0.202   4.522
  270   1HB   PHE  38          1HB       PHE  38   5.235   1.399   7.143
  271   2HB   PHE  38          2HB       PHE  38   4.514  -0.199   7.013
  272    HD1  PHE  38           HD1      PHE  38   7.555   1.725   6.748
  273    HD2  PHE  38           HD2      PHE  38   5.716  -1.969   5.713
  274    HE1  PHE  38           HE1      PHE  38   9.747   0.749   6.389
  275    HE2  PHE  38           HE2      PHE  38   7.930  -2.966   5.340
  276    HZ   PHE  38           HZ       PHE  38   9.953  -1.616   5.681
  277    H    VAL  39           H        VAL  39   2.450  -0.501   5.760
  278    HA   VAL  39           HA       VAL  39   0.496   1.573   5.601
  279    HB   VAL  39           HB       VAL  39   0.178  -1.252   6.679
  280   1HG1  VAL  39          1HG1      VAL  39  -2.196  -0.945   6.091
  281   2HG1  VAL  39          2HG1      VAL  39  -1.849   0.714   5.611
  282   3HG1  VAL  39          3HG1      VAL  39  -1.654   0.225   7.294
  283   1HG2  VAL  39          1HG2      VAL  39  -0.237  -0.244   3.862
  284   2HG2  VAL  39          2HG2      VAL  39  -0.593  -1.876   4.435
  285   3HG2  VAL  39          3HG2      VAL  39   1.067  -1.295   4.395
  286    H    LYS  40           H        LYS  40  -0.294   2.701   7.273
  287    HA   LYS  40           HA       LYS  40   1.084   2.326   9.803
  288   1HB   LYS  40          1HB       LYS  40   1.207   4.577   8.906
  289   2HB   LYS  40          2HB       LYS  40  -0.528   4.639   8.741
  290   1HG   LYS  40          1HG       LYS  40  -0.001   6.003  10.603
  291   2HG   LYS  40          2HG       LYS  40  -0.697   4.536  11.241
  292   1HD   LYS  40          1HD       LYS  40   2.275   5.125  11.146
  293   2HD   LYS  40          2HD       LYS  40   1.256   5.409  12.545
  294   1HE   LYS  40          1HE       LYS  40   0.688   2.886  12.343
  295   2HE   LYS  40          2HE       LYS  40   2.102   2.829  11.297
  296   1HZ   LYS  40          1HZ       LYS  40   2.754   2.269  13.503
  297   2HZ   LYS  40          2HZ       LYS  40   2.058   3.645  14.127
  298   3HZ   LYS  40          3HZ       LYS  40   3.427   3.781  13.169
  299    H    THR  41           H        THR  41  -2.141   2.627   8.442
  300    HA   THR  41           HA       THR  41  -3.245   1.096  10.617
  301    HB   THR  41           HB       THR  41  -4.601   3.595   9.923
  302    HG1  THR  41           HG1      THR  41  -2.360   3.283  11.642
  303   1HG2  THR  41          1HG2      THR  41  -5.786   2.012  11.284
  304   2HG2  THR  41          2HG2      THR  41  -5.448   3.449  12.259
  305   3HG2  THR  41          3HG2      THR  41  -4.476   1.990  12.472
  306    H    VAL  42           H        VAL  42  -5.420   0.545  10.018
  307    HA   VAL  42           HA       VAL  42  -6.139   1.063   7.261
  308    HB   VAL  42           HB       VAL  42  -6.433  -1.602   8.735
  309   1HG1  VAL  42          1HG1      VAL  42  -7.315  -2.469   6.621
  310   2HG1  VAL  42          2HG1      VAL  42  -7.136  -0.855   5.920
  311   3HG1  VAL  42          3HG1      VAL  42  -8.281  -1.116   7.233
  312   1HG2  VAL  42          1HG2      VAL  42  -4.129  -1.245   8.006
  313   2HG2  VAL  42          2HG2      VAL  42  -4.692  -0.920   6.367
  314   3HG2  VAL  42          3HG2      VAL  42  -4.898  -2.525   7.068
  315    H    THR  43           H        THR  43  -8.450   1.285   7.090
  316    HA   THR  43           HA       THR  43  -9.845   2.325   9.233
  317    HB   THR  43           HB       THR  43 -10.492   2.524   6.786
  318    HG1  THR  43           HG1      THR  43 -12.070   3.146   8.175
  319   1HG2  THR  43          1HG2      THR  43 -10.207   0.189   6.196
  320   2HG2  THR  43          2HG2      THR  43 -11.869   0.707   5.835
  321   3HG2  THR  43          3HG2      THR  43 -11.512  -0.228   7.300
  322    H    GLU  44           H        GLU  44 -11.297   1.394  10.711
  323    HA   GLU  44           HA       GLU  44 -10.451  -1.123  11.626
  324   1HB   GLU  44          1HB       GLU  44 -11.850  -0.710  13.488
  325   2HB   GLU  44          2HB       GLU  44 -11.047   0.789  13.068
  326   1HG   GLU  44          1HG       GLU  44 -13.028   1.535  11.921
  327   2HG   GLU  44          2HG       GLU  44 -13.812   0.011  12.330
  328    H    GLY  45           H        GLY  45 -13.333   0.010   9.933
  329   1HA   GLY  45          1HA       GLY  45 -13.933  -2.689   9.331
  330   2HA   GLY  45          2HA       GLY  45 -15.178  -1.891  10.335
  331    H    GLY  46           H        GLY  46 -13.351  -1.985   7.469
  332   1HA   GLY  46          1HA       GLY  46 -15.609  -1.118   5.986
  333   2HA   GLY  46          2HA       GLY  46 -14.003  -0.414   5.674
  334    H    ALA  47           H        ALA  47 -14.886  -1.803   3.735
  335    HA   ALA  47           HA       ALA  47 -14.614  -4.559   3.889
  336   1HB   ALA  47          1HB       ALA  47 -14.351  -2.884   1.432
  337   2HB   ALA  47          2HB       ALA  47 -15.839  -3.529   2.110
  338   3HB   ALA  47          3HB       ALA  47 -14.617  -4.623   1.452
  339    H    ALA  48           H        ALA  48 -12.085  -2.595   4.329
  340    HA   ALA  48           HA       ALA  48 -10.026  -3.937   2.773
  341   1HB   ALA  48          1HB       ALA  48  -8.453  -2.508   3.990
  342   2HB   ALA  48          2HB       ALA  48  -9.758  -1.950   5.037
  343   3HB   ALA  48          3HB       ALA  48  -9.773  -1.551   3.318
  344    H    GLN  49           H        GLN  49 -10.642  -3.567   6.316
  345    HA   GLN  49           HA       GLN  49  -9.104  -5.888   6.761
  346   1HB   GLN  49          1HB       GLN  49 -10.780  -4.207   8.612
  347   2HB   GLN  49          2HB       GLN  49  -9.998  -5.683   9.176
  348   1HG   GLN  49          1HG       GLN  49  -7.852  -4.696   8.253
  349   2HG   GLN  49          2HG       GLN  49  -8.771  -3.198   8.084
  350   1HE2  GLN  49          1HE2      GLN  49  -9.353  -2.097   9.897
  351   2HE2  GLN  49          2HE2      GLN  49  -8.724  -2.441  11.457
  352    H    ARG  50           H        ARG  50 -12.263  -5.464   5.790
  353    HA   ARG  50           HA       ARG  50 -13.303  -7.918   6.791
  354   1HB   ARG  50          1HB       ARG  50 -14.115  -6.230   4.449
  355   2HB   ARG  50          2HB       ARG  50 -14.956  -7.689   4.912
  356   1HG   ARG  50          1HG       ARG  50 -14.569  -5.389   6.773
  357   2HG   ARG  50          2HG       ARG  50 -16.024  -5.588   5.773
  358   1HD   ARG  50          1HD       ARG  50 -14.961  -7.472   7.874
  359   2HD   ARG  50          2HD       ARG  50 -16.401  -6.464   8.016
  360    HE   ARG  50           HE       ARG  50 -17.186  -7.805   6.009
  361   1HH1  ARG  50          1HH1      ARG  50 -15.168  -9.177   8.603
  362   2HH1  ARG  50          2HH1      ARG  50 -15.767 -10.760   8.392
  363   1HH2  ARG  50          1HH2      ARG  50 -17.979  -9.996   5.742
  364   2HH2  ARG  50          2HH2      ARG  50 -17.391 -11.238   6.720
  365    H    ASP  51           H        ASP  51 -11.718  -6.840   3.816
  366    HA   ASP  51           HA       ASP  51 -11.737  -9.285   2.442
  367   1HB   ASP  51          1HB       ASP  51 -11.124  -7.126   1.393
  368   2HB   ASP  51          2HB       ASP  51  -9.644  -7.090   2.342
  369    H    GLY  52           H        GLY  52  -9.090  -7.807   4.267
  370   1HA   GLY  52          1HA       GLY  52  -7.799  -8.797   5.935
  371   2HA   GLY  52          2HA       GLY  52  -8.611 -10.312   5.616
  372    H    ARG  53           H        ARG  53  -7.567  -9.498   2.596
  373    HA   ARG  53           HA       ARG  53  -5.261 -11.220   2.849
  374   1HB   ARG  53          1HB       ARG  53  -6.968 -10.882   0.839
  375   2HB   ARG  53          2HB       ARG  53  -5.890  -9.574   0.405
  376   1HG   ARG  53          1HG       ARG  53  -5.119 -12.485   0.631
  377   2HG   ARG  53          2HG       ARG  53  -5.463 -11.627  -0.862
  378   1HD   ARG  53          1HD       ARG  53  -3.551 -10.158  -0.435
  379   2HD   ARG  53          2HD       ARG  53  -3.214 -11.046   1.051
  380    HE   ARG  53           HE       ARG  53  -3.312 -12.487  -1.473
  381   1HH1  ARG  53          1HH1      ARG  53  -1.355 -11.280   1.233
  382   2HH1  ARG  53          2HH1      ARG  53   0.016 -12.205   0.844
  383   1HH2  ARG  53          1HH2      ARG  53  -1.414 -13.803  -1.964
  384   2HH2  ARG  53          2HH2      ARG  53  -0.011 -13.663  -1.018
  385    H    ILE  54           H        ILE  54  -6.015  -7.880   2.611
  386    HA   ILE  54           HA       ILE  54  -3.237  -7.034   2.531
  387    HB   ILE  54           HB       ILE  54  -5.106  -5.775   1.309
  388   1HG1  ILE  54          1HG1      ILE  54  -3.659  -4.105   3.379
  389   2HG1  ILE  54          2HG1      ILE  54  -2.875  -4.770   1.954
  390   1HG2  ILE  54          1HG2      ILE  54  -5.856  -5.030   4.142
  391   2HG2  ILE  54          2HG2      ILE  54  -6.856  -5.932   3.011
  392   3HG2  ILE  54          3HG2      ILE  54  -6.497  -4.228   2.706
  393   1HD1  ILE  54          1HD1      ILE  54  -5.206  -2.874   1.906
  394   2HD1  ILE  54          2HD1      ILE  54  -4.279  -3.486   0.517
  395   3HD1  ILE  54          3HD1      ILE  54  -3.504  -2.430   1.681
  396    H    GLN  55           H        GLN  55  -2.334  -5.783   4.379
  397    HA   GLN  55           HA       GLN  55  -3.863  -6.196   6.767
  398   1HB   GLN  55          1HB       GLN  55  -0.955  -6.919   6.448
  399   2HB   GLN  55          2HB       GLN  55  -1.806  -6.876   7.985
  400   1HG   GLN  55          1HG       GLN  55  -3.328  -8.616   7.165
  401   2HG   GLN  55          2HG       GLN  55  -2.423  -8.683   5.657
  402   1HE2  GLN  55          1HE2      GLN  55  -2.886 -10.753   7.562
  403   2HE2  GLN  55          2HE2      GLN  55  -1.344 -11.280   8.123
  404    H    VAL  56           H        VAL  56  -2.380  -5.115   8.613
  405    HA   VAL  56           HA       VAL  56  -2.020  -2.358   7.713
  406    HB   VAL  56           HB       VAL  56  -3.538  -2.854   9.633
  407   1HG1  VAL  56          1HG1      VAL  56  -2.390  -4.730  10.617
  408   2HG1  VAL  56          2HG1      VAL  56  -2.611  -3.459  11.818
  409   3HG1  VAL  56          3HG1      VAL  56  -1.032  -3.697  11.065
  410   1HG2  VAL  56          1HG2      VAL  56  -2.652  -1.104  11.167
  411   2HG2  VAL  56          2HG2      VAL  56  -2.595  -0.633   9.474
  412   3HG2  VAL  56          3HG2      VAL  56  -1.126  -1.160  10.288
  413    H    ASN  57           H        ASN  57  -0.172  -5.039   8.090
  414    HA   ASN  57           HA       ASN  57   2.080  -3.438   9.079
  415   1HB   ASN  57          1HB       ASN  57   1.214  -5.340  10.569
  416   2HB   ASN  57          2HB       ASN  57   1.908  -6.433   9.381
  417   1HD2  ASN  57          1HD2      ASN  57   3.243  -3.322  10.407
  418   2HD2  ASN  57          2HD2      ASN  57   4.658  -3.981  11.111
  419    H    ASP  58           H        ASP  58   0.971  -4.159   6.297
  420    HA   ASP  58           HA       ASP  58   3.411  -5.335   5.296
  421   1HB   ASP  58          1HB       ASP  58   2.183  -5.757   3.184
  422   2HB   ASP  58          2HB       ASP  58   1.370  -6.507   4.542
  423    H    GLN  59           H        GLN  59   3.263  -4.296   2.711
  424    HA   GLN  59           HA       GLN  59   3.784  -1.482   3.178
  425   1HB   GLN  59          1HB       GLN  59   5.951  -2.454   3.371
  426   2HB   GLN  59          2HB       GLN  59   5.617  -3.532   2.016
  427   1HG   GLN  59          1HG       GLN  59   6.035  -1.915   0.439
  428   2HG   GLN  59          2HG       GLN  59   5.646  -0.598   1.538
  429   1HE2  GLN  59          1HE2      GLN  59   7.148   0.168   2.838
  430   2HE2  GLN  59          2HE2      GLN  59   8.855  -0.150   2.683
  431    H    ILE  60           H        ILE  60   2.589  -0.395   1.794
  432    HA   ILE  60           HA       ILE  60   1.346  -1.517  -0.504
  433    HB   ILE  60           HB       ILE  60   1.821   1.422   0.027
  434   1HG1  ILE  60          1HG1      ILE  60   0.624   0.544   1.974
  435   2HG1  ILE  60          2HG1      ILE  60  -0.453   1.487   0.941
  436   1HG2  ILE  60          1HG2      ILE  60  -0.257   0.006  -1.599
  437   2HG2  ILE  60          2HG2      ILE  60   1.175   0.783  -2.236
  438   3HG2  ILE  60          3HG2      ILE  60  -0.083   1.758  -1.458
  439   1HD1  ILE  60          1HD1      ILE  60  -0.335  -1.513   1.039
  440   2HD1  ILE  60          2HD1      ILE  60  -1.429  -0.537   0.053
  441   3HD1  ILE  60          3HD1      ILE  60  -1.554  -0.501   1.813
  442    H    VAL  61           H        VAL  61   2.652  -2.143  -2.156
  443    HA   VAL  61           HA       VAL  61   5.077  -0.651  -2.717
  444    HB   VAL  61           HB       VAL  61   3.948  -3.192  -3.917
  445   1HG1  VAL  61          1HG1      VAL  61   6.066  -3.578  -4.944
  446   2HG1  VAL  61          2HG1      VAL  61   6.669  -2.000  -4.396
  447   3HG1  VAL  61          3HG1      VAL  61   5.334  -2.101  -5.561
  448   1HG2  VAL  61          1HG2      VAL  61   6.198  -2.763  -1.963
  449   2HG2  VAL  61          2HG2      VAL  61   5.729  -4.310  -2.678
  450   3HG2  VAL  61          3HG2      VAL  61   4.608  -3.457  -1.626
  451    H    GLU  62           H        GLU  62   2.165  -1.611  -4.473
  452    HA   GLU  62           HA       GLU  62   2.285   0.840  -6.068
  453   1HB   GLU  62          1HB       GLU  62   3.473  -0.788  -7.428
  454   2HB   GLU  62          2HB       GLU  62   2.178  -1.950  -7.226
  455   1HG   GLU  62          1HG       GLU  62   0.661  -0.457  -8.427
  456   2HG   GLU  62          2HG       GLU  62   1.949   0.698  -8.639
  457    H    VAL  63           H        VAL  63   0.270   1.643  -6.240
  458    HA   VAL  63           HA       VAL  63  -1.930  -0.220  -5.887
  459    HB   VAL  63           HB       VAL  63  -1.462   2.395  -4.439
  460   1HG1  VAL  63          1HG1      VAL  63  -3.855   2.657  -4.038
  461   2HG1  VAL  63          2HG1      VAL  63  -4.204   1.331  -5.162
  462   3HG1  VAL  63          3HG1      VAL  63  -3.473   2.829  -5.753
  463   1HG2  VAL  63          1HG2      VAL  63  -2.858  -0.164  -3.772
  464   2HG2  VAL  63          2HG2      VAL  63  -2.444   1.148  -2.661
  465   3HG2  VAL  63          3HG2      VAL  63  -1.174   0.197  -3.440
  466    H    ASP  64           H        ASP  64  -3.258  -0.272  -7.417
  467    HA   ASP  64           HA       ASP  64  -4.638   0.257  -9.100
  468   1HB   ASP  64          1HB       ASP  64  -5.236   2.168  -7.566
  469   2HB   ASP  64          2HB       ASP  64  -4.093   3.169  -8.447
  470    H    GLY  65           H        GLY  65  -1.685   0.180  -9.342
  471   1HA   GLY  65          1HA       GLY  65  -0.149   0.164 -10.996
  472   2HA   GLY  65          2HA       GLY  65  -1.427   0.607 -12.133
  473    H    ILE  66           H        ILE  66  -0.785   2.578  -9.348
  474    HA   ILE  66           HA       ILE  66   0.041   4.742 -11.058
  475    HB   ILE  66           HB       ILE  66  -1.467   4.804  -8.836
  476   1HG1  ILE  66          1HG1      ILE  66   0.647   6.910  -9.334
  477   2HG1  ILE  66          2HG1      ILE  66  -0.816   6.726 -10.305
  478   1HG2  ILE  66          1HG2      ILE  66   0.182   3.819  -7.362
  479   2HG2  ILE  66          2HG2      ILE  66  -0.174   5.482  -6.868
  480   3HG2  ILE  66          3HG2      ILE  66   1.317   5.117  -7.737
  481   1HD1  ILE  66          1HD1      ILE  66  -1.058   8.498  -8.667
  482   2HD1  ILE  66          2HD1      ILE  66  -0.688   7.335  -7.386
  483   3HD1  ILE  66          3HD1      ILE  66  -2.163   7.153  -8.335
  484    H    SER  67           H        SER  67   1.506   2.252  -9.448
  485    HA   SER  67           HA       SER  67   3.516   1.740  -8.524
  486   1HB   SER  67          1HB       SER  67   5.479   2.277 -10.053
  487   2HB   SER  67          2HB       SER  67   4.132   1.419 -10.794
  488    HG   SER  67           HG       SER  67   3.778   4.074 -10.950
  489    H    LEU  68           H        LEU  68   3.405   2.689  -6.601
  490    HA   LEU  68           HA       LEU  68   4.609   5.323  -6.370
  491   1HB   LEU  68          1HB       LEU  68   3.626   5.364  -4.140
  492   2HB   LEU  68          2HB       LEU  68   2.422   5.015  -5.359
  493    HG   LEU  68           HG       LEU  68   3.247   2.524  -4.518
  494   1HD1  LEU  68          1HD1      LEU  68   4.455   3.484  -2.671
  495   2HD1  LEU  68          2HD1      LEU  68   3.065   2.563  -2.094
  496   3HD1  LEU  68          3HD1      LEU  68   3.008   4.330  -2.125
  497   1HD2  LEU  68          1HD2      LEU  68   1.048   3.195  -5.111
  498   2HD2  LEU  68          2HD2      LEU  68   0.898   4.183  -3.647
  499   3HD2  LEU  68          3HD2      LEU  68   1.030   2.417  -3.530
  500    H    VAL  69           H        VAL  69   5.677   2.555  -6.683
  501    HA   VAL  69           HA       VAL  69   7.326   1.711  -4.630
  502    HB   VAL  69           HB       VAL  69   8.107   1.686  -7.552
  503   1HG1  VAL  69          1HG1      VAL  69   9.884   0.970  -6.141
  504   2HG1  VAL  69          2HG1      VAL  69   9.230  -0.428  -6.997
  505   3HG1  VAL  69          3HG1      VAL  69   8.826  -0.161  -5.300
  506   1HG2  VAL  69          1HG2      VAL  69   6.953  -0.487  -7.738
  507   2HG2  VAL  69          2HG2      VAL  69   5.843   0.843  -7.414
  508   3HG2  VAL  69          3HG2      VAL  69   6.304  -0.255  -6.114
  509    H    GLY  70           H        GLY  70   8.218   3.469  -3.568
  510   1HA   GLY  70          1HA       GLY  70  10.456   4.326  -3.179
  511   2HA   GLY  70          2HA       GLY  70  10.571   4.638  -4.904
  512    H    VAL  71           H        VAL  71   7.563   5.491  -3.533
  513    HA   VAL  71           HA       VAL  71   8.259   8.274  -3.922
  514    HB   VAL  71           HB       VAL  71   5.917   8.810  -3.726
  515   1HG1  VAL  71          1HG1      VAL  71   5.035   7.537  -5.600
  516   2HG1  VAL  71          2HG1      VAL  71   6.349   6.375  -5.418
  517   3HG1  VAL  71          3HG1      VAL  71   6.705   8.044  -5.862
  518   1HG2  VAL  71          1HG2      VAL  71   5.473   5.903  -3.021
  519   2HG2  VAL  71          2HG2      VAL  71   4.213   7.128  -3.252
  520   3HG2  VAL  71          3HG2      VAL  71   5.346   7.269  -1.915
  521    H    THR  72           H        THR  72   7.057   9.826  -2.332
  522    HA   THR  72           HA       THR  72   8.067   9.203   0.322
  523    HB   THR  72           HB       THR  72   7.445  11.570   0.785
  524    HG1  THR  72           HG1      THR  72   7.310  12.207  -1.915
  525   1HG2  THR  72          1HG2      THR  72   9.347  11.104  -1.513
  526   2HG2  THR  72          2HG2      THR  72   9.696  10.975   0.220
  527   3HG2  THR  72          3HG2      THR  72   9.307  12.547  -0.484
  528    H    GLN  73           H        GLN  73   6.674  10.220   2.065
  529    HA   GLN  73           HA       GLN  73   4.285   8.704   2.122
  530   1HB   GLN  73          1HB       GLN  73   4.021   9.333   4.382
  531   2HB   GLN  73          2HB       GLN  73   5.728   9.564   4.099
  532   1HG   GLN  73          1HG       GLN  73   3.731  11.745   3.941
  533   2HG   GLN  73          2HG       GLN  73   4.584  11.339   5.423
  534   1HE2  GLN  73          1HE2      GLN  73   7.091  10.676   4.035
  535   2HE2  GLN  73          2HE2      GLN  73   7.751  12.178   3.570
  536    H    ASN  74           H        ASN  74   4.995  11.864   1.041
  537    HA   ASN  74           HA       ASN  74   2.460  13.081   1.246
  538   1HB   ASN  74          1HB       ASN  74   4.382  13.531  -1.050
  539   2HB   ASN  74          2HB       ASN  74   3.150  14.631  -0.473
  540   1HD2  ASN  74          1HD2      ASN  74   6.319  13.460  -0.143
  541   2HD2  ASN  74          2HD2      ASN  74   6.829  14.596   1.063
  542    H    PHE  75           H        PHE  75   4.089  11.332  -1.296
  543    HA   PHE  75           HA       PHE  75   2.007  11.535  -3.127
  544   1HB   PHE  75          1HB       PHE  75   4.420  11.138  -3.673
  545   2HB   PHE  75          2HB       PHE  75   4.203   9.501  -3.080
  546    HD1  PHE  75           HD1      PHE  75   2.779   7.899  -4.317
  547    HD2  PHE  75           HD2      PHE  75   3.564  11.800  -5.817
  548    HE1  PHE  75           HE1      PHE  75   2.038   7.182  -6.490
  549    HE2  PHE  75           HE2      PHE  75   2.796  11.092  -8.040
  550    HZ   PHE  75           HZ       PHE  75   2.030   8.776  -8.395
  551    H    ALA  76           H        ALA  76   3.177   8.894  -1.038
  552    HA   ALA  76           HA       ALA  76   1.347   6.986  -1.898
  553   1HB   ALA  76          1HB       ALA  76   3.384   6.456  -0.693
  554   2HB   ALA  76          2HB       ALA  76   1.968   5.707   0.048
  555   3HB   ALA  76          3HB       ALA  76   2.701   7.140   0.784
  556    H    ALA  77           H        ALA  77   1.094   9.265   0.866
  557    HA   ALA  77           HA       ALA  77  -1.366   8.232   1.827
  558   1HB   ALA  77          1HB       ALA  77  -0.255  11.021   2.146
  559   2HB   ALA  77          2HB       ALA  77   0.090   9.653   3.204
  560   3HB   ALA  77          3HB       ALA  77  -1.547  10.306   3.109
  561    H    THR  78           H        THR  78  -0.608  10.093  -0.857
  562    HA   THR  78           HA       THR  78  -3.234  11.213  -1.149
  563    HB   THR  78           HB       THR  78  -0.764  11.237  -2.896
  564    HG1  THR  78           HG1      THR  78  -0.465  12.530  -1.258
  565   1HG2  THR  78          1HG2      THR  78  -3.403  12.658  -3.347
  566   2HG2  THR  78          2HG2      THR  78  -2.778  11.293  -4.275
  567   3HG2  THR  78          3HG2      THR  78  -1.939  12.846  -4.331
  568    H    VAL  79           H        VAL  79  -1.275   8.638  -2.590
  569    HA   VAL  79           HA       VAL  79  -3.143   7.789  -4.514
  570    HB   VAL  79           HB       VAL  79  -1.141   5.982  -3.112
  571   1HG1  VAL  79          1HG1      VAL  79  -2.827   4.794  -4.410
  572   2HG1  VAL  79          2HG1      VAL  79  -1.243   4.654  -5.147
  573   3HG1  VAL  79          3HG1      VAL  79  -2.434   5.759  -5.827
  574   1HG2  VAL  79          1HG2      VAL  79  -0.818   7.765  -5.502
  575   2HG2  VAL  79          2HG2      VAL  79   0.333   6.518  -5.007
  576   3HG2  VAL  79          3HG2      VAL  79   0.019   7.901  -3.956
  577    H    LEU  80           H        LEU  80  -2.474   6.494  -1.272
  578    HA   LEU  80           HA       LEU  80  -4.629   4.649  -1.308
  579   1HB   LEU  80          1HB       LEU  80  -2.964   5.710   0.973
  580   2HB   LEU  80          2HB       LEU  80  -4.230   4.532   1.210
  581    HG   LEU  80           HG       LEU  80  -2.177   3.356   1.212
  582   1HD1  LEU  80          1HD1      LEU  80  -3.376   2.937  -1.498
  583   2HD1  LEU  80          2HD1      LEU  80  -3.981   2.278   0.014
  584   3HD1  LEU  80          3HD1      LEU  80  -2.392   1.792  -0.583
  585   1HD2  LEU  80          1HD2      LEU  80  -0.503   3.434  -0.532
  586   2HD2  LEU  80          2HD2      LEU  80  -0.787   5.063   0.084
  587   3HD2  LEU  80          3HD2      LEU  80  -1.486   4.567  -1.456
  588    H    ARG  81           H        ARG  81  -4.758   7.855  -1.146
  589    HA   ARG  81           HA       ARG  81  -7.220   8.113   0.450
  590   1HB   ARG  81          1HB       ARG  81  -5.475   9.789   0.622
  591   2HB   ARG  81          2HB       ARG  81  -5.542  10.038  -1.111
  592   1HG   ARG  81          1HG       ARG  81  -7.941  10.735  -0.778
  593   2HG   ARG  81          2HG       ARG  81  -7.575  10.775   0.955
  594   1HD   ARG  81          1HD       ARG  81  -6.124  12.183  -1.212
  595   2HD   ARG  81          2HD       ARG  81  -7.241  12.965  -0.074
  596    HE   ARG  81           HE       ARG  81  -5.472  11.776   1.553
  597   1HH1  ARG  81          1HH1      ARG  81  -4.990  14.098  -1.103
  598   2HH1  ARG  81          2HH1      ARG  81  -3.489  14.639  -0.540
  599   1HH2  ARG  81          1HH2      ARG  81  -3.419  12.515   2.318
  600   2HH2  ARG  81          2HH2      ARG  81  -2.564  13.712   1.471
  601    H    ASN  82           H        ASN  82  -5.922   8.405  -2.780
  602    HA   ASN  82           HA       ASN  82  -8.379   9.269  -3.988
  603   1HB   ASN  82          1HB       ASN  82  -5.558   8.985  -4.858
  604   2HB   ASN  82          2HB       ASN  82  -6.835   8.999  -6.071
  605   1HD2  ASN  82          1HD2      ASN  82  -5.393  10.807  -3.474
  606   2HD2  ASN  82          2HD2      ASN  82  -6.046  12.338  -3.966
  607    H    THR  83           H        THR  83  -7.517   6.424  -3.007
  608    HA   THR  83           HA       THR  83  -7.802   4.662  -5.146
  609    HB   THR  83           HB       THR  83  -8.505   3.122  -3.172
  610    HG1  THR  83           HG1      THR  83  -8.878   5.190  -1.900
  611   1HG2  THR  83          1HG2      THR  83  -6.125   2.946  -2.539
  612   2HG2  THR  83          2HG2      THR  83  -5.818   4.505  -3.296
  613   3HG2  THR  83          3HG2      THR  83  -6.310   3.128  -4.281
  614    H    LYS  84           H        LYS  84  -9.678   2.904  -4.879
  615    HA   LYS  84           HA       LYS  84 -12.255   4.240  -4.827
  616   1HB   LYS  84          1HB       LYS  84 -12.748   3.273  -7.021
  617   2HB   LYS  84          2HB       LYS  84 -11.483   4.478  -7.031
  618   1HG   LYS  84          1HG       LYS  84  -9.796   2.741  -7.141
  619   2HG   LYS  84          2HG       LYS  84 -11.076   1.512  -7.160
  620   1HD   LYS  84          1HD       LYS  84 -12.058   2.549  -8.996
  621   2HD   LYS  84          2HD       LYS  84 -10.790   3.772  -9.043
  622   1HE   LYS  84          1HE       LYS  84  -9.090   1.957  -9.391
  623   2HE   LYS  84          2HE       LYS  84 -10.403   0.787  -9.493
  624   1HZ   LYS  84          1HZ       LYS  84  -9.935   3.053 -11.338
  625   2HZ   LYS  84          2HZ       LYS  84 -11.220   1.989 -11.465
  626   3HZ   LYS  84          3HZ       LYS  84  -9.632   1.439 -11.683
  627    H    GLY  85           H        GLY  85 -13.519   1.974  -6.057
  628   1HA   GLY  85          1HA       GLY  85 -13.814   0.280  -3.788
  629   2HA   GLY  85          2HA       GLY  85 -14.580   0.066  -5.356
  630    H    ASN  86           H        ASN  86 -12.967  -0.628  -7.121
  631    HA   ASN  86           HA       ASN  86 -11.631  -2.979  -6.060
  632   1HB   ASN  86          1HB       ASN  86 -12.363  -2.215  -8.893
  633   2HB   ASN  86          2HB       ASN  86 -11.289  -3.556  -8.531
  634   1HD2  ASN  86          1HD2      ASN  86 -14.587  -2.413  -8.426
  635   2HD2  ASN  86          2HD2      ASN  86 -15.276  -3.943  -8.029
  636    H    VAL  87           H        VAL  87  -9.749  -2.674  -5.368
  637    HA   VAL  87           HA       VAL  87  -7.933  -0.854  -6.827
  638    HB   VAL  87           HB       VAL  87  -7.506  -1.682  -4.016
  639   1HG1  VAL  87          1HG1      VAL  87  -5.716  -0.619  -5.095
  640   2HG1  VAL  87          2HG1      VAL  87  -6.360   0.463  -3.852
  641   3HG1  VAL  87          3HG1      VAL  87  -6.725   0.752  -5.564
  642   1HG2  VAL  87          1HG2      VAL  87  -9.320   0.574  -4.845
  643   2HG2  VAL  87          2HG2      VAL  87  -8.692   0.300  -3.208
  644   3HG2  VAL  87          3HG2      VAL  87  -9.722  -0.917  -3.980
  645    H    ARG  88           H        ARG  88  -6.140  -1.772  -7.578
  646    HA   ARG  88           HA       ARG  88  -5.436  -4.430  -6.649
  647   1HB   ARG  88          1HB       ARG  88  -4.657  -2.809  -9.054
  648   2HB   ARG  88          2HB       ARG  88  -3.830  -4.301  -8.615
  649   1HG   ARG  88          1HG       ARG  88  -5.736  -5.604  -8.953
  650   2HG   ARG  88          2HG       ARG  88  -6.806  -4.209  -8.891
  651   1HD   ARG  88          1HD       ARG  88  -6.625  -5.037 -11.116
  652   2HD   ARG  88          2HD       ARG  88  -5.908  -3.433 -10.983
  653    HE   ARG  88           HE       ARG  88  -3.933  -5.458 -10.732
  654   1HH1  ARG  88          1HH1      ARG  88  -5.932  -3.827 -13.144
  655   2HH1  ARG  88          2HH1      ARG  88  -4.894  -4.173 -14.448
  656   1HH2  ARG  88          1HH2      ARG  88  -2.514  -5.922 -12.505
  657   2HH2  ARG  88          2HH2      ARG  88  -2.880  -5.407 -14.086
  658    H    PHE  89           H        PHE  89  -4.428  -4.269  -4.834
  659    HA   PHE  89           HA       PHE  89  -2.295  -2.313  -4.448
  660   1HB   PHE  89          1HB       PHE  89  -3.335  -4.494  -2.615
  661   2HB   PHE  89          2HB       PHE  89  -2.116  -3.317  -2.203
  662    HD1  PHE  89           HD1      PHE  89  -2.695  -1.166  -1.498
  663    HD2  PHE  89           HD2      PHE  89  -5.671  -3.839  -2.866
  664    HE1  PHE  89           HE1      PHE  89  -4.415   0.291  -0.547
  665    HE2  PHE  89           HE2      PHE  89  -7.414  -2.357  -1.918
  666    HZ   PHE  89           HZ       PHE  89  -6.785  -0.316  -0.765
  667    H    VAL  90           H        VAL  90  -0.475  -2.972  -5.451
  668    HA   VAL  90           HA       VAL  90   0.052  -5.824  -5.415
  669    HB   VAL  90           HB       VAL  90   1.598  -3.668  -6.892
  670   1HG1  VAL  90          1HG1      VAL  90   1.708  -6.674  -7.133
  671   2HG1  VAL  90          2HG1      VAL  90   2.945  -5.636  -6.423
  672   3HG1  VAL  90          3HG1      VAL  90   2.594  -5.533  -8.147
  673   1HG2  VAL  90          1HG2      VAL  90  -0.682  -3.864  -7.720
  674   2HG2  VAL  90          2HG2      VAL  90  -0.451  -5.599  -7.966
  675   3HG2  VAL  90          3HG2      VAL  90   0.484  -4.435  -8.913
  676    H    ILE  91           H        ILE  91   0.477  -5.905  -3.338
  677    HA   ILE  91           HA       ILE  91   2.602  -4.373  -2.106
  678    HB   ILE  91           HB       ILE  91   0.423  -6.233  -1.132
  679   1HG1  ILE  91          1HG1      ILE  91   0.950  -3.339  -0.598
  680   2HG1  ILE  91          2HG1      ILE  91  -0.187  -3.908  -1.806
  681   1HG2  ILE  91          1HG2      ILE  91   1.093  -5.796   1.209
  682   2HG2  ILE  91          2HG2      ILE  91   2.506  -4.928   0.635
  683   3HG2  ILE  91          3HG2      ILE  91   2.355  -6.652   0.324
  684   1HD1  ILE  91          1HD1      ILE  91  -1.276  -3.207   0.108
  685   2HD1  ILE  91          2HD1      ILE  91  -0.298  -4.300   1.119
  686   3HD1  ILE  91          3HD1      ILE  91  -1.450  -4.963  -0.088
  687    H    GLY  92           H        GLY  92   4.224  -5.602  -0.897
  688   1HA   GLY  92          1HA       GLY  92   4.534  -8.283  -1.942
  689   2HA   GLY  92          2HA       GLY  92   5.868  -7.149  -2.085
  690    H    ARG  93           H        ARG  93   5.741  -9.608  -0.626
  691    HA   ARG  93           HA       ARG  93   6.255  -8.546   2.091
  692   1HB   ARG  93          1HB       ARG  93   4.499 -10.567   1.454
  693   2HB   ARG  93          2HB       ARG  93   5.964 -11.444   1.898
  694   1HG   ARG  93          1HG       ARG  93   5.672  -9.457   3.843
  695   2HG   ARG  93          2HG       ARG  93   4.054 -10.096   3.571
  696   1HD   ARG  93          1HD       ARG  93   5.009 -11.365   5.272
  697   2HD   ARG  93          2HD       ARG  93   5.047 -12.372   3.818
  698    HE   ARG  93           HE       ARG  93   7.459 -10.861   4.343
  699   1HH1  ARG  93          1HH1      ARG  93   5.786 -13.912   5.007
  700   2HH1  ARG  93          2HH1      ARG  93   7.224 -14.783   5.300
  701   1HH2  ARG  93          1HH2      ARG  93   9.428 -12.104   4.715
  702   2HH2  ARG  93          2HH2      ARG  93   9.310 -13.738   5.157
  703    H    GLU  94           H        GLU  94   8.190  -8.930   2.956
  704    HA   GLU  94           HA       GLU  94  10.256  -9.610   1.135
  705   1HB   GLU  94          1HB       GLU  94  11.522  -8.950   3.424
  706   2HB   GLU  94          2HB       GLU  94  10.966  -7.805   2.212
  707   1HG   GLU  94          1HG       GLU  94  10.435  -7.055   4.483
  708   2HG   GLU  94          2HG       GLU  94   8.991  -7.295   3.520
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1  17.359 -13.058   2.425
    2   2H    GLY   1          2H        GLY   1  16.659 -14.294   1.508
    3   3H    GLY   1          3H        GLY   1  15.670 -13.259   2.411
    4   1HA   GLY   1          1HA       GLY   1  16.306 -11.416   1.024
    5   2HA   GLY   1          2HA       GLY   1  17.355 -12.496   0.106
    6    H    HIS   2           H        HIS   2  14.004 -11.830   1.006
    7    HA   HIS   2           HA       HIS   2  13.167 -12.784  -1.553
    8   1HB   HIS   2          1HB       HIS   2  13.236 -14.873  -0.217
    9   2HB   HIS   2          2HB       HIS   2  12.182 -14.143   0.977
   10    HD1  HIS   2           HD1      HIS   2  12.145 -15.922  -2.282
   11    HD2  HIS   2           HD2      HIS   2   9.487 -13.846   0.139
   12    HE1  HIS   2           HE1      HIS   2   9.840 -16.499  -3.113
   13    H    MET   3           H        MET   3  11.385 -11.773  -2.199
   14    HA   MET   3           HA       MET   3   9.391 -10.795  -0.443
   15   1HB   MET   3          1HB       MET   3  10.953  -8.884  -0.313
   16   2HB   MET   3          2HB       MET   3  10.957  -8.772  -2.071
   17   1HG   MET   3          1HG       MET   3   8.575  -8.254  -2.071
   18   2HG   MET   3          2HG       MET   3   8.510  -8.398  -0.326
   19   1HE   MET   3          1HE       MET   3   9.829  -6.740   1.315
   20   2HE   MET   3          2HE       MET   3  10.742  -5.333   0.773
   21   3HE   MET   3          3HE       MET   3  11.350  -6.954   0.447
   22    H    GLU   4           H        GLU   4   7.722 -11.492  -1.440
   23    HA   GLU   4           HA       GLU   4   7.754 -11.706  -4.353
   24   1HB   GLU   4          1HB       GLU   4   7.251 -13.701  -2.933
   25   2HB   GLU   4          2HB       GLU   4   5.852 -12.783  -2.341
   26   1HG   GLU   4          1HG       GLU   4   4.812 -12.814  -4.457
   27   2HG   GLU   4          2HG       GLU   4   6.266 -13.401  -5.246
   28    H    LEU   5           H        LEU   5   6.840 -10.054  -5.380
   29    HA   LEU   5           HA       LEU   5   4.917  -8.346  -4.055
   30   1HB   LEU   5          1HB       LEU   5   6.042  -8.193  -6.855
   31   2HB   LEU   5          2HB       LEU   5   5.067  -6.973  -6.078
   32    HG   LEU   5           HG       LEU   5   7.184  -6.104  -6.007
   33   1HD1  LEU   5          11HD      LEU   5   7.893  -5.969  -3.746
   34   2HD1  LEU   5          12HD      LEU   5   7.016  -7.444  -3.382
   35   3HD1  LEU   5          13HD      LEU   5   6.120  -5.986  -3.845
   36   1HD2  LEU   5          21HD      LEU   5   8.304  -8.769  -5.158
   37   2HD2  LEU   5          22HD      LEU   5   9.234  -7.283  -5.331
   38   3HD2  LEU   5          23HD      LEU   5   8.477  -8.017  -6.743
   39    H    PHE   6           H        PHE   6   2.741  -8.506  -4.370
   40    HA   PHE   6           HA       PHE   6   1.806  -9.928  -6.696
   41   1HB   PHE   6          1HB       PHE   6   0.127 -11.051  -5.124
   42   2HB   PHE   6          2HB       PHE   6   1.725 -11.781  -5.266
   43    HD1  PHE   6           HD1      PHE   6   3.130 -11.780  -3.310
   44    HD2  PHE   6           HD2      PHE   6  -0.649  -9.883  -3.257
   45    HE1  PHE   6           HE1      PHE   6   3.268 -11.645  -0.886
   46    HE2  PHE   6           HE2      PHE   6  -0.547  -9.727  -0.785
   47    HZ   PHE   6           HZ       PHE   6   1.419 -10.610   0.404
   48    HA   PRO   7           HA       PRO   7  -1.313  -6.777  -6.581
   49   1HB   PRO   7          1HB       PRO   7  -2.909  -7.705  -8.434
   50   2HB   PRO   7          2HB       PRO   7  -1.309  -7.088  -8.831
   51   1HG   PRO   7          1HG       PRO   7  -2.210  -9.948  -8.556
   52   2HG   PRO   7          2HG       PRO   7  -1.117  -9.252  -9.775
   53   1HD   PRO   7          1HD       PRO   7  -0.350 -10.626  -7.496
   54   2HD   PRO   7          2HD       PRO   7   0.671  -9.456  -8.373
   55    H    VAL   8           H        VAL   8  -2.804  -6.558  -5.093
   56    HA   VAL   8           HA       VAL   8  -4.768  -8.691  -4.756
   57    HB   VAL   8           HB       VAL   8  -4.066  -6.528  -2.761
   58   1HG1  VAL   8          11HG      VAL   8  -5.744  -8.996  -2.412
   59   2HG1  VAL   8          12HG      VAL   8  -6.309  -7.323  -2.478
   60   3HG1  VAL   8          13HG      VAL   8  -5.297  -7.856  -1.139
   61   1HG2  VAL   8          21HG      VAL   8  -3.190  -9.400  -2.785
   62   2HG2  VAL   8          22HG      VAL   8  -2.910  -8.245  -1.467
   63   3HG2  VAL   8          23HG      VAL   8  -2.199  -7.967  -3.072
   64    H    GLU   9           H        GLU   9  -6.370  -7.986  -6.178
   65    HA   GLU   9           HA       GLU   9  -7.098  -5.201  -6.085
   66   1HB   GLU   9          1HB       GLU   9  -7.163  -6.472  -8.241
   67   2HB   GLU   9          2HB       GLU   9  -8.495  -7.421  -7.582
   68   1HG   GLU   9          1HG       GLU   9  -9.804  -5.369  -7.306
   69   2HG   GLU   9          2HG       GLU   9  -8.486  -4.446  -8.017
   70    H    LEU  10           H        LEU  10  -8.224  -4.518  -4.505
   71    HA   LEU  10           HA       LEU  10 -10.008  -6.336  -3.049
   72   1HB   LEU  10          1HB       LEU  10  -8.081  -4.607  -2.208
   73   2HB   LEU  10          2HB       LEU  10  -9.481  -3.559  -2.173
   74    HG   LEU  10           HG       LEU  10  -9.162  -4.374   0.018
   75   1HD1  LEU  10          11HD      LEU  10 -11.361  -6.027  -1.164
   76   2HD1  LEU  10          12HD      LEU  10 -11.480  -4.341  -0.688
   77   3HD1  LEU  10          13HD      LEU  10 -11.176  -5.580   0.534
   78   1HD2  LEU  10          21HD      LEU  10  -9.023  -7.146  -1.137
   79   2HD2  LEU  10          22HD      LEU  10  -9.009  -6.749   0.580
   80   3HD2  LEU  10          23HD      LEU  10  -7.684  -6.221  -0.455
   81    H    GLU  11           H        GLU  11 -12.223  -5.763  -2.949
   82    HA   GLU  11           HA       GLU  11 -12.967  -3.385  -4.477
   83   1HB   GLU  11          1HB       GLU  11 -13.893  -5.479  -5.418
   84   2HB   GLU  11          2HB       GLU  11 -14.670  -5.824  -3.873
   85   1HG   GLU  11          1HG       GLU  11 -15.936  -3.689  -4.141
   86   2HG   GLU  11          2HG       GLU  11 -15.256  -3.554  -5.759
   87    H    LYS  12           H        LYS  12 -12.734  -1.986  -2.864
   88    HA   LYS  12           HA       LYS  12 -13.938  -2.449  -0.333
   89   1HB   LYS  12          1HB       LYS  12 -12.392  -0.136  -1.395
   90   2HB   LYS  12          2HB       LYS  12 -13.065  -0.071   0.202
   91   1HG   LYS  12          1HG       LYS  12 -11.638  -2.478   0.158
   92   2HG   LYS  12          2HG       LYS  12 -10.779  -1.349  -0.865
   93   1HD   LYS  12          1HD       LYS  12  -9.882  -1.180   1.379
   94   2HD   LYS  12          2HD       LYS  12 -10.676   0.286   0.823
   95   1HE   LYS  12          1HE       LYS  12 -12.165  -1.622   2.664
   96   2HE   LYS  12          2HE       LYS  12 -11.039  -0.520   3.333
   97   1HZ   LYS  12          1HZ       LYS  12 -12.820   0.864   3.395
   98   2HZ   LYS  12          2HZ       LYS  12 -13.681  -0.013   2.347
   99   3HZ   LYS  12          3HZ       LYS  12 -12.570   1.143   1.750
  100    H    ASP  13           H        ASP  13 -14.740  -0.266   0.567
  101    HA   ASP  13           HA       ASP  13 -17.467  -0.284  -0.057
  102   1HB   ASP  13          1HB       ASP  13 -15.918   1.539   1.769
  103   2HB   ASP  13          2HB       ASP  13 -17.620   1.111   1.885
  104    H    GLU  14           H        GLU  14 -18.619   1.830  -0.062
  105    HA   GLU  14           HA       GLU  14 -18.106   3.228  -2.419
  106   1HB   GLU  14          1HB       GLU  14 -19.912   4.775  -1.601
  107   2HB   GLU  14          2HB       GLU  14 -20.342   3.072  -1.675
  108   1HG   GLU  14          1HG       GLU  14 -20.038   2.855   0.714
  109   2HG   GLU  14          2HG       GLU  14 -19.489   4.524   0.816
  110    H    ASP  15           H        ASP  15 -17.069   3.870   0.795
  111    HA   ASP  15           HA       ASP  15 -16.313   6.589   0.442
  112   1HB   ASP  15          1HB       ASP  15 -16.467   5.717   2.673
  113   2HB   ASP  15          2HB       ASP  15 -15.305   4.447   2.312
  114    H    GLY  16           H        GLY  16 -14.675   3.548   0.055
  115   1HA   GLY  16          1HA       GLY  16 -13.055   3.365  -1.778
  116   2HA   GLY  16          2HA       GLY  16 -12.406   4.930  -1.235
  117    H    LEU  17           H        LEU  17 -10.768   4.824   0.152
  118    HA   LEU  17           HA       LEU  17 -10.170   2.128   1.136
  119   1HB   LEU  17          1HB       LEU  17  -8.569   3.256  -0.552
  120   2HB   LEU  17          2HB       LEU  17  -8.196   4.311   0.786
  121    HG   LEU  17           HG       LEU  17  -7.100   2.681   1.943
  122   1HD1  LEU  17          11HD      LEU  17  -8.747   0.894   1.822
  123   2HD1  LEU  17          12HD      LEU  17  -7.195   0.269   1.270
  124   3HD1  LEU  17          13HD      LEU  17  -8.457   0.706   0.104
  125   1HD2  LEU  17          21HD      LEU  17  -6.679   2.139  -0.969
  126   2HD2  LEU  17          22HD      LEU  17  -5.571   1.751   0.347
  127   3HD2  LEU  17          23HD      LEU  17  -5.943   3.438  -0.026
  128    H    GLY  18           H        GLY  18  -9.385   5.469   1.996
  129   1HA   GLY  18          1HA       GLY  18  -9.324   6.533   4.000
  130   2HA   GLY  18          2HA       GLY  18 -10.475   5.332   4.567
  131    H    ILE  19           H        ILE  19  -7.207   4.636   3.413
  132    HA   ILE  19           HA       ILE  19  -6.657   3.736   6.146
  133    HB   ILE  19           HB       ILE  19  -4.889   2.334   5.322
  134   1HG1  ILE  19          11HG      ILE  19  -5.451   3.511   2.577
  135   2HG1  ILE  19          12HG      ILE  19  -4.008   3.747   3.547
  136   1HG2  ILE  19          21HG      ILE  19  -7.061   1.362   5.283
  137   2HG2  ILE  19          22HG      ILE  19  -6.201   0.808   3.844
  138   3HG2  ILE  19          23HG      ILE  19  -7.420   2.080   3.727
  139   1HD1  ILE  19          11HD      ILE  19  -4.940   1.163   2.359
  140   2HD1  ILE  19          12HD      ILE  19  -3.490   1.354   3.361
  141   3HD1  ILE  19          13HD      ILE  19  -3.603   2.154   1.784
  142    H    SER  20           H        SER  20  -4.065   3.780   6.511
  143    HA   SER  20           HA       SER  20  -3.192   6.528   5.942
  144   1HB   SER  20          1HB       SER  20  -2.957   5.105   8.595
  145   2HB   SER  20          2HB       SER  20  -2.558   6.785   8.254
  146    HG   SER  20           HG       SER  20  -4.758   7.157   7.850
  147    H    ILE  21           H        ILE  21  -0.975   6.768   5.891
  148    HA   ILE  21           HA       ILE  21   0.517   4.248   5.610
  149    HB   ILE  21           HB       ILE  21   1.851   5.398   3.888
  150   1HG1  ILE  21          11HG      ILE  21   0.523   7.502   2.870
  151   2HG1  ILE  21          12HG      ILE  21  -0.004   7.653   4.519
  152   1HG2  ILE  21          21HG      ILE  21   0.055   3.944   3.201
  153   2HG2  ILE  21          22HG      ILE  21   0.178   5.312   2.093
  154   3HG2  ILE  21          23HG      ILE  21  -1.098   5.274   3.312
  155   1HD1  ILE  21          11HD      ILE  21   2.871   7.648   3.665
  156   2HD1  ILE  21          12HD      ILE  21   2.258   7.903   5.289
  157   3HD1  ILE  21          13HD      ILE  21   1.902   9.058   4.017
  158    H    ILE  22           H        ILE  22   2.859   4.468   6.000
  159    HA   ILE  22           HA       ILE  22   3.394   6.788   7.578
  160    HB   ILE  22           HB       ILE  22   3.148   5.042   9.190
  161   1HG1  ILE  22          11HG      ILE  22   6.096   5.642   8.859
  162   2HG1  ILE  22          12HG      ILE  22   4.917   6.722   9.588
  163   1HG2  ILE  22          21HG      ILE  22   3.529   3.106   7.823
  164   2HG2  ILE  22          22HG      ILE  22   4.565   3.042   9.251
  165   3HG2  ILE  22          23HG      ILE  22   5.244   3.508   7.686
  166   1HD1  ILE  22          11HD      ILE  22   6.254   5.554  11.255
  167   2HD1  ILE  22          12HD      ILE  22   5.674   4.004  10.630
  168   3HD1  ILE  22          13HD      ILE  22   4.547   5.132  11.375
  169    H    GLY  23           H        GLY  23   5.112   7.904   7.017
  170   1HA   GLY  23          1HA       GLY  23   6.653   6.947   4.773
  171   2HA   GLY  23          2HA       GLY  23   6.666   8.577   5.433
  172    H    MET  24           H        MET  24   8.221   5.608   5.273
  173    HA   MET  24           HA       MET  24  10.390   6.689   6.857
  174   1HB   MET  24          1HB       MET  24  10.808   4.325   7.794
  175   2HB   MET  24          2HB       MET  24   9.637   5.358   8.591
  176   1HG   MET  24          1HG       MET  24   7.850   4.126   7.677
  177   2HG   MET  24          2HG       MET  24   8.882   3.186   6.623
  178   1HE   MET  24          1HE       MET  24   7.795   3.899  10.313
  179   2HE   MET  24          2HE       MET  24   9.537   4.185  10.420
  180   3HE   MET  24          3HE       MET  24   8.817   2.794  11.229
  181    H    GLY  25           H        GLY  25  12.326   5.136   6.733
  182   1HA   GLY  25          1HA       GLY  25  12.597   4.542   3.857
  183   2HA   GLY  25          2HA       GLY  25  13.863   5.354   4.776
  184    H    VAL  26           H        VAL  26  12.386   2.400   3.995
  185    HA   VAL  26           HA       VAL  26  13.846   0.989   6.033
  186    HB   VAL  26           HB       VAL  26  11.577   0.275   5.770
  187   1HG1  VAL  26          11HG      VAL  26  11.224   0.925   3.474
  188   2HG1  VAL  26          12HG      VAL  26  10.719  -0.751   3.724
  189   3HG1  VAL  26          13HG      VAL  26  12.261  -0.388   2.934
  190   1HG2  VAL  26          21HG      VAL  26  13.166  -1.483   6.380
  191   2HG2  VAL  26          22HG      VAL  26  13.428  -1.843   4.678
  192   3HG2  VAL  26          23HG      VAL  26  11.854  -2.147   5.405
  193    H    GLY  27           H        GLY  27  15.870   1.087   5.571
  194   1HA   GLY  27          1HA       GLY  27  17.825   0.101   4.922
  195   2HA   GLY  27          2HA       GLY  27  16.883  -1.030   3.994
  196    H    ALA  28           H        ALA  28  18.133   2.270   3.903
  197    HA   ALA  28           HA       ALA  28  18.198   2.213   1.005
  198   1HB   ALA  28          1HB       ALA  28  17.772   4.343   2.156
  199   2HB   ALA  28          2HB       ALA  28  19.276   4.431   1.237
  200   3HB   ALA  28          3HB       ALA  28  19.321   4.204   2.986
  201    H    ASP  29           H        ASP  29  20.053   1.363   3.671
  202    HA   ASP  29           HA       ASP  29  22.561   1.015   2.193
  203   1HB   ASP  29          1HB       ASP  29  22.737   2.128   4.358
  204   2HB   ASP  29          2HB       ASP  29  21.828   0.846   5.131
  205    H    ALA  30           H        ALA  30  19.879  -0.602   2.261
  206    HA   ALA  30           HA       ALA  30  20.979  -3.216   3.019
  207   1HB   ALA  30          1HB       ALA  30  18.119  -2.438   2.585
  208   2HB   ALA  30          2HB       ALA  30  18.931  -2.567   4.145
  209   3HB   ALA  30          3HB       ALA  30  18.695  -4.006   3.148
  210    H    GLY  31           H        GLY  31  21.073  -1.615   0.299
  211   1HA   GLY  31          1HA       GLY  31  21.748  -2.665  -1.741
  212   2HA   GLY  31          2HA       GLY  31  20.962  -4.113  -1.170
  213    H    LEU  32           H        LEU  32  18.445  -3.398  -0.746
  214    HA   LEU  32           HA       LEU  32  17.543  -3.477  -3.446
  215   1HB   LEU  32          1HB       LEU  32  15.893  -3.212  -0.961
  216   2HB   LEU  32          2HB       LEU  32  15.335  -3.781  -2.520
  217    HG   LEU  32           HG       LEU  32  17.148  -5.160  -0.556
  218   1HD1  LEU  32          11HD      LEU  32  14.812  -5.390  -0.099
  219   2HD1  LEU  32          12HD      LEU  32  15.491  -6.928  -0.626
  220   3HD1  LEU  32          13HD      LEU  32  14.514  -5.971  -1.740
  221   1HD2  LEU  32          21HD      LEU  32  18.150  -5.512  -2.705
  222   2HD2  LEU  32          22HD      LEU  32  16.601  -5.982  -3.417
  223   3HD2  LEU  32          23HD      LEU  32  17.366  -7.009  -2.194
  224    H    GLU  33           H        GLU  33  17.205  -1.186  -0.831
  225    HA   GLU  33           HA       GLU  33  16.654   0.980  -0.689
  226   1HB   GLU  33          1HB       GLU  33  17.748   1.114  -3.494
  227   2HB   GLU  33          2HB       GLU  33  17.459   2.484  -2.439
  228   1HG   GLU  33          1HG       GLU  33  19.132   1.643  -0.887
  229   2HG   GLU  33          2HG       GLU  33  19.416   0.264  -1.954
  230    H    LYS  34           H        LYS  34  14.458   0.429  -0.630
  231    HA   LYS  34           HA       LYS  34  13.001   1.474  -2.933
  232   1HB   LYS  34          1HB       LYS  34  11.365  -0.228  -2.953
  233   2HB   LYS  34          2HB       LYS  34  12.900  -1.070  -2.915
  234   1HG   LYS  34          1HG       LYS  34  11.084  -0.613  -0.574
  235   2HG   LYS  34          2HG       LYS  34  11.204  -2.100  -1.505
  236   1HD   LYS  34          1HD       LYS  34  13.447  -2.458  -0.754
  237   2HD   LYS  34          2HD       LYS  34  13.500  -0.855  -0.003
  238   1HE   LYS  34          1HE       LYS  34  11.653  -1.431   1.319
  239   2HE   LYS  34          2HE       LYS  34  11.671  -3.087   0.695
  240   1HZ   LYS  34          1HZ       LYS  34  13.977  -3.282   1.627
  241   2HZ   LYS  34          2HZ       LYS  34  12.810  -3.058   2.796
  242   3HZ   LYS  34          3HZ       LYS  34  13.796  -1.763   2.343
  243    H    LEU  35           H        LEU  35  10.607   1.646  -2.232
  244    HA   LEU  35           HA       LEU  35  10.449   3.890  -0.642
  245   1HB   LEU  35          1HB       LEU  35   8.100   3.630  -0.658
  246   2HB   LEU  35          2HB       LEU  35   8.709   3.051  -2.198
  247    HG   LEU  35           HG       LEU  35   8.264   1.080  -0.034
  248   1HD1  LEU  35          11HD      LEU  35   6.090   2.276  -1.758
  249   2HD1  LEU  35          12HD      LEU  35   6.239   2.381   0.002
  250   3HD1  LEU  35          13HD      LEU  35   5.907   0.836  -0.754
  251   1HD2  LEU  35          21HD      LEU  35   7.654  -0.384  -1.888
  252   2HD2  LEU  35          22HD      LEU  35   9.244   0.330  -2.146
  253   3HD2  LEU  35          23HD      LEU  35   7.839   0.949  -3.021
  254    H    GLY  36           H        GLY  36   9.627   4.220   1.444
  255   1HA   GLY  36          1HA       GLY  36   9.554   1.847   3.142
  256   2HA   GLY  36          2HA       GLY  36  10.250   3.385   3.681
  257    H    ILE  37           H        ILE  37   7.434   3.083   1.673
  258    HA   ILE  37           HA       ILE  37   5.906   4.384   3.755
  259    HB   ILE  37           HB       ILE  37   4.976   3.557   0.993
  260   1HG1  ILE  37          11HG      ILE  37   6.870   5.217   0.969
  261   2HG1  ILE  37          12HG      ILE  37   5.375   5.845   0.256
  262   1HG2  ILE  37          21HG      ILE  37   3.192   3.831   2.596
  263   2HG2  ILE  37          22HG      ILE  37   3.162   5.171   1.443
  264   3HG2  ILE  37          23HG      ILE  37   3.817   5.407   3.065
  265   1HD1  ILE  37          11HD      ILE  37   6.559   6.416   2.952
  266   2HD1  ILE  37          12HD      ILE  37   4.976   6.996   2.411
  267   3HD1  ILE  37          13HD      ILE  37   6.437   7.530   1.584
  268    H    PHE  38           H        PHE  38   5.201   3.063   5.198
  269    HA   PHE  38           HA       PHE  38   4.277   0.384   4.404
  270   1HB   PHE  38          1HB       PHE  38   5.049   1.523   7.081
  271   2HB   PHE  38          2HB       PHE  38   4.388  -0.086   6.889
  272    HD1  PHE  38           HD1      PHE  38   5.737  -1.881   6.043
  273    HD2  PHE  38           HD2      PHE  38   7.234   2.071   6.279
  274    HE1  PHE  38           HE1      PHE  38   8.019  -2.737   5.714
  275    HE2  PHE  38           HE2      PHE  38   9.493   1.286   5.958
  276    HZ   PHE  38           HZ       PHE  38   9.916  -1.172   5.667
  277    H    VAL  39           H        VAL  39   2.360  -0.383   5.685
  278    HA   VAL  39           HA       VAL  39   0.324   1.616   5.530
  279    HB   VAL  39           HB       VAL  39   0.142  -1.224   6.610
  280   1HG1  VAL  39          11HG      VAL  39  -1.985   0.651   5.601
  281   2HG1  VAL  39          12HG      VAL  39  -1.720   0.185   7.280
  282   3HG1  VAL  39          13HG      VAL  39  -2.242  -1.020   6.101
  283   1HG2  VAL  39          21HG      VAL  39   0.980  -1.215   4.302
  284   2HG2  VAL  39          22HG      VAL  39  -0.375  -0.209   3.813
  285   3HG2  VAL  39          23HG      VAL  39  -0.660  -1.857   4.378
  286    H    LYS  40           H        LYS  40  -0.157   2.903   7.137
  287    HA   LYS  40           HA       LYS  40   1.061   2.447   9.713
  288   1HB   LYS  40          1HB       LYS  40   1.197   4.705   8.854
  289   2HB   LYS  40          2HB       LYS  40  -0.528   4.757   8.609
  290   1HG   LYS  40          1HG       LYS  40  -0.020   6.146  10.479
  291   2HG   LYS  40          2HG       LYS  40  -0.835   4.711  11.079
  292   1HD   LYS  40          1HD       LYS  40   2.175   5.046  11.146
  293   2HD   LYS  40          2HD       LYS  40   1.125   5.591  12.445
  294   1HE   LYS  40          1HE       LYS  40   0.290   3.197  12.581
  295   2HE   LYS  40          2HE       LYS  40   1.587   2.796  11.465
  296   1HZ   LYS  40          1HZ       LYS  40   2.262   2.437  13.806
  297   2HZ   LYS  40          2HZ       LYS  40   2.015   4.073  14.097
  298   3HZ   LYS  40          3HZ       LYS  40   3.216   3.605  13.051
  299    H    THR  41           H        THR  41  -2.125   2.937   8.294
  300    HA   THR  41           HA       THR  41  -3.294   1.302  10.374
  301    HB   THR  41           HB       THR  41  -4.788   3.663   9.562
  302    HG1  THR  41           HG1      THR  41  -3.573   5.099  10.627
  303   1HG2  THR  41          21HG      THR  41  -5.796   2.060  11.034
  304   2HG2  THR  41          22HG      THR  41  -5.574   3.573  11.916
  305   3HG2  THR  41          23HG      THR  41  -4.472   2.224  12.191
  306    H    VAL  42           H        VAL  42  -5.346   0.588   9.617
  307    HA   VAL  42           HA       VAL  42  -5.993   1.250   6.926
  308    HB   VAL  42           HB       VAL  42  -4.810  -0.818   6.609
  309   1HG1  VAL  42          11HG      VAL  42  -5.279  -2.877   7.811
  310   2HG1  VAL  42          12HG      VAL  42  -6.412  -1.997   8.843
  311   3HG1  VAL  42          13HG      VAL  42  -4.693  -1.579   8.853
  312   1HG2  VAL  42          21HG      VAL  42  -6.527  -2.397   5.821
  313   2HG2  VAL  42          22HG      VAL  42  -6.861  -0.723   5.351
  314   3HG2  VAL  42          23HG      VAL  42  -7.744  -1.452   6.684
  315    H    THR  43           H        THR  43  -8.299   0.860   6.502
  316    HA   THR  43           HA       THR  43  -9.800   2.091   8.438
  317    HB   THR  43           HB       THR  43 -10.421   2.187   6.065
  318    HG1  THR  43           HG1      THR  43 -12.202   2.616   7.209
  319   1HG2  THR  43          21HG      THR  43 -11.548   0.255   5.058
  320   2HG2  THR  43          22HG      THR  43 -11.141  -0.638   6.545
  321   3HG2  THR  43          23HG      THR  43  -9.843  -0.085   5.479
  322    H    GLU  44           H        GLU  44 -11.276   1.517   9.753
  323    HA   GLU  44           HA       GLU  44 -10.804  -0.554  11.461
  324   1HB   GLU  44          1HB       GLU  44 -12.936   0.120  12.489
  325   2HB   GLU  44          2HB       GLU  44 -11.774   1.421  12.241
  326   1HG   GLU  44          1HG       GLU  44 -12.989   2.061  10.228
  327   2HG   GLU  44          2HG       GLU  44 -14.153   0.782  10.555
  328    H    GLY  45           H        GLY  45 -13.403  -0.325   9.042
  329   1HA   GLY  45          1HA       GLY  45 -13.424  -3.136   8.925
  330   2HA   GLY  45          2HA       GLY  45 -14.895  -2.522   9.736
  331    H    GLY  46           H        GLY  46 -13.034  -1.162   7.058
  332   1HA   GLY  46          1HA       GLY  46 -15.291  -1.515   5.399
  333   2HA   GLY  46          2HA       GLY  46 -13.740  -0.749   5.009
  334    H    ALA  47           H        ALA  47 -14.381  -2.224   3.316
  335    HA   ALA  47           HA       ALA  47 -14.181  -5.025   3.425
  336   1HB   ALA  47          1HB       ALA  47 -13.322  -3.496   1.057
  337   2HB   ALA  47          2HB       ALA  47 -15.027  -3.683   1.502
  338   3HB   ALA  47          3HB       ALA  47 -14.051  -5.102   1.077
  339    H    ALA  48           H        ALA  48 -11.602  -3.012   3.973
  340    HA   ALA  48           HA       ALA  48  -9.531  -4.606   2.737
  341   1HB   ALA  48          1HB       ALA  48  -9.194  -2.188   3.003
  342   2HB   ALA  48          2HB       ALA  48  -7.971  -3.099   3.888
  343   3HB   ALA  48          3HB       ALA  48  -9.321  -2.368   4.751
  344    H    GLN  49           H        GLN  49 -10.164  -3.715   6.197
  345    HA   GLN  49           HA       GLN  49  -8.809  -6.013   7.062
  346   1HB   GLN  49          1HB       GLN  49 -10.509  -3.999   8.496
  347   2HB   GLN  49          2HB       GLN  49  -9.843  -5.405   9.328
  348   1HG   GLN  49          1HG       GLN  49  -7.583  -4.666   8.533
  349   2HG   GLN  49          2HG       GLN  49  -8.376  -3.198   7.949
  350   1HE2  GLN  49          21HE      GLN  49 -10.160  -2.916  10.137
  351   2HE2  GLN  49          22HE      GLN  49  -9.239  -2.467  11.523
  352    H    ARG  50           H        ARG  50 -12.067  -5.493   6.095
  353    HA   ARG  50           HA       ARG  50 -13.182  -7.768   7.337
  354   1HB   ARG  50          1HB       ARG  50 -13.932  -6.493   4.710
  355   2HB   ARG  50          2HB       ARG  50 -14.891  -7.703   5.539
  356   1HG   ARG  50          1HG       ARG  50 -14.128  -5.130   6.780
  357   2HG   ARG  50          2HG       ARG  50 -15.607  -5.271   5.809
  358   1HD   ARG  50          1HD       ARG  50 -16.324  -7.042   7.418
  359   2HD   ARG  50          2HD       ARG  50 -14.886  -6.692   8.392
  360    HE   ARG  50           HE       ARG  50 -16.232  -4.309   7.895
  361   1HH1  ARG  50          11HH      ARG  50 -16.819  -7.272   9.744
  362   2HH1  ARG  50          12HH      ARG  50 -17.775  -6.505  10.916
  363   1HH2  ARG  50          21HH      ARG  50 -17.582  -3.271   9.495
  364   2HH2  ARG  50          22HH      ARG  50 -18.242  -4.193  10.759
  365    H    ASP  51           H        ASP  51 -11.319  -7.190   4.416
  366    HA   ASP  51           HA       ASP  51 -11.676  -9.755   3.221
  367   1HB   ASP  51          1HB       ASP  51 -10.895  -7.693   1.989
  368   2HB   ASP  51          2HB       ASP  51  -9.342  -7.851   2.784
  369    H    GLY  52           H        GLY  52  -8.775  -8.305   4.620
  370   1HA   GLY  52          1HA       GLY  52  -7.622  -9.269   6.465
  371   2HA   GLY  52          2HA       GLY  52  -8.326 -10.819   6.049
  372    H    ARG  53           H        ARG  53  -7.349  -9.960   3.084
  373    HA   ARG  53           HA       ARG  53  -4.864 -11.398   3.393
  374   1HB   ARG  53          1HB       ARG  53  -6.539 -11.303   1.305
  375   2HB   ARG  53          2HB       ARG  53  -5.544  -9.932   0.855
  376   1HG   ARG  53          1HG       ARG  53  -4.478 -12.716   1.363
  377   2HG   ARG  53          2HG       ARG  53  -4.861 -12.064  -0.227
  378   1HD   ARG  53          1HD       ARG  53  -3.090 -10.582  -0.181
  379   2HD   ARG  53          2HD       ARG  53  -2.991 -10.602   1.576
  380    HE   ARG  53           HE       ARG  53  -2.228 -12.895  -0.089
  381   1HH1  ARG  53          11HH      ARG  53  -1.542 -10.618   2.579
  382   2HH1  ARG  53          12HH      ARG  53  -0.097 -11.359   3.050
  383   1HH2  ARG  53          21HH      ARG  53  -0.197 -13.943   0.604
  384   2HH2  ARG  53          22HH      ARG  53   0.675 -13.299   1.906
  385    H    ILE  54           H        ILE  54  -5.857  -8.130   3.058
  386    HA   ILE  54           HA       ILE  54  -3.114  -7.162   2.932
  387    HB   ILE  54           HB       ILE  54  -5.077  -6.141   1.590
  388   1HG1  ILE  54          11HG      ILE  54  -3.666  -4.179   3.401
  389   2HG1  ILE  54          12HG      ILE  54  -2.868  -4.993   2.058
  390   1HG2  ILE  54          21HG      ILE  54  -5.766  -5.161   4.346
  391   2HG2  ILE  54          22HG      ILE  54  -6.783  -6.150   3.292
  392   3HG2  ILE  54          23HG      ILE  54  -6.443  -4.463   2.868
  393   1HD1  ILE  54          11HD      ILE  54  -4.445  -4.022   0.518
  394   2HD1  ILE  54          12HD      ILE  54  -3.590  -2.772   1.413
  395   3HD1  ILE  54          13HD      ILE  54  -5.270  -3.202   1.841
  396    H    GLN  55           H        GLN  55  -2.385  -5.618   4.748
  397    HA   GLN  55           HA       GLN  55  -3.872  -6.227   7.140
  398   1HB   GLN  55          1HB       GLN  55  -0.877  -6.589   6.843
  399   2HB   GLN  55          2HB       GLN  55  -1.811  -6.824   8.310
  400   1HG   GLN  55          1HG       GLN  55  -2.999  -8.689   7.265
  401   2HG   GLN  55          2HG       GLN  55  -2.063  -8.458   5.792
  402   1HE2  GLN  55          21HE      GLN  55  -0.764  -8.201   9.047
  403   2HE2  GLN  55          22HE      GLN  55   0.209  -9.611   8.967
  404    H    VAL  56           H        VAL  56  -2.065  -5.079   8.926
  405    HA   VAL  56           HA       VAL  56  -1.903  -2.292   8.006
  406    HB   VAL  56           HB       VAL  56  -3.474  -2.872   9.936
  407   1HG1  VAL  56          11HG      VAL  56  -2.486  -3.117  12.185
  408   2HG1  VAL  56          12HG      VAL  56  -0.914  -3.388  11.416
  409   3HG1  VAL  56          13HG      VAL  56  -2.246  -4.498  11.122
  410   1HG2  VAL  56          21HG      VAL  56  -1.295  -0.870  10.469
  411   2HG2  VAL  56          22HG      VAL  56  -2.859  -0.901  11.289
  412   3HG2  VAL  56          23HG      VAL  56  -2.770  -0.591   9.554
  413    H    ASN  57           H        ASN  57  -0.146  -4.784   8.033
  414    HA   ASN  57           HA       ASN  57   2.234  -3.662   9.384
  415   1HB   ASN  57          1HB       ASN  57   1.291  -5.647  10.534
  416   2HB   ASN  57          2HB       ASN  57   1.518  -6.586   9.067
  417   1HD2  ASN  57          21HD      ASN  57   3.039  -5.045  11.748
  418   2HD2  ASN  57          22HD      ASN  57   4.572  -5.847  11.583
  419    H    ASP  58           H        ASP  58   0.874  -4.430   6.456
  420    HA   ASP  58           HA       ASP  58   3.290  -5.438   5.246
  421   1HB   ASP  58          1HB       ASP  58   1.940  -5.700   3.204
  422   2HB   ASP  58          2HB       ASP  58   1.114  -6.437   4.560
  423    H    GLN  59           H        GLN  59   2.936  -4.215   2.713
  424    HA   GLN  59           HA       GLN  59   3.509  -1.438   3.248
  425   1HB   GLN  59          1HB       GLN  59   5.641  -2.592   3.550
  426   2HB   GLN  59          2HB       GLN  59   5.436  -3.337   1.965
  427   1HG   GLN  59          1HG       GLN  59   5.640  -1.252   0.870
  428   2HG   GLN  59          2HG       GLN  59   5.579  -0.381   2.397
  429   1HE2  GLN  59          21HE      GLN  59   7.408   0.587   2.085
  430   2HE2  GLN  59          22HE      GLN  59   8.981  -0.144   2.103
  431    H    ILE  60           H        ILE  60   2.476  -0.327   1.766
  432    HA   ILE  60           HA       ILE  60   1.278  -1.467  -0.545
  433    HB   ILE  60           HB       ILE  60   1.783   1.462   0.006
  434   1HG1  ILE  60          11HG      ILE  60   0.577   0.488   1.922
  435   2HG1  ILE  60          12HG      ILE  60  -0.472   1.542   0.988
  436   1HG2  ILE  60          21HG      ILE  60  -0.343   0.110  -1.612
  437   2HG2  ILE  60          22HG      ILE  60   1.142   0.727  -2.281
  438   3HG2  ILE  60          23HG      ILE  60  -0.022   1.850  -1.548
  439   1HD1  ILE  60          11HD      ILE  60  -0.450  -1.462   0.918
  440   2HD1  ILE  60          12HD      ILE  60  -1.503  -0.424  -0.047
  441   3HD1  ILE  60          13HD      ILE  60  -1.651  -0.445   1.713
  442    H    VAL  61           H        VAL  61   2.607  -2.128  -2.165
  443    HA   VAL  61           HA       VAL  61   5.086  -0.702  -2.684
  444    HB   VAL  61           HB       VAL  61   3.932  -3.224  -3.907
  445   1HG1  VAL  61          11HG      VAL  61   6.110  -3.666  -4.799
  446   2HG1  VAL  61          12HG      VAL  61   6.692  -2.081  -4.255
  447   3HG1  VAL  61          13HG      VAL  61   5.421  -2.197  -5.489
  448   1HG2  VAL  61          21HG      VAL  61   6.101  -2.859  -1.850
  449   2HG2  VAL  61          22HG      VAL  61   5.617  -4.394  -2.573
  450   3HG2  VAL  61          23HG      VAL  61   4.479  -3.494  -1.575
  451    H    GLU  62           H        GLU  62   2.219  -1.640  -4.499
  452    HA   GLU  62           HA       GLU  62   2.464   0.748  -6.143
  453   1HB   GLU  62          1HB       GLU  62   3.725  -0.746  -7.489
  454   2HB   GLU  62          2HB       GLU  62   2.596  -2.059  -7.325
  455   1HG   GLU  62          1HG       GLU  62   0.935  -0.694  -8.604
  456   2HG   GLU  62          2HG       GLU  62   2.197   0.513  -8.833
  457    H    VAL  63           H        VAL  63   0.529   1.628  -5.777
  458    HA   VAL  63           HA       VAL  63  -1.744  -0.158  -5.895
  459    HB   VAL  63           HB       VAL  63  -1.278   2.347  -4.322
  460   1HG1  VAL  63          11HG      VAL  63  -3.142   2.984  -5.784
  461   2HG1  VAL  63          12HG      VAL  63  -3.651   2.763  -4.098
  462   3HG1  VAL  63          13HG      VAL  63  -4.015   1.521  -5.303
  463   1HG2  VAL  63          21HG      VAL  63  -1.235   0.077  -3.418
  464   2HG2  VAL  63          22HG      VAL  63  -2.903  -0.136  -3.945
  465   3HG2  VAL  63          23HG      VAL  63  -2.518   1.070  -2.719
  466    H    ASP  64           H        ASP  64  -3.124  -0.111  -7.383
  467    HA   ASP  64           HA       ASP  64  -4.319   0.395  -9.250
  468   1HB   ASP  64          1HB       ASP  64  -4.956   2.352  -7.793
  469   2HB   ASP  64          2HB       ASP  64  -3.692   3.288  -8.574
  470    H    GLY  65           H        GLY  65  -1.314   0.250  -9.252
  471   1HA   GLY  65          1HA       GLY  65   0.236   0.005 -10.955
  472   2HA   GLY  65          2HA       GLY  65  -0.951   0.669 -12.071
  473    H    ILE  66           H        ILE  66  -0.363   2.562  -9.245
  474    HA   ILE  66           HA       ILE  66   0.754   4.630 -10.879
  475    HB   ILE  66           HB       ILE  66  -0.915   4.831  -8.789
  476   1HG1  ILE  66          11HG      ILE  66   1.354   6.793  -9.127
  477   2HG1  ILE  66          12HG      ILE  66   0.005   6.649 -10.256
  478   1HG2  ILE  66          21HG      ILE  66   0.532   3.795  -7.151
  479   2HG2  ILE  66          22HG      ILE  66   0.250   5.494  -6.737
  480   3HG2  ILE  66          23HG      ILE  66   1.779   5.001  -7.468
  481   1HD1  ILE  66          11HD      ILE  66  -0.166   7.382  -7.359
  482   2HD1  ILE  66          12HD      ILE  66  -1.533   7.206  -8.454
  483   3HD1  ILE  66          13HD      ILE  66  -0.344   8.489  -8.726
  484    H    SER  67           H        SER  67   1.966   2.282  -8.702
  485    HA   SER  67           HA       SER  67   3.919   1.778  -7.748
  486   1HB   SER  67          1HB       SER  67   4.519   1.374 -10.156
  487   2HB   SER  67          2HB       SER  67   5.177   3.014 -10.214
  488    HG   SER  67           HG       SER  67   6.939   2.061  -9.589
  489    H    LEU  68           H        LEU  68   4.082   2.865  -5.963
  490    HA   LEU  68           HA       LEU  68   4.968   5.650  -6.052
  491   1HB   LEU  68          1HB       LEU  68   4.108   5.772  -3.769
  492   2HB   LEU  68          2HB       LEU  68   2.885   5.237  -4.902
  493    HG   LEU  68           HG       LEU  68   4.278   3.013  -3.756
  494   1HD1  LEU  68          11HD      LEU  68   4.624   4.513  -1.949
  495   2HD1  LEU  68          12HD      LEU  68   3.467   3.258  -1.478
  496   3HD1  LEU  68          13HD      LEU  68   2.906   4.903  -1.860
  497   1HD2  LEU  68          21HD      LEU  68   1.400   3.902  -3.697
  498   2HD2  LEU  68          22HD      LEU  68   2.002   2.295  -3.270
  499   3HD2  LEU  68          23HD      LEU  68   2.178   2.896  -4.923
  500    H    VAL  69           H        VAL  69   6.448   3.127  -6.234
  501    HA   VAL  69           HA       VAL  69   8.063   2.667  -4.003
  502    HB   VAL  69           HB       VAL  69   8.888   2.256  -6.883
  503   1HG1  VAL  69          11HG      VAL  69   9.846   0.915  -4.360
  504   2HG1  VAL  69          12HG      VAL  69  10.753   2.061  -5.349
  505   3HG1  VAL  69          13HG      VAL  69  10.329   0.477  -5.998
  506   1HG2  VAL  69          21HG      VAL  69   6.774   1.163  -6.542
  507   2HG2  VAL  69          22HG      VAL  69   7.340   0.438  -5.037
  508   3HG2  VAL  69          23HG      VAL  69   8.043  -0.064  -6.574
  509    H    GLY  70           H        GLY  70   8.766   4.592  -3.126
  510   1HA   GLY  70          1HA       GLY  70  11.034   5.566  -2.919
  511   2HA   GLY  70          2HA       GLY  70  10.919   5.917  -4.634
  512    H    VAL  71           H        VAL  71   7.919   6.379  -3.217
  513    HA   VAL  71           HA       VAL  71   8.271   9.244  -3.462
  514    HB   VAL  71           HB       VAL  71   5.885   9.456  -3.364
  515   1HG1  VAL  71          11HG      VAL  71   6.660   7.103  -5.050
  516   2HG1  VAL  71          12HG      VAL  71   6.771   8.813  -5.499
  517   3HG1  VAL  71          13HG      VAL  71   5.196   8.060  -5.239
  518   1HG2  VAL  71          21HG      VAL  71   5.430   7.859  -1.575
  519   2HG2  VAL  71          22HG      VAL  71   5.774   6.518  -2.668
  520   3HG2  VAL  71          23HG      VAL  71   4.388   7.577  -2.965
  521    H    THR  72           H        THR  72   6.736  10.519  -1.833
  522    HA   THR  72           HA       THR  72   7.779  10.001   0.833
  523    HB   THR  72           HB       THR  72   6.645  12.215   1.306
  524    HG1  THR  72           HG1      THR  72   6.715  12.583  -1.506
  525   1HG2  THR  72          21HG      THR  72   8.843  12.156  -0.785
  526   2HG2  THR  72          22HG      THR  72   9.065  12.065   0.965
  527   3HG2  THR  72          23HG      THR  72   8.441  13.542   0.230
  528    H    GLN  73           H        GLN  73   6.208  10.676   2.520
  529    HA   GLN  73           HA       GLN  73   4.081   8.912   2.542
  530   1HB   GLN  73          1HB       GLN  73   3.592   9.713   4.729
  531   2HB   GLN  73          2HB       GLN  73   5.316   9.799   4.516
  532   1HG   GLN  73          1HG       GLN  73   3.385  12.028   4.377
  533   2HG   GLN  73          2HG       GLN  73   4.446  11.697   5.748
  534   1HE2  GLN  73          21HE      GLN  73   6.752  11.626   5.126
  535   2HE2  GLN  73          22HE      GLN  73   7.330  12.822   4.042
  536    H    ASN  74           H        ASN  74   4.201  12.336   1.778
  537    HA   ASN  74           HA       ASN  74   1.409  12.629   1.784
  538   1HB   ASN  74          1HB       ASN  74   1.735  14.796   0.640
  539   2HB   ASN  74          2HB       ASN  74   2.764  14.626   2.055
  540   1HD2  ASN  74          21HD      ASN  74   4.947  14.581   1.751
  541   2HD2  ASN  74          22HD      ASN  74   5.705  14.959   0.250
  542    H    PHE  75           H        PHE  75   3.653  11.664  -0.713
  543    HA   PHE  75           HA       PHE  75   1.776  11.852  -2.818
  544   1HB   PHE  75          1HB       PHE  75   4.237  11.575  -3.186
  545   2HB   PHE  75          2HB       PHE  75   4.090   9.924  -2.582
  546    HD1  PHE  75           HD1      PHE  75   2.619   8.267  -3.927
  547    HD2  PHE  75           HD2      PHE  75   3.833  12.063  -5.438
  548    HE1  PHE  75           HE1      PHE  75   2.102   7.514  -6.193
  549    HE2  PHE  75           HE2      PHE  75   3.321  11.301  -7.721
  550    HZ   PHE  75           HZ       PHE  75   2.462   9.028  -8.103
  551    H    ALA  76           H        ALA  76   2.894   9.166  -0.762
  552    HA   ALA  76           HA       ALA  76   1.151   7.222  -1.750
  553   1HB   ALA  76          1HB       ALA  76   1.650   5.993   0.261
  554   2HB   ALA  76          2HB       ALA  76   2.298   7.448   1.019
  555   3HB   ALA  76          3HB       ALA  76   3.114   6.742  -0.377
  556    H    ALA  77           H        ALA  77   0.763   9.464   0.972
  557    HA   ALA  77           HA       ALA  77  -1.709   8.510   1.877
  558   1HB   ALA  77          1HB       ALA  77  -0.631  11.314   2.080
  559   2HB   ALA  77          2HB       ALA  77  -0.227   9.991   3.176
  560   3HB   ALA  77          3HB       ALA  77  -1.882  10.595   3.101
  561    H    THR  78           H        THR  78  -0.897  10.369  -0.849
  562    HA   THR  78           HA       THR  78  -3.551  11.373  -1.213
  563    HB   THR  78           HB       THR  78  -1.099  11.420  -2.987
  564    HG1  THR  78           HG1      THR  78  -0.817  12.767  -1.327
  565   1HG2  THR  78          21HG      THR  78  -3.113  11.466  -4.370
  566   2HG2  THR  78          22HG      THR  78  -2.357  13.063  -4.371
  567   3HG2  THR  78          23HG      THR  78  -3.793  12.754  -3.384
  568    H    VAL  79           H        VAL  79  -1.474   8.903  -2.747
  569    HA   VAL  79           HA       VAL  79  -3.343   8.035  -4.627
  570    HB   VAL  79           HB       VAL  79  -1.249   6.258  -3.312
  571   1HG1  VAL  79          11HG      VAL  79  -1.303   5.001  -5.381
  572   2HG1  VAL  79          12HG      VAL  79  -2.554   6.066  -6.015
  573   3HG1  VAL  79          13HG      VAL  79  -2.892   5.044  -4.622
  574   1HG2  VAL  79          21HG      VAL  79  -0.222   8.296  -4.109
  575   2HG2  VAL  79          22HG      VAL  79  -1.027   8.117  -5.661
  576   3HG2  VAL  79          23HG      VAL  79   0.203   6.947  -5.161
  577    H    LEU  80           H        LEU  80  -2.565   6.605  -1.464
  578    HA   LEU  80           HA       LEU  80  -4.650   4.669  -1.495
  579   1HB   LEU  80          1HB       LEU  80  -2.989   5.781   0.772
  580   2HB   LEU  80          2HB       LEU  80  -4.163   4.508   0.990
  581    HG   LEU  80           HG       LEU  80  -2.032   3.481   0.929
  582   1HD1  LEU  80          11HD      LEU  80  -2.134   1.985  -0.924
  583   2HD1  LEU  80          12HD      LEU  80  -3.242   3.064  -1.770
  584   3HD1  LEU  80          13HD      LEU  80  -3.744   2.282  -0.271
  585   1HD2  LEU  80          21HD      LEU  80  -0.413   3.708  -0.880
  586   2HD2  LEU  80          22HD      LEU  80  -0.747   5.273  -0.134
  587   3HD2  LEU  80          23HD      LEU  80  -1.481   4.860  -1.684
  588    H    ARG  81           H        ARG  81  -4.891   7.934  -1.198
  589    HA   ARG  81           HA       ARG  81  -7.327   7.937   0.456
  590   1HB   ARG  81          1HB       ARG  81  -5.762   9.770   0.811
  591   2HB   ARG  81          2HB       ARG  81  -5.759  10.120  -0.905
  592   1HG   ARG  81          1HG       ARG  81  -8.300  10.495  -0.577
  593   2HG   ARG  81          2HG       ARG  81  -7.864  10.680   1.124
  594   1HD   ARG  81          1HD       ARG  81  -6.287  12.438   0.563
  595   2HD   ARG  81          2HD       ARG  81  -6.614  12.150  -1.156
  596    HE   ARG  81           HE       ARG  81  -8.973  12.753   0.267
  597   1HH1  ARG  81          11HH      ARG  81  -6.085  14.366  -0.988
  598   2HH1  ARG  81          12HH      ARG  81  -6.897  15.771  -1.471
  599   1HH2  ARG  81          21HH      ARG  81 -10.122  14.700  -0.448
  600   2HH2  ARG  81          22HH      ARG  81  -9.238  15.962  -1.170
  601    H    ASN  82           H        ASN  82  -6.081   8.582  -2.753
  602    HA   ASN  82           HA       ASN  82  -8.538   9.511  -3.889
  603   1HB   ASN  82          1HB       ASN  82  -5.836   8.891  -5.057
  604   2HB   ASN  82          2HB       ASN  82  -7.188   9.226  -6.104
  605   1HD2  ASN  82          21HD      ASN  82  -6.332  10.745  -3.058
  606   2HD2  ASN  82          22HD      ASN  82  -6.124  12.348  -3.704
  607    H    THR  83           H        THR  83  -7.357   6.460  -3.238
  608    HA   THR  83           HA       THR  83  -8.438   5.091  -5.450
  609    HB   THR  83           HB       THR  83  -8.175   3.134  -3.920
  610    HG1  THR  83           HG1      THR  83  -8.199   4.667  -2.047
  611   1HG2  THR  83          21HG      THR  83  -6.478   3.724  -5.583
  612   2HG2  THR  83          22HG      THR  83  -5.725   3.166  -4.083
  613   3HG2  THR  83          23HG      THR  83  -5.771   4.884  -4.449
  614    H    LYS  84           H        LYS  84 -10.242   4.076  -5.668
  615    HA   LYS  84           HA       LYS  84 -12.313   4.407  -3.646
  616   1HB   LYS  84          1HB       LYS  84 -12.447   4.241  -6.649
  617   2HB   LYS  84          2HB       LYS  84 -13.874   3.947  -5.669
  618   1HG   LYS  84          1HG       LYS  84 -12.233   6.472  -5.642
  619   2HG   LYS  84          2HG       LYS  84 -13.772   6.247  -6.484
  620   1HD   LYS  84          1HD       LYS  84 -14.881   5.780  -4.411
  621   2HD   LYS  84          2HD       LYS  84 -13.385   5.913  -3.508
  622   1HE   LYS  84          1HE       LYS  84 -13.167   8.231  -4.213
  623   2HE   LYS  84          2HE       LYS  84 -14.710   8.130  -5.057
  624   1HZ   LYS  84          1HZ       LYS  84 -14.348   7.739  -2.116
  625   2HZ   LYS  84          2HZ       LYS  84 -15.808   7.677  -2.945
  626   3HZ   LYS  84          3HZ       LYS  84 -14.976   9.124  -2.836
  627    H    GLY  85           H        GLY  85 -14.075   2.513  -4.588
  628   1HA   GLY  85          1HA       GLY  85 -13.592   0.360  -3.112
  629   2HA   GLY  85          2HA       GLY  85 -14.555   0.299  -4.562
  630    H    ASN  86           H        ASN  86 -12.824   0.339  -6.560
  631    HA   ASN  86           HA       ASN  86 -11.605  -2.288  -6.115
  632   1HB   ASN  86          1HB       ASN  86 -12.181  -0.858  -8.707
  633   2HB   ASN  86          2HB       ASN  86 -11.338  -2.402  -8.615
  634   1HD2  ASN  86          21HD      ASN  86 -14.362  -0.770  -8.247
  635   2HD2  ASN  86          22HD      ASN  86 -15.335  -2.196  -8.144
  636    H    VAL  87           H        VAL  87  -9.722  -2.197  -5.270
  637    HA   VAL  87           HA       VAL  87  -7.761  -0.294  -6.413
  638    HB   VAL  87           HB       VAL  87  -7.248  -1.466  -3.790
  639   1HG1  VAL  87          11HG      VAL  87  -5.619  -0.098  -4.762
  640   2HG1  VAL  87          12HG      VAL  87  -6.258   0.703  -3.326
  641   3HG1  VAL  87          13HG      VAL  87  -6.755   1.241  -4.934
  642   1HG2  VAL  87          21HG      VAL  87  -8.519   0.264  -2.577
  643   2HG2  VAL  87          22HG      VAL  87  -9.508  -0.918  -3.450
  644   3HG2  VAL  87          23HG      VAL  87  -9.297   0.708  -4.111
  645    H    ARG  88           H        ARG  88  -6.126  -1.229  -7.299
  646    HA   ARG  88           HA       ARG  88  -5.438  -4.028  -6.772
  647   1HB   ARG  88          1HB       ARG  88  -4.458  -1.981  -8.745
  648   2HB   ARG  88          2HB       ARG  88  -3.733  -3.572  -8.566
  649   1HG   ARG  88          1HG       ARG  88  -5.543  -4.654  -9.427
  650   2HG   ARG  88          2HG       ARG  88  -6.655  -3.325  -9.060
  651   1HD   ARG  88          1HD       ARG  88  -6.159  -3.528 -11.452
  652   2HD   ARG  88          2HD       ARG  88  -5.691  -1.982 -10.723
  653    HE   ARG  88           HE       ARG  88  -3.619  -4.021 -10.984
  654   1HH1  ARG  88          11HH      ARG  88  -4.995  -0.991 -12.275
  655   2HH1  ARG  88          12HH      ARG  88  -3.588  -0.568 -13.119
  656   1HH2  ARG  88          21HH      ARG  88  -1.654  -3.366 -12.169
  657   2HH2  ARG  88          22HH      ARG  88  -1.695  -1.917 -13.065
  658    H    PHE  89           H        PHE  89  -4.540  -4.100  -4.835
  659    HA   PHE  89           HA       PHE  89  -2.383  -2.277  -4.165
  660   1HB   PHE  89          1HB       PHE  89  -3.548  -4.592  -2.624
  661   2HB   PHE  89          2HB       PHE  89  -2.316  -3.472  -2.060
  662    HD1  PHE  89           HD1      PHE  89  -2.896  -1.153  -1.635
  663    HD2  PHE  89           HD2      PHE  89  -5.814  -4.065  -2.576
  664    HE1  PHE  89           HE1      PHE  89  -4.614   0.327  -0.753
  665    HE2  PHE  89           HE2      PHE  89  -7.573  -2.594  -1.683
  666    HZ   PHE  89           HZ       PHE  89  -6.967  -0.372  -0.770
  667    H    VAL  90           H        VAL  90  -0.630  -2.857  -5.368
  668    HA   VAL  90           HA       VAL  90   0.041  -5.668  -5.413
  669    HB   VAL  90           HB       VAL  90   1.499  -3.311  -6.586
  670   1HG1  VAL  90          11HG      VAL  90   2.988  -5.208  -6.192
  671   2HG1  VAL  90          12HG      VAL  90   2.734  -4.998  -7.925
  672   3HG1  VAL  90          13HG      VAL  90   1.882  -6.277  -7.059
  673   1HG2  VAL  90          21HG      VAL  90  -0.659  -3.584  -7.662
  674   2HG2  VAL  90          22HG      VAL  90  -0.303  -5.287  -7.975
  675   3HG2  VAL  90          23HG      VAL  90   0.650  -4.025  -8.754
  676    H    ILE  91           H        ILE  91   0.454  -5.985  -3.389
  677    HA   ILE  91           HA       ILE  91   2.605  -4.536  -2.051
  678    HB   ILE  91           HB       ILE  91   0.303  -6.243  -1.083
  679   1HG1  ILE  91          11HG      ILE  91   0.914  -3.350  -0.581
  680   2HG1  ILE  91          12HG      ILE  91  -0.183  -3.907  -1.835
  681   1HG2  ILE  91          21HG      ILE  91   0.997  -5.755   1.235
  682   2HG2  ILE  91          22HG      ILE  91   2.436  -4.949   0.626
  683   3HG2  ILE  91          23HG      ILE  91   2.228  -6.679   0.375
  684   1HD1  ILE  91          11HD      ILE  91  -1.541  -4.916  -0.194
  685   2HD1  ILE  91          12HD      ILE  91  -1.323  -3.153   0.036
  686   3HD1  ILE  91          13HD      ILE  91  -0.459  -4.306   1.083
  687    H    GLY  92           H        GLY  92   4.159  -5.873  -0.998
  688   1HA   GLY  92          1HA       GLY  92   4.168  -8.568  -2.079
  689   2HA   GLY  92          2HA       GLY  92   5.650  -7.626  -2.049
  690    H    ARG  93           H        ARG  93   5.197 -10.088  -0.816
  691    HA   ARG  93           HA       ARG  93   5.385  -9.362   2.015
  692   1HB   ARG  93          1HB       ARG  93   3.367 -10.696   1.549
  693   2HB   ARG  93          2HB       ARG  93   4.356 -11.938   0.807
  694   1HG   ARG  93          1HG       ARG  93   4.759 -11.185   3.678
  695   2HG   ARG  93          2HG       ARG  93   3.472 -12.288   3.204
  696   1HD   ARG  93          1HD       ARG  93   6.395 -12.632   2.561
  697   2HD   ARG  93          2HD       ARG  93   5.545 -13.437   3.873
  698    HE   ARG  93           HE       ARG  93   4.055 -14.284   2.003
  699   1HH1  ARG  93          11HH      ARG  93   7.607 -13.820   1.547
  700   2HH1  ARG  93          12HH      ARG  93   7.669 -14.920   0.273
  701   1HH2  ARG  93          21HH      ARG  93   4.241 -15.784   0.256
  702   2HH2  ARG  93          22HH      ARG  93   5.742 -16.068  -0.473
  703    H    GLU  94           H        GLU  94   7.078  -9.901   3.102
  704    HA   GLU  94           HA       GLU  94   9.323 -10.851   1.621
  705   1HB   GLU  94          1HB       GLU  94  10.597 -10.390   3.713
  706   2HB   GLU  94          2HB       GLU  94   9.727  -9.002   3.081
  707   1HG   GLU  94          1HG       GLU  94   7.962  -9.422   4.779
  708   2HG   GLU  94          2HG       GLU  94   8.968 -10.713   5.433
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1  15.672  -9.974   2.258
    2   2H    GLY   1          2H        GLY   1  15.420 -10.017   3.932
    3   3H    GLY   1          3H        GLY   1  14.193  -9.505   2.891
    4   1HA   GLY   1          1HA       GLY   1  15.358 -12.221   2.954
    5   2HA   GLY   1          2HA       GLY   1  13.787 -11.774   3.615
    6    H    HIS   2           H        HIS   2  13.724 -13.724   1.819
    7    HA   HIS   2           HA       HIS   2  13.442 -12.867  -0.888
    8   1HB   HIS   2          1HB       HIS   2  12.372 -15.310   0.564
    9   2HB   HIS   2          2HB       HIS   2  12.233 -15.068  -1.167
   10    HD1  HIS   2           HD1      HIS   2  14.488 -16.454   1.367
   11    HD2  HIS   2           HD2      HIS   2  14.785 -15.008  -2.511
   12    HE1  HIS   2           HE1      HIS   2  16.708 -17.250   0.494
   13    H    MET   3           H        MET   3  11.652 -12.039  -1.887
   14    HA   MET   3           HA       MET   3   9.243 -11.837  -0.277
   15   1HB   MET   3          1HB       MET   3  10.417  -9.842   0.294
   16   2HB   MET   3          2HB       MET   3  10.775  -9.512  -1.395
   17   1HG   MET   3          1HG       MET   3   8.481  -9.012  -1.845
   18   2HG   MET   3          2HG       MET   3   7.997  -9.539  -0.237
   19   1HE   MET   3          1HE       MET   3  10.099  -6.884  -2.274
   20   2HE   MET   3          2HE       MET   3  11.248  -7.446  -1.060
   21   3HE   MET   3          3HE       MET   3  10.620  -5.805  -0.980
   22    H    GLU   4           H        GLU   4   7.449 -12.008  -1.346
   23    HA   GLU   4           HA       GLU   4   7.505 -12.192  -4.268
   24   1HB   GLU   4          1HB       GLU   4   6.616 -14.105  -2.886
   25   2HB   GLU   4          2HB       GLU   4   5.435 -12.935  -2.266
   26   1HG   GLU   4          1HG       GLU   4   4.472 -12.667  -4.481
   27   2HG   GLU   4          2HG       GLU   4   5.688 -13.729  -5.171
   28    H    LEU   5           H        LEU   5   6.781 -10.415  -5.275
   29    HA   LEU   5           HA       LEU   5   5.120  -8.522  -3.846
   30   1HB   LEU   5          1HB       LEU   5   6.260  -8.415  -6.643
   31   2HB   LEU   5          2HB       LEU   5   5.418  -7.112  -5.833
   32    HG   LEU   5           HG       LEU   5   7.628  -6.501  -5.720
   33   1HD1  LEU   5          11HD      LEU   5   8.300  -6.548  -3.424
   34   2HD1  LEU   5          12HD      LEU   5   7.192  -7.883  -3.143
   35   3HD1  LEU   5          13HD      LEU   5   6.550  -6.288  -3.576
   36   1HD2  LEU   5          21HD      LEU   5   9.510  -7.928  -5.033
   37   2HD2  LEU   5          22HD      LEU   5   8.702  -8.530  -6.480
   38   3HD2  LEU   5          23HD      LEU   5   8.405  -9.300  -4.921
   39    H    PHE   6           H        PHE   6   2.929  -8.622  -4.022
   40    HA   PHE   6           HA       PHE   6   1.867  -9.891  -6.400
   41   1HB   PHE   6          1HB       PHE   6   0.184 -11.017  -4.866
   42   2HB   PHE   6          2HB       PHE   6   1.779 -11.752  -4.979
   43    HD1  PHE   6           HD1      PHE   6  -0.413  -9.568  -2.969
   44    HD2  PHE   6           HD2      PHE   6   2.996 -12.071  -2.994
   45    HE1  PHE   6           HE1      PHE   6  -0.343  -9.465  -0.514
   46    HE2  PHE   6           HE2      PHE   6   3.098 -11.986  -0.557
   47    HZ   PHE   6           HZ       PHE   6   1.429 -10.674   0.707
   48    HA   PRO   7           HA       PRO   7  -1.144  -6.682  -6.112
   49   1HB   PRO   7          1HB       PRO   7  -2.941  -7.627  -7.820
   50   2HB   PRO   7          2HB       PRO   7  -1.404  -6.946  -8.350
   51   1HG   PRO   7          1HG       PRO   7  -2.222  -9.820  -8.104
   52   2HG   PRO   7          2HG       PRO   7  -1.199  -9.061  -9.345
   53   1HD   PRO   7          1HD       PRO   7  -0.295 -10.511  -7.168
   54   2HD   PRO   7          2HD       PRO   7   0.666  -9.312  -8.062
   55    H    VAL   8           H        VAL   8  -2.505  -6.429  -4.518
   56    HA   VAL   8           HA       VAL   8  -4.362  -8.557  -3.918
   57    HB   VAL   8           HB       VAL   8  -3.720  -6.109  -2.249
   58   1HG1  VAL   8          11HG      VAL   8  -5.354  -8.544  -1.555
   59   2HG1  VAL   8          12HG      VAL   8  -5.941  -6.904  -1.790
   60   3HG1  VAL   8          13HG      VAL   8  -4.886  -7.276  -0.425
   61   1HG2  VAL   8          21HG      VAL   8  -2.799  -8.943  -1.880
   62   2HG2  VAL   8          22HG      VAL   8  -2.501  -7.604  -0.761
   63   3HG2  VAL   8          23HG      VAL   8  -1.811  -7.572  -2.397
   64    H    GLU   9           H        GLU   9  -6.104  -8.200  -5.171
   65    HA   GLU   9           HA       GLU   9  -6.889  -5.462  -5.723
   66   1HB   GLU   9          1HB       GLU   9  -6.877  -7.181  -7.543
   67   2HB   GLU   9          2HB       GLU   9  -8.168  -8.022  -6.699
   68   1HG   GLU   9          1HG       GLU   9  -9.611  -6.062  -6.949
   69   2HG   GLU   9          2HG       GLU   9  -8.308  -5.227  -7.790
   70    H    LEU  10           H        LEU  10  -7.940  -4.520  -4.138
   71    HA   LEU  10           HA       LEU  10  -9.661  -6.128  -2.385
   72   1HB   LEU  10          1HB       LEU  10  -7.725  -4.280  -1.880
   73   2HB   LEU  10          2HB       LEU  10  -9.147  -3.259  -1.939
   74    HG   LEU  10           HG       LEU  10  -8.676  -3.765   0.331
   75   1HD1  LEU  10          11HD      LEU  10 -10.996  -5.445  -0.554
   76   2HD1  LEU  10          12HD      LEU  10 -11.032  -3.732  -0.156
   77   3HD1  LEU  10          13HD      LEU  10 -10.687  -4.924   1.098
   78   1HD2  LEU  10          21HD      LEU  10  -7.274  -5.699  -0.007
   79   2HD2  LEU  10          22HD      LEU  10  -8.685  -6.674  -0.433
   80   3HD2  LEU  10          23HD      LEU  10  -8.514  -6.027   1.199
   81    H    GLU  11           H        GLU  11 -11.868  -5.539  -2.282
   82    HA   GLU  11           HA       GLU  11 -12.623  -3.390  -4.097
   83   1HB   GLU  11          1HB       GLU  11 -13.413  -5.630  -4.825
   84   2HB   GLU  11          2HB       GLU  11 -14.305  -5.775  -3.317
   85   1HG   GLU  11          1HG       GLU  11 -15.658  -3.853  -3.908
   86   2HG   GLU  11          2HG       GLU  11 -14.729  -3.649  -5.390
   87    H    LYS  12           H        LYS  12 -12.598  -1.778  -2.734
   88    HA   LYS  12           HA       LYS  12 -14.026  -1.943  -0.257
   89   1HB   LYS  12          1HB       LYS  12 -12.043  -0.152  -1.447
   90   2HB   LYS  12          2HB       LYS  12 -13.141   0.625  -0.337
   91   1HG   LYS  12          1HG       LYS  12 -11.271  -1.691   0.179
   92   2HG   LYS  12          2HG       LYS  12 -11.139  -0.057   0.818
   93   1HD   LYS  12          1HD       LYS  12 -13.704  -1.141   1.460
   94   2HD   LYS  12          2HD       LYS  12 -12.460  -2.295   1.984
   95   1HE   LYS  12          1HE       LYS  12 -12.920  -0.981   3.841
   96   2HE   LYS  12          2HE       LYS  12 -11.468  -0.308   3.254
   97   1HZ   LYS  12          1HZ       LYS  12 -14.183   0.856   2.681
   98   2HZ   LYS  12          2HZ       LYS  12 -12.792   1.514   2.057
   99   3HZ   LYS  12          3HZ       LYS  12 -13.073   1.545   3.706
  100    H    ASP  13           H        ASP  13 -14.868   0.512   0.104
  101    HA   ASP  13           HA       ASP  13 -17.366   0.682  -1.249
  102   1HB   ASP  13          1HB       ASP  13 -16.070   2.670   0.620
  103   2HB   ASP  13          2HB       ASP  13 -17.785   2.390   0.375
  104    H    GLU  14           H        GLU  14 -18.000   2.854  -2.185
  105    HA   GLU  14           HA       GLU  14 -16.099   3.761  -4.105
  106   1HB   GLU  14          1HB       GLU  14 -17.774   5.502  -4.668
  107   2HB   GLU  14          2HB       GLU  14 -18.483   3.897  -4.597
  108   1HG   GLU  14          1HG       GLU  14 -19.405   4.388  -2.393
  109   2HG   GLU  14          2HG       GLU  14 -18.649   5.977  -2.430
  110    H    ASP  15           H        ASP  15 -16.775   4.552  -0.917
  111    HA   ASP  15           HA       ASP  15 -15.775   7.195  -0.648
  112   1HB   ASP  15          1HB       ASP  15 -17.140   6.044   1.047
  113   2HB   ASP  15          2HB       ASP  15 -15.827   4.921   1.336
  114    H    GLY  16           H        GLY  16 -14.331   4.030  -0.692
  115   1HA   GLY  16          1HA       GLY  16 -12.142   3.922  -1.683
  116   2HA   GLY  16          2HA       GLY  16 -11.698   5.306  -0.699
  117    H    LEU  17           H        LEU  17 -10.367   4.688   0.819
  118    HA   LEU  17           HA       LEU  17 -10.691   1.963   1.895
  119   1HB   LEU  17          1HB       LEU  17  -8.204   3.609   2.186
  120   2HB   LEU  17          2HB       LEU  17  -8.464   1.880   2.340
  121    HG   LEU  17           HG       LEU  17  -8.567   3.405  -0.176
  122   1HD1  LEU  17          11HD      LEU  17  -6.421   1.662   1.008
  123   2HD1  LEU  17          12HD      LEU  17  -6.329   3.390   0.646
  124   3HD1  LEU  17          13HD      LEU  17  -6.432   2.217  -0.662
  125   1HD2  LEU  17          21HD      LEU  17  -9.963   1.451  -0.320
  126   2HD2  LEU  17          22HD      LEU  17  -8.698   0.447   0.385
  127   3HD2  LEU  17          23HD      LEU  17  -8.475   1.145  -1.219
  128    H    GLY  18           H        GLY  18  -9.394   5.088   2.873
  129   1HA   GLY  18          1HA       GLY  18  -9.733   6.244   4.830
  130   2HA   GLY  18          2HA       GLY  18 -10.702   4.894   5.435
  131    H    ILE  19           H        ILE  19  -7.617   4.235   3.980
  132    HA   ILE  19           HA       ILE  19  -6.684   3.253   6.583
  133    HB   ILE  19           HB       ILE  19  -4.945   2.038   5.492
  134   1HG1  ILE  19          11HG      ILE  19  -5.701   3.398   2.909
  135   2HG1  ILE  19          12HG      ILE  19  -4.293   3.788   3.895
  136   1HG2  ILE  19          21HG      ILE  19  -6.191   0.657   3.857
  137   2HG2  ILE  19          22HG      ILE  19  -7.462   1.894   3.897
  138   3HG2  ILE  19          23HG      ILE  19  -7.112   0.982   5.333
  139   1HD1  ILE  19          11HD      ILE  19  -3.679   2.357   2.013
  140   2HD1  ILE  19          12HD      ILE  19  -4.810   1.131   2.578
  141   3HD1  ILE  19          13HD      ILE  19  -3.401   1.547   3.556
  142    H    SER  20           H        SER  20  -4.144   3.420   6.753
  143    HA   SER  20           HA       SER  20  -3.297   6.157   6.252
  144   1HB   SER  20          1HB       SER  20  -3.464   4.784   8.941
  145   2HB   SER  20          2HB       SER  20  -2.605   6.296   8.707
  146    HG   SER  20           HG       SER  20  -4.645   7.044   7.802
  147    H    ILE  21           H        ILE  21  -1.053   6.382   6.229
  148    HA   ILE  21           HA       ILE  21   0.468   3.859   6.143
  149    HB   ILE  21           HB       ILE  21   1.711   4.732   4.229
  150   1HG1  ILE  21          11HG      ILE  21   0.278   6.652   2.955
  151   2HG1  ILE  21          12HG      ILE  21  -0.051   7.089   4.609
  152   1HG2  ILE  21          21HG      ILE  21  -1.251   4.535   3.731
  153   2HG2  ILE  21          22HG      ILE  21  -0.093   3.205   3.786
  154   3HG2  ILE  21          23HG      ILE  21  -0.002   4.397   2.490
  155   1HD1  ILE  21          11HD      ILE  21   2.716   6.904   3.384
  156   2HD1  ILE  21          12HD      ILE  21   2.368   7.307   5.049
  157   3HD1  ILE  21          13HD      ILE  21   1.858   8.380   3.768
  158    H    ILE  22           H        ILE  22   2.738   4.166   6.407
  159    HA   ILE  22           HA       ILE  22   3.426   6.719   7.542
  160    HB   ILE  22           HB       ILE  22   3.137   5.328   9.375
  161   1HG1  ILE  22          11HG      ILE  22   6.116   5.644   8.938
  162   2HG1  ILE  22          12HG      ILE  22   5.022   6.867   9.563
  163   1HG2  ILE  22          21HG      ILE  22   4.521   3.244   9.766
  164   2HG2  ILE  22          22HG      ILE  22   4.892   3.309   8.032
  165   3HG2  ILE  22          23HG      ILE  22   3.217   3.146   8.593
  166   1HD1  ILE  22          11HD      ILE  22   6.329   5.876  11.343
  167   2HD1  ILE  22          12HD      ILE  22   5.739   4.274  10.914
  168   3HD1  ILE  22          13HD      ILE  22   4.621   5.485  11.545
  169    H    GLY  23           H        GLY  23   5.416   7.546   6.970
  170   1HA   GLY  23          1HA       GLY  23   6.701   6.062   4.834
  171   2HA   GLY  23          2HA       GLY  23   6.850   7.806   5.092
  172    H    MET  24           H        MET  24   8.140   4.777   5.538
  173    HA   MET  24           HA       MET  24  10.111   5.825   7.469
  174   1HB   MET  24          1HB       MET  24   9.245   2.959   7.038
  175   2HB   MET  24          2HB       MET  24  10.516   3.470   8.127
  176   1HG   MET  24          1HG       MET  24   7.592   4.127   8.351
  177   2HG   MET  24          2HG       MET  24   8.488   2.971   9.340
  178   1HE   MET  24          1HE       MET  24  10.454   3.703  11.036
  179   2HE   MET  24          2HE       MET  24  10.937   5.384  11.273
  180   3HE   MET  24          3HE       MET  24  11.258   4.589   9.737
  181    H    GLY  25           H        GLY  25  11.514   6.599   5.954
  182   1HA   GLY  25          1HA       GLY  25  12.172   5.419   3.536
  183   2HA   GLY  25          2HA       GLY  25  13.247   6.489   4.421
  184    H    VAL  26           H        VAL  26  12.747   3.415   3.275
  185    HA   VAL  26           HA       VAL  26  14.981   2.346   4.787
  186    HB   VAL  26           HB       VAL  26  12.705   1.632   5.681
  187   1HG1  VAL  26          11HG      VAL  26  11.475   1.416   3.659
  188   2HG1  VAL  26          12HG      VAL  26  11.478  -0.124   4.514
  189   3HG1  VAL  26          13HG      VAL  26  12.519   0.108   3.106
  190   1HG2  VAL  26          21HG      VAL  26  14.562  -0.539   4.714
  191   2HG2  VAL  26          22HG      VAL  26  13.321  -0.747   5.947
  192   3HG2  VAL  26          23HG      VAL  26  14.675   0.349   6.237
  193    H    GLY  27           H        GLY  27  15.896   0.481   3.574
  194   1HA   GLY  27          1HA       GLY  27  15.788  -0.814   1.530
  195   2HA   GLY  27          2HA       GLY  27  15.236   0.648   0.720
  196    H    ALA  28           H        ALA  28  17.352   1.890   2.721
  197    HA   ALA  28           HA       ALA  28  19.370   2.076   0.708
  198   1HB   ALA  28          1HB       ALA  28  20.536   3.567   2.254
  199   2HB   ALA  28          2HB       ALA  28  19.436   3.109   3.552
  200   3HB   ALA  28          3HB       ALA  28  18.830   4.002   2.158
  201    H    ASP  29           H        ASP  29  19.059   0.526   3.812
  202    HA   ASP  29           HA       ASP  29  21.698  -0.610   3.837
  203   1HB   ASP  29          1HB       ASP  29  20.301  -0.307   5.897
  204   2HB   ASP  29          2HB       ASP  29  19.237  -1.578   5.320
  205    H    ALA  30           H        ALA  30  18.594  -1.541   2.692
  206    HA   ALA  30           HA       ALA  30  19.210  -4.191   1.937
  207   1HB   ALA  30          1HB       ALA  30  17.134  -2.339   0.770
  208   2HB   ALA  30          2HB       ALA  30  16.904  -3.370   2.182
  209   3HB   ALA  30          3HB       ALA  30  17.177  -4.091   0.595
  210    H    GLY  31           H        GLY  31  19.746  -1.094   0.454
  211   1HA   GLY  31          1HA       GLY  31  21.356  -0.649  -1.174
  212   2HA   GLY  31          2HA       GLY  31  21.396  -2.363  -1.562
  213    H    LEU  32           H        LEU  32  18.378  -0.785  -1.344
  214    HA   LEU  32           HA       LEU  32  18.216  -0.797  -4.287
  215   1HB   LEU  32          1HB       LEU  32  16.067  -1.384  -2.281
  216   2HB   LEU  32          2HB       LEU  32  15.717  -1.050  -3.961
  217    HG   LEU  32           HG       LEU  32  15.587  -3.350  -3.738
  218   1HD1  LEU  32          11HD      LEU  32  17.343  -4.282  -5.119
  219   2HD1  LEU  32          12HD      LEU  32  18.305  -2.835  -4.865
  220   3HD1  LEU  32          13HD      LEU  32  16.766  -2.726  -5.721
  221   1HD2  LEU  32          21HD      LEU  32  17.335  -4.788  -2.735
  222   2HD2  LEU  32          22HD      LEU  32  16.605  -3.675  -1.584
  223   3HD2  LEU  32          23HD      LEU  32  18.204  -3.334  -2.243
  224    H    GLU  33           H        GLU  33  17.381   0.861  -1.341
  225    HA   GLU  33           HA       GLU  33  16.342   2.759  -0.843
  226   1HB   GLU  33          1HB       GLU  33  17.864   3.718  -3.269
  227   2HB   GLU  33          2HB       GLU  33  17.007   4.792  -2.176
  228   1HG   GLU  33          1HG       GLU  33  18.415   4.008  -0.326
  229   2HG   GLU  33          2HG       GLU  33  19.294   2.983  -1.462
  230    H    LYS  34           H        LYS  34  14.348   2.085  -1.022
  231    HA   LYS  34           HA       LYS  34  12.895   2.857  -3.444
  232   1HB   LYS  34          1HB       LYS  34  11.511   0.819  -3.181
  233   2HB   LYS  34          2HB       LYS  34  13.196   0.435  -3.436
  234   1HG   LYS  34          1HG       LYS  34  13.517  -0.147  -1.136
  235   2HG   LYS  34          2HG       LYS  34  11.932   0.486  -0.708
  236   1HD   LYS  34          1HD       LYS  34  11.933  -1.977  -0.822
  237   2HD   LYS  34          2HD       LYS  34  10.845  -1.254  -1.999
  238   1HE   LYS  34          1HE       LYS  34  12.438  -1.578  -3.751
  239   2HE   LYS  34          2HE       LYS  34  13.640  -2.215  -2.618
  240   1HZ   LYS  34          1HZ       LYS  34  11.000  -3.441  -3.181
  241   2HZ   LYS  34          2HZ       LYS  34  12.259  -4.124  -2.254
  242   3HZ   LYS  34          3HZ       LYS  34  12.448  -3.903  -3.906
  243    H    LEU  35           H        LEU  35  10.455   1.956  -2.280
  244    HA   LEU  35           HA       LEU  35   9.711   4.225  -0.735
  245   1HB   LEU  35          1HB       LEU  35   7.537   3.195  -0.790
  246   2HB   LEU  35          2HB       LEU  35   8.260   3.076  -2.382
  247    HG   LEU  35           HG       LEU  35   9.031   0.740  -1.175
  248   1HD1  LEU  35          11HD      LEU  35   7.008  -0.301  -0.312
  249   2HD1  LEU  35          12HD      LEU  35   6.230   1.286  -0.274
  250   3HD1  LEU  35          13HD      LEU  35   7.663   0.974   0.704
  251   1HD2  LEU  35          21HD      LEU  35   8.355   0.877  -3.434
  252   2HD2  LEU  35          22HD      LEU  35   6.677   1.218  -2.982
  253   3HD2  LEU  35          23HD      LEU  35   7.406  -0.359  -2.629
  254    H    GLY  36           H        GLY  36   9.164   4.196   1.466
  255   1HA   GLY  36          1HA       GLY  36   9.560   1.666   2.875
  256   2HA   GLY  36          2HA       GLY  36  10.129   3.214   3.522
  257    H    ILE  37           H        ILE  37   7.211   2.662   1.750
  258    HA   ILE  37           HA       ILE  37   5.777   3.989   3.857
  259    HB   ILE  37           HB       ILE  37   4.794   3.045   1.169
  260   1HG1  ILE  37          11HG      ILE  37   6.659   4.732   1.196
  261   2HG1  ILE  37          12HG      ILE  37   5.191   5.295   0.346
  262   1HG2  ILE  37          21HG      ILE  37   2.994   3.298   2.726
  263   2HG2  ILE  37          22HG      ILE  37   2.951   4.673   1.613
  264   3HG2  ILE  37          23HG      ILE  37   3.599   4.859   3.254
  265   1HD1  ILE  37          11HD      ILE  37   4.715   6.514   2.518
  266   2HD1  ILE  37          12HD      ILE  37   6.116   7.068   1.602
  267   3HD1  ILE  37          13HD      ILE  37   6.345   6.039   3.012
  268    H    PHE  38           H        PHE  38   5.381   2.703   5.444
  269    HA   PHE  38           HA       PHE  38   4.306   0.042   4.966
  270   1HB   PHE  38          1HB       PHE  38   5.193   1.428   7.481
  271   2HB   PHE  38          2HB       PHE  38   4.444  -0.170   7.452
  272    HD1  PHE  38           HD1      PHE  38   5.609  -2.085   6.528
  273    HD2  PHE  38           HD2      PHE  38   7.486   1.721   6.768
  274    HE1  PHE  38           HE1      PHE  38   7.782  -3.152   6.153
  275    HE2  PHE  38           HE2      PHE  38   9.684   0.664   6.396
  276    HZ   PHE  38           HZ       PHE  38   9.837  -1.775   6.089
  277    H    VAL  39           H        VAL  39   2.424  -0.591   6.144
  278    HA   VAL  39           HA       VAL  39   0.436   1.471   5.935
  279    HB   VAL  39           HB       VAL  39   0.145  -1.450   6.706
  280   1HG1  VAL  39          11HG      VAL  39  -2.197  -1.139   6.149
  281   2HG1  VAL  39          12HG      VAL  39  -1.909   0.572   5.827
  282   3HG1  VAL  39          13HG      VAL  39  -1.719  -0.065   7.465
  283   1HG2  VAL  39          21HG      VAL  39  -0.621  -1.778   4.391
  284   2HG2  VAL  39          22HG      VAL  39   1.047  -1.202   4.452
  285   3HG2  VAL  39          23HG      VAL  39  -0.248  -0.091   4.037
  286    H    LYS  40           H        LYS  40  -0.407   2.537   7.574
  287    HA   LYS  40           HA       LYS  40   0.676   2.123  10.207
  288   1HB   LYS  40          1HB       LYS  40  -0.866   4.237   8.873
  289   2HB   LYS  40          2HB       LYS  40  -1.084   4.129  10.615
  290   1HG   LYS  40          1HG       LYS  40   1.408   4.499   9.056
  291   2HG   LYS  40          2HG       LYS  40   0.570   5.752   9.979
  292   1HD   LYS  40          1HD       LYS  40   2.001   3.306  11.093
  293   2HD   LYS  40          2HD       LYS  40   2.473   4.982  11.282
  294   1HE   LYS  40          1HE       LYS  40   0.528   5.461  12.595
  295   2HE   LYS  40          2HE       LYS  40  -0.098   3.837  12.339
  296   1HZ   LYS  40          1HZ       LYS  40   1.833   2.954  13.492
  297   2HZ   LYS  40          2HZ       LYS  40   0.940   3.985  14.478
  298   3HZ   LYS  40          3HZ       LYS  40   2.397   4.509  13.812
  299    H    THR  41           H        THR  41  -2.421   2.424   8.647
  300    HA   THR  41           HA       THR  41  -3.750   0.678  10.608
  301    HB   THR  41           HB       THR  41  -5.168   3.008   9.622
  302    HG1  THR  41           HG1      THR  41  -4.235   4.224  11.583
  303   1HG2  THR  41          21HG      THR  41  -6.114   3.027  11.897
  304   2HG2  THR  41          22HG      THR  41  -5.011   1.724  12.339
  305   3HG2  THR  41          23HG      THR  41  -6.263   1.450  11.110
  306    H    VAL  42           H        VAL  42  -5.966  -0.015   9.567
  307    HA   VAL  42           HA       VAL  42  -5.907   0.420   6.738
  308    HB   VAL  42           HB       VAL  42  -6.356  -2.326   7.969
  309   1HG1  VAL  42          11HG      VAL  42  -7.797  -1.972   6.121
  310   2HG1  VAL  42          12HG      VAL  42  -6.473  -3.016   5.543
  311   3HG1  VAL  42          13HG      VAL  42  -6.497  -1.269   5.182
  312   1HG2  VAL  42          21HG      VAL  42  -4.398  -3.011   6.731
  313   2HG2  VAL  42          22HG      VAL  42  -4.016  -1.704   7.872
  314   3HG2  VAL  42          23HG      VAL  42  -4.214  -1.349   6.148
  315    H    THR  43           H        THR  43  -7.511   1.728   6.992
  316    HA   THR  43           HA       THR  43  -9.700   2.515   7.266
  317    HB   THR  43           HB       THR  43  -9.811  -0.411   6.731
  318    HG1  THR  43           HG1      THR  43 -10.106   1.720   4.942
  319   1HG2  THR  43          21HG      THR  43 -12.039  -0.129   5.703
  320   2HG2  THR  43          22HG      THR  43 -12.035   1.563   6.270
  321   3HG2  THR  43          23HG      THR  43 -11.996   0.225   7.439
  322    H    GLU  44           H        GLU  44 -11.846   1.810   8.589
  323    HA   GLU  44           HA       GLU  44 -11.306   0.833  11.217
  324   1HB   GLU  44          1HB       GLU  44 -13.769   0.987  11.385
  325   2HB   GLU  44          2HB       GLU  44 -13.080   2.480  10.760
  326   1HG   GLU  44          1HG       GLU  44 -13.650   1.782   8.506
  327   2HG   GLU  44          2HG       GLU  44 -14.352   0.302   9.158
  328    H    GLY  45           H        GLY  45 -13.705  -0.998  11.163
  329   1HA   GLY  45          1HA       GLY  45 -12.405  -3.082   9.640
  330   2HA   GLY  45          2HA       GLY  45 -13.601  -3.410  10.941
  331    H    GLY  46           H        GLY  46 -13.229  -1.592   7.995
  332   1HA   GLY  46          1HA       GLY  46 -15.795  -2.497   7.054
  333   2HA   GLY  46          2HA       GLY  46 -14.767  -1.264   6.306
  334    H    ALA  47           H        ALA  47 -15.026  -2.342   4.448
  335    HA   ALA  47           HA       ALA  47 -14.622  -5.080   3.987
  336   1HB   ALA  47          1HB       ALA  47 -14.751  -4.695   1.632
  337   2HB   ALA  47          2HB       ALA  47 -14.346  -2.996   1.841
  338   3HB   ALA  47          3HB       ALA  47 -15.876  -3.607   2.444
  339    H    ALA  48           H        ALA  48 -12.188  -2.769   4.389
  340    HA   ALA  48           HA       ALA  48 -10.105  -4.073   2.834
  341   1HB   ALA  48          1HB       ALA  48  -8.593  -2.576   4.043
  342   2HB   ALA  48          2HB       ALA  48  -9.923  -2.075   5.091
  343   3HB   ALA  48          3HB       ALA  48  -9.959  -1.695   3.367
  344    H    GLN  49           H        GLN  49 -10.531  -3.673   6.347
  345    HA   GLN  49           HA       GLN  49  -8.890  -5.900   6.878
  346   1HB   GLN  49          1HB       GLN  49 -10.751  -4.334   8.619
  347   2HB   GLN  49          2HB       GLN  49  -9.803  -5.691   9.233
  348   1HG   GLN  49          1HG       GLN  49  -7.769  -4.468   8.397
  349   2HG   GLN  49          2HG       GLN  49  -8.840  -3.093   8.105
  350   1HE2  GLN  49          21HE      GLN  49  -9.656  -1.975   9.842
  351   2HE2  GLN  49          22HE      GLN  49  -9.093  -2.184  11.459
  352    H    ARG  50           H        ARG  50 -12.303  -5.648   6.240
  353    HA   ARG  50           HA       ARG  50 -12.971  -8.189   7.270
  354   1HB   ARG  50          1HB       ARG  50 -14.279  -6.682   5.017
  355   2HB   ARG  50          2HB       ARG  50 -14.919  -8.152   5.715
  356   1HG   ARG  50          1HG       ARG  50 -14.372  -5.679   7.245
  357   2HG   ARG  50          2HG       ARG  50 -15.968  -6.042   6.552
  358   1HD   ARG  50          1HD       ARG  50 -15.956  -8.103   7.987
  359   2HD   ARG  50          2HD       ARG  50 -14.440  -7.541   8.707
  360    HE   ARG  50           HE       ARG  50 -16.536  -5.615   8.723
  361   1HH1  ARG  50          11HH      ARG  50 -15.101  -8.275  10.593
  362   2HH1  ARG  50          12HH      ARG  50 -15.768  -7.750  12.066
  363   1HH2  ARG  50          21HH      ARG  50 -17.420  -4.913  10.726
  364   2HH2  ARG  50          22HH      ARG  50 -17.122  -5.787  12.159
  365    H    ASP  51           H        ASP  51 -11.766  -7.005   4.139
  366    HA   ASP  51           HA       ASP  51 -11.969  -9.421   2.716
  367   1HB   ASP  51          1HB       ASP  51 -11.364  -7.237   1.663
  368   2HB   ASP  51          2HB       ASP  51  -9.760  -7.360   2.385
  369    H    GLY  52           H        GLY  52  -9.290  -8.107   4.554
  370   1HA   GLY  52          1HA       GLY  52  -7.934  -9.222   6.050
  371   2HA   GLY  52          2HA       GLY  52  -8.757 -10.707   5.633
  372    H    ARG  53           H        ARG  53  -7.861  -9.778   2.646
  373    HA   ARG  53           HA       ARG  53  -5.575 -11.484   2.773
  374   1HB   ARG  53          1HB       ARG  53  -7.286 -11.228   0.790
  375   2HB   ARG  53          2HB       ARG  53  -6.313  -9.832   0.354
  376   1HG   ARG  53          1HG       ARG  53  -5.041 -12.522   0.699
  377   2HG   ARG  53          2HG       ARG  53  -5.851 -12.092  -0.801
  378   1HD   ARG  53          1HD       ARG  53  -4.331 -10.324  -1.212
  379   2HD   ARG  53          2HD       ARG  53  -3.681 -10.400   0.423
  380    HE   ARG  53           HE       ARG  53  -2.685 -12.490  -0.134
  381   1HH1  ARG  53          11HH      ARG  53  -3.879 -10.717  -2.985
  382   2HH1  ARG  53          12HH      ARG  53  -2.743 -11.360  -4.053
  383   1HH2  ARG  53          21HH      ARG  53  -1.123 -13.389  -1.584
  384   2HH2  ARG  53          22HH      ARG  53  -1.127 -12.949  -3.236
  385    H    ILE  54           H        ILE  54  -6.196  -8.147   2.818
  386    HA   ILE  54           HA       ILE  54  -3.363  -7.454   2.563
  387    HB   ILE  54           HB       ILE  54  -5.195  -6.145   1.336
  388   1HG1  ILE  54          11HG      ILE  54  -3.588  -4.488   3.292
  389   2HG1  ILE  54          12HG      ILE  54  -2.921  -5.213   1.828
  390   1HG2  ILE  54          21HG      ILE  54  -5.824  -5.265   4.144
  391   2HG2  ILE  54          22HG      ILE  54  -6.905  -6.135   3.046
  392   3HG2  ILE  54          23HG      ILE  54  -6.448  -4.463   2.695
  393   1HD1  ILE  54          11HD      ILE  54  -5.164  -3.210   1.915
  394   2HD1  ILE  54          12HD      ILE  54  -4.431  -3.926   0.475
  395   3HD1  ILE  54          13HD      ILE  54  -3.467  -2.863   1.490
  396    H    GLN  55           H        GLN  55  -2.295  -6.372   4.397
  397    HA   GLN  55           HA       GLN  55  -3.891  -6.457   6.812
  398   1HB   GLN  55          1HB       GLN  55  -1.102  -7.565   6.543
  399   2HB   GLN  55          2HB       GLN  55  -1.921  -7.323   8.077
  400   1HG   GLN  55          1HG       GLN  55  -3.664  -8.897   7.381
  401   2HG   GLN  55          2HG       GLN  55  -2.805  -9.157   5.863
  402   1HE2  GLN  55          21HE      GLN  55  -0.879 -10.269   5.891
  403   2HE2  GLN  55          22HE      GLN  55  -0.388 -11.255   7.199
  404    H    VAL  56           H        VAL  56  -2.701  -5.403   8.666
  405    HA   VAL  56           HA       VAL  56  -1.974  -2.710   7.881
  406    HB   VAL  56           HB       VAL  56  -3.504  -3.424   9.809
  407   1HG1  VAL  56          11HG      VAL  56  -0.896  -4.004  11.184
  408   2HG1  VAL  56          12HG      VAL  56  -2.192  -5.135  10.828
  409   3HG1  VAL  56          13HG      VAL  56  -2.453  -3.838  11.996
  410   1HG2  VAL  56          21HG      VAL  56  -2.834  -1.106   9.580
  411   2HG2  VAL  56          22HG      VAL  56  -1.300  -1.443  10.364
  412   3HG2  VAL  56          23HG      VAL  56  -2.800  -1.553  11.280
  413    H    ASN  57           H        ASN  57  -0.318  -5.500   8.143
  414    HA   ASN  57           HA       ASN  57   2.130  -4.283   9.239
  415   1HB   ASN  57          1HB       ASN  57   1.263  -6.440  10.254
  416   2HB   ASN  57          2HB       ASN  57   1.544  -7.222   8.709
  417   1HD2  ASN  57          21HD      ASN  57   3.021  -5.778  11.505
  418   2HD2  ASN  57          22HD      ASN  57   4.591  -6.471  11.293
  419    H    ASP  58           H        ASP  58   0.772  -4.129   6.521
  420    HA   ASP  58           HA       ASP  58   2.826  -5.317   4.855
  421   1HB   ASP  58          1HB       ASP  58   0.174  -4.087   4.149
  422   2HB   ASP  58          2HB       ASP  58   1.414  -4.467   2.967
  423    H    GLN  59           H        GLN  59   3.182  -3.951   2.835
  424    HA   GLN  59           HA       GLN  59   3.853  -1.218   3.531
  425   1HB   GLN  59          1HB       GLN  59   5.830  -2.711   3.915
  426   2HB   GLN  59          2HB       GLN  59   5.674  -3.260   2.250
  427   1HG   GLN  59          1HG       GLN  59   6.180  -1.033   1.455
  428   2HG   GLN  59          2HG       GLN  59   6.250  -0.435   3.106
  429   1HE2  GLN  59          21HE      GLN  59   8.344   0.255   2.862
  430   2HE2  GLN  59          22HE      GLN  59   9.693  -0.814   2.753
  431    H    ILE  60           H        ILE  60   3.101   0.029   1.900
  432    HA   ILE  60           HA       ILE  60   1.728  -1.210  -0.314
  433    HB   ILE  60           HB       ILE  60   2.296   1.735   0.127
  434   1HG1  ILE  60          11HG      ILE  60   1.004   0.874   2.047
  435   2HG1  ILE  60          12HG      ILE  60   0.006   1.891   1.012
  436   1HG2  ILE  60          21HG      ILE  60   1.699   1.043  -2.155
  437   2HG2  ILE  60          22HG      ILE  60   0.512   2.128  -1.443
  438   3HG2  ILE  60          23HG      ILE  60   0.190   0.387  -1.529
  439   1HD1  ILE  60          11HD      ILE  60  -1.224  -0.044   1.787
  440   2HD1  ILE  60          12HD      ILE  60  -0.010  -1.108   1.089
  441   3HD1  ILE  60          13HD      ILE  60  -1.011  -0.105   0.033
  442    H    VAL  61           H        VAL  61   2.871  -1.910  -2.044
  443    HA   VAL  61           HA       VAL  61   5.401  -0.625  -2.658
  444    HB   VAL  61           HB       VAL  61   4.135  -3.151  -3.772
  445   1HG1  VAL  61          11HG      VAL  61   5.649  -2.223  -5.408
  446   2HG1  VAL  61          12HG      VAL  61   6.264  -3.712  -4.683
  447   3HG1  VAL  61          13HG      VAL  61   6.940  -2.151  -4.190
  448   1HG2  VAL  61          21HG      VAL  61   5.798  -4.348  -2.442
  449   2HG2  VAL  61          22HG      VAL  61   4.721  -3.377  -1.438
  450   3HG2  VAL  61          23HG      VAL  61   6.358  -2.818  -1.770
  451    H    GLU  62           H        GLU  62   2.416  -1.514  -4.317
  452    HA   GLU  62           HA       GLU  62   2.627   0.848  -5.986
  453   1HB   GLU  62          1HB       GLU  62   3.930  -0.626  -7.284
  454   2HB   GLU  62          2HB       GLU  62   2.807  -1.947  -7.105
  455   1HG   GLU  62          1HG       GLU  62   1.188  -0.769  -8.484
  456   2HG   GLU  62          2HG       GLU  62   2.291   0.600  -8.596
  457    H    VAL  63           H        VAL  63   0.681   1.685  -5.624
  458    HA   VAL  63           HA       VAL  63  -1.616  -0.105  -5.681
  459    HB   VAL  63           HB       VAL  63  -1.188   2.573  -4.338
  460   1HG1  VAL  63          11HG      VAL  63  -3.605   2.784  -3.998
  461   2HG1  VAL  63          12HG      VAL  63  -3.881   1.407  -5.073
  462   3HG1  VAL  63          13HG      VAL  63  -3.169   2.904  -5.709
  463   1HG2  VAL  63          21HG      VAL  63  -2.181   1.402  -2.511
  464   2HG2  VAL  63          22HG      VAL  63  -0.889   0.396  -3.212
  465   3HG2  VAL  63          23HG      VAL  63  -2.567   0.033  -3.547
  466    H    ASP  64           H        ASP  64  -2.909  -0.183  -7.254
  467    HA   ASP  64           HA       ASP  64  -4.141   0.258  -9.066
  468   1HB   ASP  64          1HB       ASP  64  -4.798   2.312  -7.777
  469   2HB   ASP  64          2HB       ASP  64  -3.539   3.205  -8.612
  470    H    GLY  65           H        GLY  65  -1.086   0.254  -9.083
  471   1HA   GLY  65          1HA       GLY  65   0.457  -0.008 -10.793
  472   2HA   GLY  65          2HA       GLY  65  -0.778   0.507 -11.938
  473    H    ILE  66           H        ILE  66  -0.311   2.566  -9.216
  474    HA   ILE  66           HA       ILE  66   0.639   4.706 -10.874
  475    HB   ILE  66           HB       ILE  66  -0.902   4.808  -8.683
  476   1HG1  ILE  66          11HG      ILE  66   1.312   6.822  -9.085
  477   2HG1  ILE  66          12HG      ILE  66  -0.097   6.698 -10.139
  478   1HG2  ILE  66          21HG      ILE  66   0.366   5.403  -6.678
  479   2HG2  ILE  66          22HG      ILE  66   1.864   4.995  -7.521
  480   3HG2  ILE  66          23HG      ILE  66   0.674   3.739  -7.189
  481   1HD1  ILE  66          11HD      ILE  66  -0.090   7.315  -7.225
  482   2HD1  ILE  66          12HD      ILE  66  -1.529   7.176  -8.238
  483   3HD1  ILE  66          13HD      ILE  66  -0.360   8.478  -8.529
  484    H    SER  67           H        SER  67   2.104   2.253  -9.200
  485    HA   SER  67           HA       SER  67   4.102   1.807  -8.274
  486   1HB   SER  67          1HB       SER  67   6.077   2.269  -9.837
  487   2HB   SER  67          2HB       SER  67   4.724   1.393 -10.542
  488    HG   SER  67           HG       SER  67   4.412   4.062 -10.823
  489    H    LEU  68           H        LEU  68   4.079   2.879  -6.389
  490    HA   LEU  68           HA       LEU  68   5.111   5.607  -6.357
  491   1HB   LEU  68          1HB       LEU  68   4.211   5.685  -4.081
  492   2HB   LEU  68          2HB       LEU  68   2.988   5.264  -5.264
  493    HG   LEU  68           HG       LEU  68   3.989   2.849  -4.380
  494   1HD1  LEU  68          11HD      LEU  68   5.096   3.906  -2.547
  495   2HD1  LEU  68          12HD      LEU  68   3.745   2.937  -1.949
  496   3HD1  LEU  68          13HD      LEU  68   3.607   4.700  -2.042
  497   1HD2  LEU  68          21HD      LEU  68   1.763   2.618  -3.388
  498   2HD2  LEU  68          22HD      LEU  68   1.776   3.275  -5.024
  499   3HD2  LEU  68          23HD      LEU  68   1.497   4.354  -3.646
  500    H    VAL  69           H        VAL  69   6.441   2.938  -6.542
  501    HA   VAL  69           HA       VAL  69   8.188   2.557  -4.405
  502    HB   VAL  69           HB       VAL  69   8.900   2.174  -7.331
  503   1HG1  VAL  69          11HG      VAL  69  10.495   0.504  -6.531
  504   2HG1  VAL  69          12HG      VAL  69  10.034   0.848  -4.867
  505   3HG1  VAL  69          13HG      VAL  69  10.838   2.089  -5.830
  506   1HG2  VAL  69          21HG      VAL  69   7.589   0.254  -5.402
  507   2HG2  VAL  69          22HG      VAL  69   8.167  -0.165  -7.013
  508   3HG2  VAL  69          23HG      VAL  69   6.844   0.982  -6.824
  509    H    GLY  70           H        GLY  70   8.949   4.353  -3.518
  510   1HA   GLY  70          1HA       GLY  70  10.940   5.668  -3.286
  511   2HA   GLY  70          2HA       GLY  70  10.983   5.819  -5.042
  512    H    VAL  71           H        VAL  71   8.446   6.405  -2.583
  513    HA   VAL  71           HA       VAL  71   8.439   9.205  -3.359
  514    HB   VAL  71           HB       VAL  71   6.025   9.357  -3.326
  515   1HG1  VAL  71          11HG      VAL  71   6.852   7.117  -5.146
  516   2HG1  VAL  71          12HG      VAL  71   6.974   8.843  -5.476
  517   3HG1  VAL  71          13HG      VAL  71   5.388   8.088  -5.305
  518   1HG2  VAL  71          21HG      VAL  71   5.955   6.383  -2.804
  519   2HG2  VAL  71          22HG      VAL  71   4.554   7.432  -3.086
  520   3HG2  VAL  71          23HG      VAL  71   5.547   7.657  -1.650
  521    H    THR  72           H        THR  72   6.994  10.418  -1.682
  522    HA   THR  72           HA       THR  72   7.907   9.652   0.969
  523    HB   THR  72           HB       THR  72   6.910  11.934   1.459
  524    HG1  THR  72           HG1      THR  72   7.126  12.749  -1.105
  525   1HG2  THR  72          21HG      THR  72   8.833  13.132   0.492
  526   2HG2  THR  72          22HG      THR  72   9.156  11.754  -0.568
  527   3HG2  THR  72          23HG      THR  72   9.307  11.584   1.183
  528    H    GLN  73           H        GLN  73   6.357  10.308   2.690
  529    HA   GLN  73           HA       GLN  73   4.185   8.535   2.471
  530   1HB   GLN  73          1HB       GLN  73   3.835   8.780   4.749
  531   2HB   GLN  73          2HB       GLN  73   5.472   9.378   4.639
  532   1HG   GLN  73          1HG       GLN  73   3.021  11.108   4.713
  533   2HG   GLN  73          2HG       GLN  73   3.999  10.704   6.118
  534   1HE2  GLN  73          21HE      GLN  73   6.528  10.895   4.657
  535   2HE2  GLN  73          22HE      GLN  73   6.741  12.573   4.388
  536    H    ASN  74           H        ASN  74   4.467  11.955   1.945
  537    HA   ASN  74           HA       ASN  74   1.674  12.424   2.032
  538   1HB   ASN  74          1HB       ASN  74   2.108  14.626   0.986
  539   2HB   ASN  74          2HB       ASN  74   3.177  14.337   2.353
  540   1HD2  ASN  74          21HD      ASN  74   5.385  14.287   1.996
  541   2HD2  ASN  74          22HD      ASN  74   6.070  14.576   0.444
  542    H    PHE  75           H        PHE  75   3.883  11.541  -0.574
  543    HA   PHE  75           HA       PHE  75   1.973  11.841  -2.645
  544   1HB   PHE  75          1HB       PHE  75   4.463  11.534  -3.045
  545   2HB   PHE  75          2HB       PHE  75   4.239   9.857  -2.571
  546    HD1  PHE  75           HD1      PHE  75   2.934   8.253  -4.052
  547    HD2  PHE  75           HD2      PHE  75   3.759  12.290  -5.235
  548    HE1  PHE  75           HE1      PHE  75   2.361   7.695  -6.359
  549    HE2  PHE  75           HE2      PHE  75   3.177  11.706  -7.554
  550    HZ   PHE  75           HZ       PHE  75   2.484   9.414  -8.116
  551    H    ALA  76           H        ALA  76   3.110   9.100  -0.752
  552    HA   ALA  76           HA       ALA  76   1.464   7.174  -1.883
  553   1HB   ALA  76          1HB       ALA  76   2.576   7.208   0.910
  554   2HB   ALA  76          2HB       ALA  76   3.421   6.659  -0.545
  555   3HB   ALA  76          3HB       ALA  76   1.992   5.793   0.025
  556    H    ALA  77           H        ALA  77   0.927   9.141   1.050
  557    HA   ALA  77           HA       ALA  77  -1.523   8.027   1.766
  558   1HB   ALA  77          1HB       ALA  77  -0.627  10.882   2.138
  559   2HB   ALA  77          2HB       ALA  77  -0.261   9.542   3.224
  560   3HB   ALA  77          3HB       ALA  77  -1.931  10.083   3.019
  561    H    THR  78           H        THR  78  -0.754  10.554  -0.547
  562    HA   THR  78           HA       THR  78  -3.394  11.295  -1.136
  563    HB   THR  78           HB       THR  78  -0.873  11.430  -2.763
  564    HG1  THR  78           HG1      THR  78  -0.599  12.841  -1.181
  565   1HG2  THR  78          21HG      THR  78  -3.518  12.803  -3.297
  566   2HG2  THR  78          22HG      THR  78  -2.795  11.495  -4.237
  567   3HG2  THR  78          23HG      THR  78  -2.013  13.078  -4.195
  568    H    VAL  79           H        VAL  79  -1.259   8.854  -2.586
  569    HA   VAL  79           HA       VAL  79  -3.003   7.986  -4.616
  570    HB   VAL  79           HB       VAL  79  -1.034   6.256  -3.082
  571   1HG1  VAL  79          11HG      VAL  79  -1.008   4.852  -5.103
  572   2HG1  VAL  79          12HG      VAL  79  -2.172   5.927  -5.867
  573   3HG1  VAL  79          13HG      VAL  79  -2.644   4.995  -4.461
  574   1HG2  VAL  79          21HG      VAL  79   0.519   6.804  -4.951
  575   2HG2  VAL  79          22HG      VAL  79   0.120   8.151  -3.894
  576   3HG2  VAL  79          23HG      VAL  79  -0.650   8.031  -5.473
  577    H    LEU  80           H        LEU  80  -2.466   6.723  -1.358
  578    HA   LEU  80           HA       LEU  80  -4.596   4.861  -1.447
  579   1HB   LEU  80          1HB       LEU  80  -2.964   5.947   0.835
  580   2HB   LEU  80          2HB       LEU  80  -4.279   4.834   1.101
  581    HG   LEU  80           HG       LEU  80  -2.277   3.579   1.176
  582   1HD1  LEU  80          11HD      LEU  80  -2.570   1.946  -0.522
  583   2HD1  LEU  80          12HD      LEU  80  -3.415   3.100  -1.543
  584   3HD1  LEU  80          13HD      LEU  80  -4.151   2.568  -0.029
  585   1HD2  LEU  80          21HD      LEU  80  -0.775   5.120   0.015
  586   2HD2  LEU  80          22HD      LEU  80  -1.516   4.676  -1.524
  587   3HD2  LEU  80          23HD      LEU  80  -0.630   3.473  -0.587
  588    H    ARG  81           H        ARG  81  -4.741   8.097  -1.298
  589    HA   ARG  81           HA       ARG  81  -7.271   8.214   0.164
  590   1HB   ARG  81          1HB       ARG  81  -5.649   9.939   0.740
  591   2HB   ARG  81          2HB       ARG  81  -5.445  10.370  -0.942
  592   1HG   ARG  81          1HG       ARG  81  -8.131  10.684   0.308
  593   2HG   ARG  81          2HG       ARG  81  -6.864  11.845   0.706
  594   1HD   ARG  81          1HD       ARG  81  -6.615  12.440  -1.615
  595   2HD   ARG  81          2HD       ARG  81  -7.718  11.164  -2.110
  596    HE   ARG  81           HE       ARG  81  -9.126  12.642  -0.314
  597   1HH1  ARG  81          11HH      ARG  81  -7.545  13.552  -3.356
  598   2HH1  ARG  81          12HH      ARG  81  -8.742  14.669  -3.800
  599   1HH2  ARG  81          21HH      ARG  81 -10.785  14.140  -0.961
  600   2HH2  ARG  81          22HH      ARG  81 -10.669  15.010  -2.411
  601    H    ASN  82           H        ASN  82  -5.920   8.315  -3.001
  602    HA   ASN  82           HA       ASN  82  -8.313   9.314  -4.265
  603   1HB   ASN  82          1HB       ASN  82  -5.558   8.725  -5.151
  604   2HB   ASN  82          2HB       ASN  82  -6.812   8.694  -6.386
  605   1HD2  ASN  82          21HD      ASN  82  -5.178  10.629  -4.015
  606   2HD2  ASN  82          22HD      ASN  82  -5.694  12.154  -4.655
  607    H    THR  83           H        THR  83  -7.420   6.454  -3.098
  608    HA   THR  83           HA       THR  83  -8.055   4.577  -5.052
  609    HB   THR  83           HB       THR  83  -8.480   3.171  -2.962
  610    HG1  THR  83           HG1      THR  83  -8.845   5.316  -1.822
  611   1HG2  THR  83          21HG      THR  83  -6.047   3.124  -2.460
  612   2HG2  THR  83          22HG      THR  83  -5.854   4.649  -3.320
  613   3HG2  THR  83          23HG      THR  83  -6.337   3.201  -4.195
  614    H    LYS  84           H        LYS  84  -9.873   3.374  -5.358
  615    HA   LYS  84           HA       LYS  84 -12.419   4.342  -4.327
  616   1HB   LYS  84          1HB       LYS  84 -13.143   3.362  -6.778
  617   2HB   LYS  84          2HB       LYS  84 -12.756   5.041  -6.483
  618   1HG   LYS  84          1HG       LYS  84 -11.686   4.368  -8.491
  619   2HG   LYS  84          2HG       LYS  84 -10.449   4.593  -7.263
  620   1HD   LYS  84          1HD       LYS  84 -10.387   2.135  -6.961
  621   2HD   LYS  84          2HD       LYS  84 -11.548   1.972  -8.282
  622   1HE   LYS  84          1HE       LYS  84 -10.004   3.178  -9.783
  623   2HE   LYS  84          2HE       LYS  84  -8.821   3.280  -8.486
  624   1HZ   LYS  84          1HZ       LYS  84  -8.909   0.718  -8.548
  625   2HZ   LYS  84          2HZ       LYS  84  -8.118   1.546  -9.762
  626   3HZ   LYS  84          3HZ       LYS  84  -9.642   0.912 -10.066
  627    H    GLY  85           H        GLY  85 -13.853   2.203  -5.634
  628   1HA   GLY  85          1HA       GLY  85 -13.807   0.284  -3.659
  629   2HA   GLY  85          2HA       GLY  85 -14.514   0.066  -5.246
  630    H    ASN  86           H        ASN  86 -12.983  -0.618  -6.975
  631    HA   ASN  86           HA       ASN  86 -11.383  -2.762  -5.921
  632   1HB   ASN  86          1HB       ASN  86 -12.257  -2.035  -8.687
  633   2HB   ASN  86          2HB       ASN  86 -10.887  -3.117  -8.475
  634   1HD2  ASN  86          21HD      ASN  86 -14.346  -2.726  -7.887
  635   2HD2  ASN  86          22HD      ASN  86 -14.644  -4.389  -7.570
  636    H    VAL  87           H        VAL  87  -9.523  -2.478  -5.223
  637    HA   VAL  87           HA       VAL  87  -7.718  -0.590  -6.586
  638    HB   VAL  87           HB       VAL  87  -7.425  -1.437  -3.751
  639   1HG1  VAL  87          11HG      VAL  87  -5.514  -0.527  -4.743
  640   2HG1  VAL  87          12HG      VAL  87  -6.141   0.622  -3.550
  641   3HG1  VAL  87          13HG      VAL  87  -6.386   0.913  -5.282
  642   1HG2  VAL  87          21HG      VAL  87  -9.554  -0.526  -3.800
  643   2HG2  VAL  87          22HG      VAL  87  -9.043   0.872  -4.760
  644   3HG2  VAL  87          23HG      VAL  87  -8.494   0.695  -3.084
  645    H    ARG  88           H        ARG  88  -5.911  -1.521  -7.310
  646    HA   ARG  88           HA       ARG  88  -5.252  -4.188  -6.340
  647   1HB   ARG  88          1HB       ARG  88  -4.371  -2.675  -8.799
  648   2HB   ARG  88          2HB       ARG  88  -3.688  -4.222  -8.314
  649   1HG   ARG  88          1HG       ARG  88  -5.896  -5.263  -8.492
  650   2HG   ARG  88          2HG       ARG  88  -6.591  -3.713  -8.949
  651   1HD   ARG  88          1HD       ARG  88  -5.290  -3.672 -10.956
  652   2HD   ARG  88          2HD       ARG  88  -4.445  -5.157 -10.481
  653    HE   ARG  88           HE       ARG  88  -7.196  -5.684 -10.508
  654   1HH1  ARG  88          11HH      ARG  88  -4.662  -4.943 -12.882
  655   2HH1  ARG  88          12HH      ARG  88  -5.412  -5.778 -14.144
  656   1HH2  ARG  88          21HH      ARG  88  -8.177  -6.843 -12.177
  657   2HH2  ARG  88          22HH      ARG  88  -7.486  -6.918 -13.743
  658    H    PHE  89           H        PHE  89  -4.305  -3.961  -4.542
  659    HA   PHE  89           HA       PHE  89  -2.157  -2.039  -4.122
  660   1HB   PHE  89          1HB       PHE  89  -3.212  -4.229  -2.317
  661   2HB   PHE  89          2HB       PHE  89  -2.031  -3.016  -1.888
  662    HD1  PHE  89           HD1      PHE  89  -5.561  -3.684  -2.553
  663    HD2  PHE  89           HD2      PHE  89  -2.694  -0.824  -1.314
  664    HE1  PHE  89           HE1      PHE  89  -7.359  -2.254  -1.664
  665    HE2  PHE  89           HE2      PHE  89  -4.475   0.598  -0.440
  666    HZ   PHE  89           HZ       PHE  89  -6.808  -0.117  -0.606
  667    H    VAL  90           H        VAL  90  -0.363  -2.738  -5.234
  668    HA   VAL  90           HA       VAL  90   0.225  -5.559  -5.092
  669    HB   VAL  90           HB       VAL  90   1.820  -3.356  -6.403
  670   1HG1  VAL  90          11HG      VAL  90   1.961  -6.358  -6.684
  671   2HG1  VAL  90          12HG      VAL  90   3.167  -5.315  -5.921
  672   3HG1  VAL  90          13HG      VAL  90   2.872  -5.208  -7.657
  673   1HG2  VAL  90          21HG      VAL  90  -0.147  -5.260  -7.674
  674   2HG2  VAL  90          22HG      VAL  90   0.875  -4.107  -8.534
  675   3HG2  VAL  90          23HG      VAL  90  -0.379  -3.529  -7.439
  676    H    ILE  91           H        ILE  91   0.635  -5.836  -3.100
  677    HA   ILE  91           HA       ILE  91   2.902  -4.486  -1.833
  678    HB   ILE  91           HB       ILE  91   0.539  -6.043  -0.779
  679   1HG1  ILE  91          11HG      ILE  91   1.325  -3.176  -0.294
  680   2HG1  ILE  91          12HG      ILE  91   0.160  -3.653  -1.516
  681   1HG2  ILE  91          21HG      ILE  91   1.312  -5.652   1.465
  682   2HG2  ILE  91          22HG      ILE  91   2.750  -4.820   0.872
  683   3HG2  ILE  91          23HG      ILE  91   2.541  -6.549   0.572
  684   1HD1  ILE  91          11HD      ILE  91  -0.871  -2.847   0.409
  685   2HD1  ILE  91          12HD      ILE  91  -0.101  -4.120   1.400
  686   3HD1  ILE  91          13HD      ILE  91  -1.243  -4.547   0.090
  687    H    GLY  92           H        GLY  92   4.430  -5.933  -0.780
  688   1HA   GLY  92          1HA       GLY  92   4.263  -8.619  -1.895
  689   2HA   GLY  92          2HA       GLY  92   5.795  -7.790  -1.790
  690    H    ARG  93           H        ARG  93   5.069 -10.313  -0.593
  691    HA   ARG  93           HA       ARG  93   5.516  -9.538   2.178
  692   1HB   ARG  93          1HB       ARG  93   3.287 -10.542   2.042
  693   2HB   ARG  93          2HB       ARG  93   3.957 -11.964   1.253
  694   1HG   ARG  93          1HG       ARG  93   3.474 -12.461   3.570
  695   2HG   ARG  93          2HG       ARG  93   5.215 -12.499   3.300
  696   1HD   ARG  93          1HD       ARG  93   5.275 -10.112   4.167
  697   2HD   ARG  93          2HD       ARG  93   3.597 -10.343   4.653
  698    HE   ARG  93           HE       ARG  93   5.164 -12.438   5.657
  699   1HH1  ARG  93          11HH      ARG  93   4.476  -9.023   6.259
  700   2HH1  ARG  93          12HH      ARG  93   5.020  -9.012   7.865
  701   1HH2  ARG  93          21HH      ARG  93   5.975 -12.437   7.911
  702   2HH2  ARG  93          22HH      ARG  93   5.932 -11.000   8.793
  703    H    GLU  94           H        GLU  94   7.139 -10.415   3.245
  704    HA   GLU  94           HA       GLU  94   8.961 -12.060   1.780
  705   1HB   GLU  94          1HB       GLU  94  10.428 -11.554   3.841
  706   2HB   GLU  94          2HB       GLU  94  10.029 -10.215   2.777
  707   1HG   GLU  94          1HG       GLU  94   8.240  -9.538   4.381
  708   2HG   GLU  94          2HG       GLU  94   8.777 -10.821   5.461
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1   9.973 -15.941  -4.130
    2   2H    GLY   1          2H        GLY   1  11.489 -16.676  -4.210
    3   3H    GLY   1          3H        GLY   1  10.833 -15.930  -5.592
    4   1HA   GLY   1          1HA       GLY   1  12.530 -14.551  -4.567
    5   2HA   GLY   1          2HA       GLY   1  10.930 -13.810  -4.466
    6    H    HIS   2           H        HIS   2  13.123 -13.216  -2.716
    7    HA   HIS   2           HA       HIS   2  12.420 -14.579  -0.229
    8   1HB   HIS   2          1HB       HIS   2  14.848 -14.104  -0.955
    9   2HB   HIS   2          2HB       HIS   2  14.525 -12.415  -0.586
   10    HD1  HIS   2           HD1      HIS   2  15.192 -11.758   1.789
   11    HD2  HIS   2           HD2      HIS   2  14.378 -15.823   1.430
   12    HE1  HIS   2           HE1      HIS   2  15.726 -12.778   4.011
   13    H    MET   3           H        MET   3  11.106 -12.423  -1.931
   14    HA   MET   3           HA       MET   3   9.645 -11.213   0.231
   15   1HB   MET   3          1HB       MET   3  11.451  -9.519  -0.352
   16   2HB   MET   3          2HB       MET   3  10.839  -9.522  -1.999
   17   1HG   MET   3          1HG       MET   3   8.694  -8.691  -1.228
   18   2HG   MET   3          2HG       MET   3   9.258  -8.710   0.439
   19   1HE   MET   3          1HE       MET   3   8.687  -6.213   0.917
   20   2HE   MET   3          2HE       MET   3   7.928  -6.142  -0.673
   21   3HE   MET   3          3HE       MET   3   9.060  -4.883  -0.178
   22    H    GLU   4           H        GLU   4   7.657 -11.629  -0.299
   23    HA   GLU   4           HA       GLU   4   7.072 -12.479  -3.015
   24   1HB   GLU   4          1HB       GLU   4   6.225 -13.838  -1.108
   25   2HB   GLU   4          2HB       GLU   4   5.367 -12.390  -0.559
   26   1HG   GLU   4          1HG       GLU   4   3.995 -12.403  -2.578
   27   2HG   GLU   4          2HG       GLU   4   4.847 -13.816  -3.154
   28    H    LEU   5           H        LEU   5   6.835 -10.740  -4.307
   29    HA   LEU   5           HA       LEU   5   5.192  -8.558  -3.382
   30   1HB   LEU   5          1HB       LEU   5   6.355  -8.991  -6.154
   31   2HB   LEU   5          2HB       LEU   5   5.617  -7.522  -5.544
   32    HG   LEU   5           HG       LEU   5   7.847  -7.039  -5.527
   33   1HD1  LEU   5          11HD      LEU   5   6.812  -6.446  -3.442
   34   2HD1  LEU   5          12HD      LEU   5   8.532  -6.808  -3.243
   35   3HD1  LEU   5          13HD      LEU   5   7.321  -8.007  -2.781
   36   1HD2  LEU   5          21HD      LEU   5   8.469  -9.720  -4.303
   37   2HD2  LEU   5          22HD      LEU   5   9.643  -8.453  -4.659
   38   3HD2  LEU   5          23HD      LEU   5   8.768  -9.235  -5.973
   39    H    PHE   6           H        PHE   6   3.067  -8.651  -3.527
   40    HA   PHE   6           HA       PHE   6   1.967 -10.428  -5.513
   41   1HB   PHE   6          1HB       PHE   6   0.325 -11.163  -3.836
   42   2HB   PHE   6          2HB       PHE   6   1.928 -11.834  -3.614
   43    HD1  PHE   6           HD1      PHE   6   3.262 -10.806  -1.674
   44    HD2  PHE   6           HD2      PHE   6  -0.829 -10.027  -2.325
   45    HE1  PHE   6           HE1      PHE   6   3.071 -10.072   0.641
   46    HE2  PHE   6           HE2      PHE   6  -1.068  -9.261   0.023
   47    HZ   PHE   6           HZ       PHE   6   0.894  -9.281   1.514
   48    HA   PRO   7           HA       PRO   7  -0.945  -7.129  -6.026
   49   1HB   PRO   7          1HB       PRO   7  -2.455  -8.302  -7.825
   50   2HB   PRO   7          2HB       PRO   7  -0.813  -7.785  -8.211
   51   1HG   PRO   7          1HG       PRO   7  -1.768 -10.559  -7.453
   52   2HG   PRO   7          2HG       PRO   7  -0.685 -10.105  -8.799
   53   1HD   PRO   7          1HD       PRO   7   0.092 -11.055  -6.380
   54   2HD   PRO   7          2HD       PRO   7   1.103  -9.968  -7.353
   55    H    VAL   8           H        VAL   8  -2.550  -6.728  -4.693
   56    HA   VAL   8           HA       VAL   8  -4.484  -8.848  -4.151
   57    HB   VAL   8           HB       VAL   8  -3.998  -6.380  -2.477
   58   1HG1  VAL   8          11HG      VAL   8  -5.283  -7.507  -0.746
   59   2HG1  VAL   8          12HG      VAL   8  -5.575  -8.854  -1.848
   60   3HG1  VAL   8          13HG      VAL   8  -6.217  -7.252  -2.220
   61   1HG2  VAL   8          21HG      VAL   8  -2.997  -9.166  -1.980
   62   2HG2  VAL   8          22HG      VAL   8  -2.859  -7.800  -0.857
   63   3HG2  VAL   8          23HG      VAL   8  -2.038  -7.755  -2.427
   64    H    GLU   9           H        GLU   9  -6.272  -8.429  -5.363
   65    HA   GLU   9           HA       GLU   9  -6.847  -5.629  -5.904
   66   1HB   GLU   9          1HB       GLU   9  -6.825  -7.171  -7.869
   67   2HB   GLU   9          2HB       GLU   9  -8.144  -8.075  -7.137
   68   1HG   GLU   9          1HG       GLU   9  -9.582  -6.087  -7.271
   69   2HG   GLU   9          2HG       GLU   9  -8.241  -5.190  -7.986
   70    H    LEU  10           H        LEU  10  -7.948  -4.736  -4.393
   71    HA   LEU  10           HA       LEU  10  -9.657  -6.332  -2.645
   72   1HB   LEU  10          1HB       LEU  10  -7.822  -4.420  -2.215
   73   2HB   LEU  10          2HB       LEU  10  -9.249  -3.412  -2.330
   74    HG   LEU  10           HG       LEU  10  -8.830  -3.776  -0.040
   75   1HD1  LEU  10          11HD      LEU  10 -11.174  -3.925  -0.543
   76   2HD1  LEU  10          12HD      LEU  10 -10.760  -4.989   0.802
   77   3HD1  LEU  10          13HD      LEU  10 -11.024  -5.660  -0.803
   78   1HD2  LEU  10          21HD      LEU  10  -7.294  -5.625  -0.225
   79   2HD2  LEU  10          22HD      LEU  10  -8.616  -6.716  -0.632
   80   3HD2  LEU  10          23HD      LEU  10  -8.540  -5.978   0.968
   81    H    GLU  11           H        GLU  11 -11.855  -5.943  -2.603
   82    HA   GLU  11           HA       GLU  11 -12.900  -3.987  -4.509
   83   1HB   GLU  11          1HB       GLU  11 -13.632  -6.321  -4.871
   84   2HB   GLU  11          2HB       GLU  11 -14.222  -6.391  -3.219
   85   1HG   GLU  11          1HG       GLU  11 -16.180  -6.002  -4.460
   86   2HG   GLU  11          2HG       GLU  11 -15.628  -4.409  -3.886
   87    H    LYS  12           H        LYS  12 -12.689  -2.215  -3.165
   88    HA   LYS  12           HA       LYS  12 -13.800  -2.263  -0.535
   89   1HB   LYS  12          1HB       LYS  12 -12.063  -0.465  -2.061
   90   2HB   LYS  12          2HB       LYS  12 -13.085   0.328  -0.883
   91   1HG   LYS  12          1HG       LYS  12 -11.070  -1.868  -0.414
   92   2HG   LYS  12          2HG       LYS  12 -10.933  -0.173   0.061
   93   1HD   LYS  12          1HD       LYS  12 -13.380  -1.215   1.116
   94   2HD   LYS  12          2HD       LYS  12 -12.097  -2.349   1.517
   95   1HE   LYS  12          1HE       LYS  12 -12.401  -0.839   3.318
   96   2HE   LYS  12          2HE       LYS  12 -10.861  -0.478   2.608
   97   1HZ   LYS  12          1HZ       LYS  12 -12.056   1.644   3.008
   98   2HZ   LYS  12          2HZ       LYS  12 -13.408   1.039   2.254
   99   3HZ   LYS  12          3HZ       LYS  12 -12.073   1.399   1.335
  100    H    ASP  13           H        ASP  13 -14.721   0.076  -0.082
  101    HA   ASP  13           HA       ASP  13 -17.382   0.081  -1.192
  102   1HB   ASP  13          1HB       ASP  13 -17.704   1.710   0.741
  103   2HB   ASP  13          2HB       ASP  13 -17.246   0.065   1.183
  104    H    GLU  14           H        GLU  14 -18.182   2.625  -0.861
  105    HA   GLU  14           HA       GLU  14 -17.071   3.878  -3.194
  106   1HB   GLU  14          1HB       GLU  14 -18.916   5.436  -3.018
  107   2HB   GLU  14          2HB       GLU  14 -19.467   3.765  -2.939
  108   1HG   GLU  14          1HG       GLU  14 -19.684   3.959  -0.526
  109   2HG   GLU  14          2HG       GLU  14 -19.126   5.628  -0.606
  110    H    ASP  15           H        ASP  15 -16.349   4.128   0.055
  111    HA   ASP  15           HA       ASP  15 -15.688   6.955   0.008
  112   1HB   ASP  15          1HB       ASP  15 -16.268   6.050   2.152
  113   2HB   ASP  15          2HB       ASP  15 -15.112   4.748   1.977
  114    H    GLY  16           H        GLY  16 -14.232   3.926  -0.388
  115   1HA   GLY  16          1HA       GLY  16 -12.443   3.902  -2.118
  116   2HA   GLY  16          2HA       GLY  16 -11.737   5.247  -1.223
  117    H    LEU  17           H        LEU  17 -10.357   4.800   0.316
  118    HA   LEU  17           HA       LEU  17 -10.171   1.974   1.147
  119   1HB   LEU  17          1HB       LEU  17  -8.291   2.886  -0.359
  120   2HB   LEU  17          2HB       LEU  17  -7.916   3.910   0.991
  121    HG   LEU  17           HG       LEU  17  -7.182   2.135   2.264
  122   1HD1  LEU  17          11HD      LEU  17  -8.949   0.493   1.814
  123   2HD1  LEU  17          12HD      LEU  17  -7.386  -0.230   1.443
  124   3HD1  LEU  17          13HD      LEU  17  -8.426   0.363   0.141
  125   1HD2  LEU  17          21HD      LEU  17  -5.743   2.921   0.502
  126   2HD2  LEU  17          22HD      LEU  17  -6.417   1.712  -0.593
  127   3HD2  LEU  17          23HD      LEU  17  -5.504   1.208   0.830
  128    H    GLY  18           H        GLY  18  -8.986   5.150   2.138
  129   1HA   GLY  18          1HA       GLY  18  -9.222   6.232   4.135
  130   2HA   GLY  18          2HA       GLY  18 -10.390   5.001   4.596
  131    H    ILE  19           H        ILE  19  -7.092   4.269   3.628
  132    HA   ILE  19           HA       ILE  19  -6.653   3.377   6.386
  133    HB   ILE  19           HB       ILE  19  -4.864   1.988   5.600
  134   1HG1  ILE  19          11HG      ILE  19  -5.351   3.137   2.838
  135   2HG1  ILE  19          12HG      ILE  19  -3.967   3.490   3.858
  136   1HG2  ILE  19          21HG      ILE  19  -6.137   0.557   3.937
  137   2HG2  ILE  19          22HG      ILE  19  -7.423   1.792   4.056
  138   3HG2  ILE  19          23HG      ILE  19  -6.911   0.923   5.465
  139   1HD1  ILE  19          11HD      ILE  19  -4.697   0.831   2.698
  140   2HD1  ILE  19          12HD      ILE  19  -3.309   1.118   3.757
  141   3HD1  ILE  19          13HD      ILE  19  -3.391   1.880   2.160
  142    H    SER  20           H        SER  20  -4.246   3.483   6.993
  143    HA   SER  20           HA       SER  20  -3.309   6.210   6.444
  144   1HB   SER  20          1HB       SER  20  -3.166   4.606   9.003
  145   2HB   SER  20          2HB       SER  20  -2.583   6.252   8.779
  146    HG   SER  20           HG       SER  20  -4.911   6.569   8.053
  147    H    ILE  21           H        ILE  21  -1.119   6.452   6.282
  148    HA   ILE  21           HA       ILE  21   0.413   3.972   6.001
  149    HB   ILE  21           HB       ILE  21   1.636   5.065   4.153
  150   1HG1  ILE  21          11HG      ILE  21   0.164   7.060   3.090
  151   2HG1  ILE  21          12HG      ILE  21  -0.233   7.292   4.767
  152   1HG2  ILE  21          21HG      ILE  21  -0.087   4.848   2.429
  153   2HG2  ILE  21          22HG      ILE  21  -1.325   4.827   3.685
  154   3HG2  ILE  21          23HG      ILE  21  -0.130   3.530   3.599
  155   1HD1  ILE  21          11HD      ILE  21   2.576   7.318   3.672
  156   2HD1  ILE  21          12HD      ILE  21   2.116   7.608   5.337
  157   3HD1  ILE  21          13HD      ILE  21   1.634   8.734   4.086
  158    H    ILE  22           H        ILE  22   2.763   4.352   6.255
  159    HA   ILE  22           HA       ILE  22   3.307   6.812   7.638
  160    HB   ILE  22           HB       ILE  22   3.071   5.171   9.387
  161   1HG1  ILE  22          11HG      ILE  22   5.996   5.865   8.995
  162   2HG1  ILE  22          12HG      ILE  22   4.779   6.940   9.661
  163   1HG2  ILE  22          21HG      ILE  22   5.219   3.591   7.996
  164   2HG2  ILE  22          22HG      ILE  22   3.517   3.137   8.187
  165   3HG2  ILE  22          23HG      ILE  22   4.573   3.224   9.599
  166   1HD1  ILE  22          11HD      ILE  22   5.739   4.362  10.873
  167   2HD1  ILE  22          12HD      ILE  22   4.496   5.415  11.559
  168   3HD1  ILE  22          13HD      ILE  22   6.155   5.991  11.409
  169    H    GLY  23           H        GLY  23   5.187   7.801   7.067
  170   1HA   GLY  23          1HA       GLY  23   6.579   6.499   4.896
  171   2HA   GLY  23          2HA       GLY  23   6.606   8.237   5.217
  172    H    MET  24           H        MET  24   8.143   5.327   5.495
  173    HA   MET  24           HA       MET  24  10.314   6.553   6.941
  174   1HB   MET  24          1HB       MET  24  10.572   4.491   8.413
  175   2HB   MET  24          2HB       MET  24   9.281   5.602   8.845
  176   1HG   MET  24          1HG       MET  24   7.662   4.133   7.759
  177   2HG   MET  24          2HG       MET  24   8.951   3.017   7.338
  178   1HE   MET  24          1HE       MET  24  10.306   1.587   9.085
  179   2HE   MET  24          2HE       MET  24  10.067   1.656  10.829
  180   3HE   MET  24          3HE       MET  24  10.768   3.035   9.984
  181    H    GLY  25           H        GLY  25  11.335   6.680   5.168
  182   1HA   GLY  25          1HA       GLY  25  11.673   4.827   3.150
  183   2HA   GLY  25          2HA       GLY  25  12.802   6.104   3.551
  184    H    VAL  26           H        VAL  26  12.361   2.870   3.298
  185    HA   VAL  26           HA       VAL  26  14.841   2.306   4.754
  186    HB   VAL  26           HB       VAL  26  12.751   1.465   5.882
  187   1HG1  VAL  26          11HG      VAL  26  11.662  -0.547   4.964
  188   2HG1  VAL  26          12HG      VAL  26  12.515  -0.258   3.443
  189   3HG1  VAL  26          13HG      VAL  26  11.363   0.933   4.052
  190   1HG2  VAL  26          21HG      VAL  26  14.689  -0.666   4.978
  191   2HG2  VAL  26          22HG      VAL  26  13.586  -0.816   6.346
  192   3HG2  VAL  26          23HG      VAL  26  14.870   0.393   6.377
  193    H    GLY  27           H        GLY  27  15.913   0.279   3.801
  194   1HA   GLY  27          1HA       GLY  27  16.009  -1.337   2.046
  195   2HA   GLY  27          2HA       GLY  27  15.117  -0.217   1.026
  196    H    ALA  28           H        ALA  28  16.919   1.907   2.296
  197    HA   ALA  28           HA       ALA  28  18.696   1.999   0.088
  198   1HB   ALA  28          1HB       ALA  28  19.460   4.112   1.039
  199   2HB   ALA  28          2HB       ALA  28  18.602   3.756   2.539
  200   3HB   ALA  28          3HB       ALA  28  17.702   4.028   1.051
  201    H    ASP  29           H        ASP  29  19.022   1.301   3.478
  202    HA   ASP  29           HA       ASP  29  21.855   1.022   3.528
  203   1HB   ASP  29          1HB       ASP  29  20.732   1.263   5.634
  204   2HB   ASP  29          2HB       ASP  29  19.708  -0.132   5.318
  205    H    ALA  30           H        ALA  30  19.240  -1.170   2.875
  206    HA   ALA  30           HA       ALA  30  20.790  -3.524   2.687
  207   1HB   ALA  30          1HB       ALA  30  18.852  -4.513   1.584
  208   2HB   ALA  30          2HB       ALA  30  18.147  -2.912   1.363
  209   3HB   ALA  30          3HB       ALA  30  18.349  -3.567   2.986
  210    H    GLY  31           H        GLY  31  20.222  -0.907   0.485
  211   1HA   GLY  31          1HA       GLY  31  21.796  -0.535  -1.297
  212   2HA   GLY  31          2HA       GLY  31  21.923  -2.286  -1.454
  213    H    LEU  32           H        LEU  32  18.828  -1.980  -1.049
  214    HA   LEU  32           HA       LEU  32  18.324  -2.187  -3.895
  215   1HB   LEU  32          1HB       LEU  32  16.495  -2.597  -1.538
  216   2HB   LEU  32          2HB       LEU  32  15.951  -2.693  -3.196
  217    HG   LEU  32           HG       LEU  32  17.605  -4.590  -3.499
  218   1HD1  LEU  32          11HD      LEU  32  19.040  -4.182  -1.590
  219   2HD1  LEU  32          12HD      LEU  32  18.325  -5.794  -1.509
  220   3HD1  LEU  32          13HD      LEU  32  17.693  -4.498  -0.495
  221   1HD2  LEU  32          21HD      LEU  32  15.357  -4.950  -1.531
  222   2HD2  LEU  32          22HD      LEU  32  16.126  -6.236  -2.459
  223   3HD2  LEU  32          23HD      LEU  32  15.224  -4.972  -3.288
  224    H    GLU  33           H        GLU  33  17.722  -0.001  -1.300
  225    HA   GLU  33           HA       GLU  33  16.697   1.973  -1.074
  226   1HB   GLU  33          1HB       GLU  33  17.289   2.261  -4.024
  227   2HB   GLU  33          2HB       GLU  33  16.842   3.580  -2.946
  228   1HG   GLU  33          1HG       GLU  33  18.904   3.196  -1.666
  229   2HG   GLU  33          2HG       GLU  33  19.350   1.913  -2.794
  230    H    LYS  34           H        LYS  34  14.727   0.971  -0.554
  231    HA   LYS  34           HA       LYS  34  12.785   0.590  -2.649
  232   1HB   LYS  34          1HB       LYS  34  13.595  -1.046  -0.754
  233   2HB   LYS  34          2HB       LYS  34  12.634   0.020   0.255
  234   1HG   LYS  34          1HG       LYS  34  11.350  -1.806  -0.207
  235   2HG   LYS  34          2HG       LYS  34  10.712  -0.464  -1.169
  236   1HD   LYS  34          1HD       LYS  34  11.760  -1.316  -3.175
  237   2HD   LYS  34          2HD       LYS  34  12.600  -2.564  -2.256
  238   1HE   LYS  34          1HE       LYS  34  10.424  -3.578  -1.692
  239   2HE   LYS  34          2HE       LYS  34   9.618  -2.346  -2.663
  240   1HZ   LYS  34          1HZ       LYS  34  10.753  -3.156  -4.596
  241   2HZ   LYS  34          2HZ       LYS  34   9.920  -4.416  -3.921
  242   3HZ   LYS  34          3HZ       LYS  34  11.597  -4.306  -3.737
  243    H    LEU  35           H        LEU  35  10.546   1.353  -1.743
  244    HA   LEU  35           HA       LEU  35  10.647   3.955  -0.652
  245   1HB   LEU  35          1HB       LEU  35   8.256   3.864  -0.740
  246   2HB   LEU  35          2HB       LEU  35   8.883   3.089  -2.183
  247    HG   LEU  35           HG       LEU  35   8.244   1.277   0.070
  248   1HD1  LEU  35          11HD      LEU  35   6.417   2.875   0.121
  249   2HD1  LEU  35          12HD      LEU  35   5.900   1.292  -0.431
  250   3HD1  LEU  35          13HD      LEU  35   6.128   2.602  -1.600
  251   1HD2  LEU  35          21HD      LEU  35   7.424  -0.124  -1.724
  252   2HD2  LEU  35          22HD      LEU  35   9.044   0.430  -2.133
  253   3HD2  LEU  35          23HD      LEU  35   7.632   1.170  -2.891
  254    H    GLY  36           H        GLY  36   9.322   4.319   1.388
  255   1HA   GLY  36          1HA       GLY  36   9.556   2.034   3.204
  256   2HA   GLY  36          2HA       GLY  36  10.089   3.638   3.693
  257    H    ILE  37           H        ILE  37   7.269   2.896   1.760
  258    HA   ILE  37           HA       ILE  37   5.772   4.220   3.846
  259    HB   ILE  37           HB       ILE  37   4.764   3.472   1.094
  260   1HG1  ILE  37          11HG      ILE  37   6.670   5.134   1.172
  261   2HG1  ILE  37          12HG      ILE  37   5.195   5.771   0.399
  262   1HG2  ILE  37          21HG      ILE  37   3.646   5.249   3.263
  263   2HG2  ILE  37          22HG      ILE  37   3.020   3.687   2.767
  264   3HG2  ILE  37          23HG      ILE  37   2.950   5.054   1.652
  265   1HD1  ILE  37          11HD      ILE  37   4.796   6.852   2.685
  266   2HD1  ILE  37          12HD      ILE  37   6.141   7.458   1.729
  267   3HD1  ILE  37          13HD      ILE  37   6.452   6.342   3.056
  268    H    PHE  38           H        PHE  38   5.128   2.984   5.288
  269    HA   PHE  38           HA       PHE  38   4.260   0.278   4.624
  270   1HB   PHE  38          1HB       PHE  38   5.074   1.537   7.209
  271   2HB   PHE  38          2HB       PHE  38   4.438  -0.107   7.081
  272    HD1  PHE  38           HD1      PHE  38   5.700  -1.793   5.751
  273    HD2  PHE  38           HD2      PHE  38   7.305   2.003   6.713
  274    HE1  PHE  38           HE1      PHE  38   7.947  -2.632   5.244
  275    HE2  PHE  38           HE2      PHE  38   9.569   1.193   6.216
  276    HZ   PHE  38           HZ       PHE  38   9.886  -1.158   5.478
  277    H    VAL  39           H        VAL  39   2.446  -0.535   5.753
  278    HA   VAL  39           HA       VAL  39   0.288   1.339   5.719
  279    HB   VAL  39           HB       VAL  39   0.251  -1.547   6.672
  280   1HG1  VAL  39          11HG      VAL  39  -2.119  -1.453   6.096
  281   2HG1  VAL  39          12HG      VAL  39  -1.946   0.247   5.663
  282   3HG1  VAL  39          13HG      VAL  39  -1.694  -0.269   7.330
  283   1HG2  VAL  39          21HG      VAL  39   1.152  -1.456   4.392
  284   2HG2  VAL  39          22HG      VAL  39  -0.206  -0.474   3.882
  285   3HG2  VAL  39          23HG      VAL  39  -0.473  -2.147   4.384
  286    H    LYS  40           H        LYS  40  -0.173   2.532   7.362
  287    HA   LYS  40           HA       LYS  40   1.094   2.101   9.924
  288   1HB   LYS  40          1HB       LYS  40   1.130   4.332   9.029
  289   2HB   LYS  40          2HB       LYS  40  -0.601   4.314   8.779
  290   1HG   LYS  40          1HG       LYS  40   0.001   5.712  10.648
  291   2HG   LYS  40          2HG       LYS  40  -0.956   4.328  11.174
  292   1HD   LYS  40          1HD       LYS  40   1.071   3.206  11.932
  293   2HD   LYS  40          2HD       LYS  40   2.041   4.579  11.380
  294   1HE   LYS  40          1HE       LYS  40   0.897   6.043  12.867
  295   2HE   LYS  40          2HE       LYS  40  -0.181   4.737  13.374
  296   1HZ   LYS  40          1HZ       LYS  40   2.771   4.763  13.808
  297   2HZ   LYS  40          2HZ       LYS  40   1.691   3.620  14.409
  298   3HZ   LYS  40          3HZ       LYS  40   1.637   5.216  14.946
  299    H    THR  41           H        THR  41  -2.166   2.516   8.603
  300    HA   THR  41           HA       THR  41  -3.245   0.747  10.620
  301    HB   THR  41           HB       THR  41  -4.753   3.202  10.071
  302    HG1  THR  41           HG1      THR  41  -3.637   4.093  12.106
  303   1HG2  THR  41          21HG      THR  41  -5.509   2.886  12.400
  304   2HG2  THR  41          22HG      THR  41  -4.379   1.542  12.561
  305   3HG2  THR  41          23HG      THR  41  -5.720   1.438  11.415
  306    H    VAL  42           H        VAL  42  -5.499   0.174   9.873
  307    HA   VAL  42           HA       VAL  42  -5.867   0.793   7.075
  308    HB   VAL  42           HB       VAL  42  -6.656  -1.847   8.382
  309   1HG1  VAL  42          11HG      VAL  42  -7.943  -1.259   6.420
  310   2HG1  VAL  42          12HG      VAL  42  -6.913  -2.661   6.093
  311   3HG1  VAL  42          13HG      VAL  42  -6.456  -1.057   5.498
  312   1HG2  VAL  42          21HG      VAL  42  -4.245  -1.757   8.397
  313   2HG2  VAL  42          22HG      VAL  42  -4.225  -1.313   6.689
  314   3HG2  VAL  42          23HG      VAL  42  -4.788  -2.911   7.180
  315    H    THR  43           H        THR  43  -8.281   0.611   6.576
  316    HA   THR  43           HA       THR  43  -9.759   1.943   8.593
  317    HB   THR  43           HB       THR  43 -10.068   2.458   6.169
  318    HG1  THR  43           HG1      THR  43 -11.972   2.995   6.839
  319   1HG2  THR  43          21HG      THR  43 -11.213  -0.286   6.128
  320   2HG2  THR  43          22HG      THR  43  -9.686   0.193   5.380
  321   3HG2  THR  43          23HG      THR  43 -11.229   0.831   4.745
  322    H    GLU  44           H        GLU  44 -11.429   1.130   9.665
  323    HA   GLU  44           HA       GLU  44 -11.327  -1.748  10.133
  324   1HB   GLU  44          1HB       GLU  44 -10.892  -0.127  11.955
  325   2HB   GLU  44          2HB       GLU  44 -12.513   0.495  11.734
  326   1HG   GLU  44          1HG       GLU  44 -13.430  -1.629  12.415
  327   2HG   GLU  44          2HG       GLU  44 -11.798  -2.277  12.614
  328    H    GLY  45           H        GLY  45 -13.294   0.854   9.223
  329   1HA   GLY  45          1HA       GLY  45 -15.608  -0.917   8.801
  330   2HA   GLY  45          2HA       GLY  45 -15.730   0.860   8.977
  331    H    GLY  46           H        GLY  46 -13.781  -1.349   7.098
  332   1HA   GLY  46          1HA       GLY  46 -15.085  -0.534   4.739
  333   2HA   GLY  46          2HA       GLY  46 -13.376  -0.084   4.901
  334    H    ALA  47           H        ALA  47 -14.610  -1.924   3.214
  335    HA   ALA  47           HA       ALA  47 -14.361  -4.574   3.935
  336   1HB   ALA  47          1HB       ALA  47 -15.531  -3.789   1.935
  337   2HB   ALA  47          2HB       ALA  47 -14.469  -5.160   1.618
  338   3HB   ALA  47          3HB       ALA  47 -13.972  -3.539   1.144
  339    H    ALA  48           H        ALA  48 -11.722  -2.655   3.996
  340    HA   ALA  48           HA       ALA  48  -9.795  -4.279   2.582
  341   1HB   ALA  48          1HB       ALA  48  -9.385  -1.890   2.852
  342   2HB   ALA  48          2HB       ALA  48  -8.103  -2.826   3.624
  343   3HB   ALA  48          3HB       ALA  48  -9.361  -2.082   4.605
  344    H    GLN  49           H        GLN  49 -10.383  -3.604   6.045
  345    HA   GLN  49           HA       GLN  49  -8.815  -5.885   6.781
  346   1HB   GLN  49          1HB       GLN  49 -10.568  -4.051   8.368
  347   2HB   GLN  49          2HB       GLN  49  -9.702  -5.405   9.111
  348   1HG   GLN  49          1HG       GLN  49  -7.597  -4.419   8.271
  349   2HG   GLN  49          2HG       GLN  49  -8.525  -3.056   7.660
  350   1HE2  GLN  49          21HE      GLN  49 -10.272  -3.175  10.063
  351   2HE2  GLN  49          22HE      GLN  49  -9.357  -2.412  11.307
  352    H    ARG  50           H        ARG  50 -11.955  -5.411   5.772
  353    HA   ARG  50           HA       ARG  50 -13.088  -7.657   7.075
  354   1HB   ARG  50          1HB       ARG  50 -13.944  -6.347   4.497
  355   2HB   ARG  50          2HB       ARG  50 -14.900  -7.483   5.422
  356   1HG   ARG  50          1HG       ARG  50 -13.898  -4.938   6.553
  357   2HG   ARG  50          2HG       ARG  50 -15.494  -5.033   5.766
  358   1HD   ARG  50          1HD       ARG  50 -14.520  -6.526   8.218
  359   2HD   ARG  50          2HD       ARG  50 -15.635  -5.160   8.192
  360    HE   ARG  50           HE       ARG  50 -16.412  -7.507   6.688
  361   1HH1  ARG  50          11HH      ARG  50 -16.765  -5.636   9.685
  362   2HH1  ARG  50          12HH      ARG  50 -18.215  -6.399  10.135
  363   1HH2  ARG  50          21HH      ARG  50 -18.399  -8.568   7.342
  364   2HH2  ARG  50          22HH      ARG  50 -19.159  -8.111   8.792
  365    H    ASP  51           H        ASP  51 -11.579  -6.924   3.946
  366    HA   ASP  51           HA       ASP  51 -11.724  -9.448   2.745
  367   1HB   ASP  51          1HB       ASP  51 -10.993  -7.356   1.589
  368   2HB   ASP  51          2HB       ASP  51  -9.464  -7.423   2.455
  369    H    GLY  52           H        GLY  52  -8.953  -8.012   4.434
  370   1HA   GLY  52          1HA       GLY  52  -7.732  -9.008   6.173
  371   2HA   GLY  52          2HA       GLY  52  -8.506 -10.534   5.820
  372    H    ARG  53           H        ARG  53  -7.521  -9.751   2.824
  373    HA   ARG  53           HA       ARG  53  -5.208 -11.427   2.919
  374   1HB   ARG  53          1HB       ARG  53  -6.849 -10.625   0.918
  375   2HB   ARG  53          2HB       ARG  53  -5.556  -9.479   0.684
  376   1HG   ARG  53          1HG       ARG  53  -5.275 -12.493   0.570
  377   2HG   ARG  53          2HG       ARG  53  -5.402 -11.430  -0.818
  378   1HD   ARG  53          1HD       ARG  53  -3.107 -11.990  -0.630
  379   2HD   ARG  53          2HD       ARG  53  -3.245 -10.357   0.013
  380    HE   ARG  53           HE       ARG  53  -3.150 -11.308   2.236
  381   1HH1  ARG  53          11HH      ARG  53  -1.851 -13.307  -0.406
  382   2HH1  ARG  53          12HH      ARG  53  -0.913 -14.263   0.619
  383   1HH2  ARG  53          21HH      ARG  53  -1.893 -12.635   3.611
  384   2HH2  ARG  53          22HH      ARG  53  -0.934 -13.891   2.975
  385    H    ILE  54           H        ILE  54  -5.803  -8.021   2.940
  386    HA   ILE  54           HA       ILE  54  -3.019  -7.299   2.726
  387    HB   ILE  54           HB       ILE  54  -5.046  -5.971   1.812
  388   1HG1  ILE  54          11HG      ILE  54  -3.103  -4.419   3.531
  389   2HG1  ILE  54          12HG      ILE  54  -2.694  -5.134   1.972
  390   1HG2  ILE  54          21HG      ILE  54  -5.187  -5.218   4.722
  391   2HG2  ILE  54          22HG      ILE  54  -6.461  -5.985   3.770
  392   3HG2  ILE  54          23HG      ILE  54  -5.997  -4.308   3.440
  393   1HD1  ILE  54          11HD      ILE  54  -4.411  -3.789   0.910
  394   2HD1  ILE  54          12HD      ILE  54  -3.185  -2.797   1.686
  395   3HD1  ILE  54          13HD      ILE  54  -4.782  -3.023   2.455
  396    H    GLN  55           H        GLN  55  -1.846  -6.230   4.530
  397    HA   GLN  55           HA       GLN  55  -3.095  -6.794   7.091
  398   1HB   GLN  55          1HB       GLN  55  -0.134  -7.104   6.550
  399   2HB   GLN  55          2HB       GLN  55  -1.018  -7.638   7.971
  400   1HG   GLN  55          1HG       GLN  55  -2.117  -9.363   6.694
  401   2HG   GLN  55          2HG       GLN  55  -1.394  -8.764   5.205
  402   1HE2  GLN  55          21HE      GLN  55   0.869  -8.904   5.010
  403   2HE2  GLN  55          22HE      GLN  55   1.754 -10.185   5.745
  404    H    VAL  56           H        VAL  56  -2.074  -5.504   8.858
  405    HA   VAL  56           HA       VAL  56  -1.724  -2.752   7.948
  406    HB   VAL  56           HB       VAL  56  -3.338  -3.444   9.790
  407   1HG1  VAL  56          11HG      VAL  56  -1.971  -5.011  11.005
  408   2HG1  VAL  56          12HG      VAL  56  -2.507  -3.712  12.067
  409   3HG1  VAL  56          13HG      VAL  56  -0.855  -3.724  11.448
  410   1HG2  VAL  56          21HG      VAL  56  -2.724  -1.094   9.490
  411   2HG2  VAL  56          22HG      VAL  56  -1.321  -1.327  10.519
  412   3HG2  VAL  56          23HG      VAL  56  -2.941  -1.471  11.198
  413    H    ASN  57           H        ASN  57   0.440  -4.959   7.912
  414    HA   ASN  57           HA       ASN  57   2.497  -3.285   9.150
  415   1HB   ASN  57          1HB       ASN  57   1.822  -5.081  10.756
  416   2HB   ASN  57          2HB       ASN  57   2.342  -6.284   9.594
  417   1HD2  ASN  57          21HD      ASN  57   3.423  -3.717  11.730
  418   2HD2  ASN  57          22HD      ASN  57   5.058  -4.257  11.849
  419    H    ASP  58           H        ASP  58   1.502  -3.997   6.454
  420    HA   ASP  58           HA       ASP  58   3.958  -5.101   5.305
  421   1HB   ASP  58          1HB       ASP  58   1.178  -4.843   4.166
  422   2HB   ASP  58          2HB       ASP  58   2.574  -5.172   3.158
  423    H    GLN  59           H        GLN  59   4.012  -4.098   2.877
  424    HA   GLN  59           HA       GLN  59   4.183  -1.189   3.246
  425   1HB   GLN  59          1HB       GLN  59   6.403  -2.197   3.235
  426   2HB   GLN  59          2HB       GLN  59   5.959  -3.071   1.766
  427   1HG   GLN  59          1HG       GLN  59   5.932  -1.088   0.475
  428   2HG   GLN  59          2HG       GLN  59   6.066  -0.081   1.911
  429   1HE2  GLN  59          21HE      GLN  59   7.996   0.158   2.882
  430   2HE2  GLN  59          22HE      GLN  59   9.491  -0.257   2.115
  431    H    ILE  60           H        ILE  60   3.220   0.012   1.707
  432    HA   ILE  60           HA       ILE  60   1.682  -1.304  -0.341
  433    HB   ILE  60           HB       ILE  60   2.211   1.666  -0.003
  434   1HG1  ILE  60          11HG      ILE  60   1.094   0.800   2.027
  435   2HG1  ILE  60          12HG      ILE  60   0.010   1.798   1.060
  436   1HG2  ILE  60          21HG      ILE  60  -0.002   0.236  -1.438
  437   2HG2  ILE  60          22HG      ILE  60   1.438   0.852  -2.209
  438   3HG2  ILE  60          23HG      ILE  60   0.296   1.979  -1.458
  439   1HD1  ILE  60          11HD      ILE  60  -1.053  -0.218   0.179
  440   2HD1  ILE  60          12HD      ILE  60  -1.157  -0.125   1.933
  441   3HD1  ILE  60          13HD      ILE  60   0.018  -1.206   1.177
  442    H    VAL  61           H        VAL  61   2.969  -2.135  -1.985
  443    HA   VAL  61           HA       VAL  61   5.413  -0.765  -2.661
  444    HB   VAL  61           HB       VAL  61   4.178  -3.319  -3.739
  445   1HG1  VAL  61          11HG      VAL  61   5.564  -2.308  -5.454
  446   2HG1  VAL  61          12HG      VAL  61   6.230  -3.809  -4.815
  447   3HG1  VAL  61          13HG      VAL  61   6.930  -2.254  -4.318
  448   1HG2  VAL  61          21HG      VAL  61   5.964  -4.439  -2.512
  449   2HG2  VAL  61          22HG      VAL  61   4.914  -3.503  -1.448
  450   3HG2  VAL  61          23HG      VAL  61   6.509  -2.883  -1.883
  451    H    GLU  62           H        GLU  62   2.412  -1.584  -4.315
  452    HA   GLU  62           HA       GLU  62   2.599   0.843  -5.884
  453   1HB   GLU  62          1HB       GLU  62   3.967  -0.658  -7.187
  454   2HB   GLU  62          2HB       GLU  62   2.722  -1.884  -7.187
  455   1HG   GLU  62          1HG       GLU  62   1.293  -0.449  -8.508
  456   2HG   GLU  62          2HG       GLU  62   2.519   0.817  -8.473
  457    H    VAL  63           H        VAL  63   0.608   1.630  -5.531
  458    HA   VAL  63           HA       VAL  63  -1.645  -0.201  -5.718
  459    HB   VAL  63           HB       VAL  63  -1.309   2.438  -4.272
  460   1HG1  VAL  63          11HG      VAL  63  -3.730   2.606  -4.008
  461   2HG1  VAL  63          12HG      VAL  63  -3.960   1.257  -5.131
  462   3HG1  VAL  63          13HG      VAL  63  -3.259   2.781  -5.701
  463   1HG2  VAL  63          21HG      VAL  63  -2.635  -0.175  -3.640
  464   2HG2  VAL  63          22HG      VAL  63  -2.332   1.152  -2.518
  465   3HG2  VAL  63          23HG      VAL  63  -0.986   0.251  -3.224
  466    H    ASP  64           H        ASP  64  -2.972  -0.191  -7.273
  467    HA   ASP  64           HA       ASP  64  -4.179   0.302  -9.095
  468   1HB   ASP  64          1HB       ASP  64  -4.770   2.451  -8.163
  469   2HB   ASP  64          2HB       ASP  64  -3.253   3.159  -8.698
  470    H    GLY  65           H        GLY  65  -1.060   0.915  -8.980
  471   1HA   GLY  65          1HA       GLY  65   0.485   0.139 -10.717
  472   2HA   GLY  65          2HA       GLY  65  -0.701   0.737 -11.890
  473    H    ILE  66           H        ILE  66  -0.460   2.750  -9.205
  474    HA   ILE  66           HA       ILE  66   0.552   4.950 -10.703
  475    HB   ILE  66           HB       ILE  66  -1.093   4.886  -8.583
  476   1HG1  ILE  66          11HG      ILE  66   1.007   7.039  -8.908
  477   2HG1  ILE  66          12HG      ILE  66  -0.404   6.862  -9.954
  478   1HG2  ILE  66          21HG      ILE  66   0.483   3.892  -7.029
  479   2HG2  ILE  66          22HG      ILE  66   0.075   5.534  -6.510
  480   3HG2  ILE  66          23HG      ILE  66   1.617   5.215  -7.301
  481   1HD1  ILE  66          11HD      ILE  66  -0.413   7.424  -7.019
  482   2HD1  ILE  66          12HD      ILE  66  -1.846   7.230  -8.031
  483   3HD1  ILE  66          13HD      ILE  66  -0.750   8.592  -8.299
  484    H    SER  67           H        SER  67   2.045   2.483  -8.988
  485    HA   SER  67           HA       SER  67   4.034   2.131  -8.020
  486   1HB   SER  67          1HB       SER  67   5.998   2.792  -9.554
  487   2HB   SER  67          2HB       SER  67   4.761   1.734 -10.227
  488    HG   SER  67           HG       SER  67   4.284   4.425 -10.514
  489    H    LEU  68           H        LEU  68   3.756   3.198  -6.171
  490    HA   LEU  68           HA       LEU  68   4.898   5.810  -6.025
  491   1HB   LEU  68          1HB       LEU  68   3.776   5.999  -3.868
  492   2HB   LEU  68          2HB       LEU  68   2.665   5.563  -5.126
  493    HG   LEU  68           HG       LEU  68   1.867   4.410  -3.429
  494   1HD1  LEU  68          11HD      LEU  68   3.604   2.306  -4.478
  495   2HD1  LEU  68          12HD      LEU  68   2.030   2.862  -5.087
  496   3HD1  LEU  68          13HD      LEU  68   2.152   2.111  -3.505
  497   1HD2  LEU  68          21HD      LEU  68   3.098   3.208  -1.648
  498   2HD2  LEU  68          22HD      LEU  68   3.402   4.945  -1.695
  499   3HD2  LEU  68          23HD      LEU  68   4.599   3.824  -2.342
  500    H    VAL  69           H        VAL  69   6.538   3.546  -6.476
  501    HA   VAL  69           HA       VAL  69   7.885   2.809  -4.084
  502    HB   VAL  69           HB       VAL  69   8.877   2.583  -6.939
  503   1HG1  VAL  69          11HG      VAL  69  10.355   0.839  -6.083
  504   2HG1  VAL  69          12HG      VAL  69   9.745   1.118  -4.452
  505   3HG1  VAL  69          13HG      VAL  69  10.649   2.381  -5.283
  506   1HG2  VAL  69          21HG      VAL  69   6.754   1.406  -6.684
  507   2HG2  VAL  69          22HG      VAL  69   7.384   0.549  -5.278
  508   3HG2  VAL  69          23HG      VAL  69   8.082   0.260  -6.873
  509    H    GLY  70           H        GLY  70   8.543   4.599  -3.089
  510   1HA   GLY  70          1HA       GLY  70  10.667   5.684  -2.633
  511   2HA   GLY  70          2HA       GLY  70  10.796   6.008  -4.365
  512    H    VAL  71           H        VAL  71   7.933   6.316  -2.461
  513    HA   VAL  71           HA       VAL  71   8.072   9.200  -3.033
  514    HB   VAL  71           HB       VAL  71   5.671   9.388  -3.020
  515   1HG1  VAL  71          11HG      VAL  71   5.074   8.051  -4.970
  516   2HG1  VAL  71          12HG      VAL  71   6.558   7.117  -4.765
  517   3HG1  VAL  71          13HG      VAL  71   6.643   8.836  -5.132
  518   1HG2  VAL  71          21HG      VAL  71   5.529   6.421  -2.463
  519   2HG2  VAL  71          22HG      VAL  71   4.167   7.536  -2.710
  520   3HG2  VAL  71          23HG      VAL  71   5.198   7.705  -1.299
  521    H    THR  72           H        THR  72   6.555  10.459  -1.538
  522    HA   THR  72           HA       THR  72   7.570  10.053   1.139
  523    HB   THR  72           HB       THR  72   6.518  12.289   1.459
  524    HG1  THR  72           HG1      THR  72   6.420  12.482  -1.355
  525   1HG2  THR  72          21HG      THR  72   8.534  12.012  -0.768
  526   2HG2  THR  72          22HG      THR  72   8.862  11.995   0.969
  527   3HG2  THR  72          23HG      THR  72   8.240  13.466   0.202
  528    H    GLN  73           H        GLN  73   6.043  10.722   2.848
  529    HA   GLN  73           HA       GLN  73   3.893   8.880   2.793
  530   1HB   GLN  73          1HB       GLN  73   3.499   9.291   5.054
  531   2HB   GLN  73          2HB       GLN  73   5.155   9.831   4.906
  532   1HG   GLN  73          1HG       GLN  73   2.773  11.644   4.794
  533   2HG   GLN  73          2HG       GLN  73   3.668  11.300   6.269
  534   1HE2  GLN  73          21HE      GLN  73   6.238  11.264   5.009
  535   2HE2  GLN  73          22HE      GLN  73   6.609  12.876   4.596
  536    H    ASN  74           H        ASN  74   4.091  12.272   2.091
  537    HA   ASN  74           HA       ASN  74   1.270  12.675   2.209
  538   1HB   ASN  74          1HB       ASN  74   1.662  14.862   1.105
  539   2HB   ASN  74          2HB       ASN  74   2.711  14.629   2.496
  540   1HD2  ASN  74          21HD      ASN  74   4.911  14.593   2.192
  541   2HD2  ASN  74          22HD      ASN  74   5.642  14.876   0.648
  542    H    PHE  75           H        PHE  75   3.484  11.659  -0.280
  543    HA   PHE  75           HA       PHE  75   1.632  11.912  -2.409
  544   1HB   PHE  75          1HB       PHE  75   4.140  11.605  -2.689
  545   2HB   PHE  75          2HB       PHE  75   3.902   9.936  -2.191
  546    HD1  PHE  75           HD1      PHE  75   3.816  12.237  -4.927
  547    HD2  PHE  75           HD2      PHE  75   2.411   8.420  -3.648
  548    HE1  PHE  75           HE1      PHE  75   3.336  11.616  -7.254
  549    HE2  PHE  75           HE2      PHE  75   1.924   7.814  -5.974
  550    HZ   PHE  75           HZ       PHE  75   2.392   9.410  -7.772
  551    H    ALA  76           H        ALA  76   2.715   9.222  -0.391
  552    HA   ALA  76           HA       ALA  76   1.010   7.300  -1.475
  553   1HB   ALA  76          1HB       ALA  76   2.214   7.358   1.275
  554   2HB   ALA  76          2HB       ALA  76   2.997   6.767  -0.196
  555   3HB   ALA  76          3HB       ALA  76   1.559   5.951   0.431
  556    H    ALA  77           H        ALA  77   0.572   9.437   1.356
  557    HA   ALA  77           HA       ALA  77  -1.895   8.344   2.192
  558   1HB   ALA  77          1HB       ALA  77  -2.155  10.374   3.515
  559   2HB   ALA  77          2HB       ALA  77  -0.877  11.152   2.583
  560   3HB   ALA  77          3HB       ALA  77  -0.495   9.782   3.630
  561    H    THR  78           H        THR  78  -1.118  10.169  -0.499
  562    HA   THR  78           HA       THR  78  -3.803  11.152  -0.833
  563    HB   THR  78           HB       THR  78  -1.306  11.350  -2.499
  564    HG1  THR  78           HG1      THR  78  -1.197  12.683  -0.761
  565   1HG2  THR  78          21HG      THR  78  -4.012  12.606  -3.037
  566   2HG2  THR  78          22HG      THR  78  -3.233  11.340  -3.989
  567   3HG2  THR  78          23HG      THR  78  -2.526  12.958  -3.932
  568    H    VAL  79           H        VAL  79  -1.616   8.777  -2.363
  569    HA   VAL  79           HA       VAL  79  -3.444   7.835  -4.286
  570    HB   VAL  79           HB       VAL  79  -1.318   6.132  -2.940
  571   1HG1  VAL  79          11HG      VAL  79  -2.556   5.921  -5.677
  572   2HG1  VAL  79          12HG      VAL  79  -2.892   4.887  -4.301
  573   3HG1  VAL  79          13HG      VAL  79  -1.291   4.879  -5.024
  574   1HG2  VAL  79          21HG      VAL  79   0.167   6.867  -4.774
  575   2HG2  VAL  79          22HG      VAL  79  -0.275   8.167  -3.673
  576   3HG2  VAL  79          23HG      VAL  79  -1.059   8.052  -5.244
  577    H    LEU  80           H        LEU  80  -2.578   6.494  -1.117
  578    HA   LEU  80           HA       LEU  80  -4.549   4.465  -1.118
  579   1HB   LEU  80          1HB       LEU  80  -2.892   5.626   1.113
  580   2HB   LEU  80          2HB       LEU  80  -4.022   4.321   1.369
  581    HG   LEU  80           HG       LEU  80  -1.852   3.367   1.243
  582   1HD1  LEU  80          11HD      LEU  80  -3.183   2.878  -1.392
  583   2HD1  LEU  80          12HD      LEU  80  -3.588   2.112   0.139
  584   3HD1  LEU  80          13HD      LEU  80  -2.005   1.838  -0.591
  585   1HD2  LEU  80          21HD      LEU  80  -0.319   3.641  -0.630
  586   2HD2  LEU  80          22HD      LEU  80  -0.702   5.205   0.095
  587   3HD2  LEU  80          23HD      LEU  80  -1.476   4.722  -1.410
  588    H    ARG  81           H        ARG  81  -5.029   7.641  -0.889
  589    HA   ARG  81           HA       ARG  81  -7.406   7.446   0.830
  590   1HB   ARG  81          1HB       ARG  81  -5.919   9.326   1.224
  591   2HB   ARG  81          2HB       ARG  81  -6.009   9.770  -0.474
  592   1HG   ARG  81          1HG       ARG  81  -8.505  10.012  -0.098
  593   2HG   ARG  81          2HG       ARG  81  -8.116   9.968   1.625
  594   1HD   ARG  81          1HD       ARG  81  -6.552  11.832   1.287
  595   2HD   ARG  81          2HD       ARG  81  -7.007  11.850  -0.414
  596    HE   ARG  81           HE       ARG  81  -9.329  11.999   1.115
  597   1HH1  ARG  81          11HH      ARG  81  -6.528  14.017   0.378
  598   2HH1  ARG  81          12HH      ARG  81  -7.365  15.493   0.536
  599   1HH2  ARG  81          21HH      ARG  81 -10.498  14.012   1.286
  600   2HH2  ARG  81          22HH      ARG  81  -9.681  15.481   1.051
  601    H    ASN  82           H        ASN  82  -6.235   8.347  -2.359
  602    HA   ASN  82           HA       ASN  82  -8.792   9.066  -3.377
  603   1HB   ASN  82          1HB       ASN  82  -6.016   9.189  -4.343
  604   2HB   ASN  82          2HB       ASN  82  -7.287   9.247  -5.549
  605   1HD2  ASN  82          21HD      ASN  82  -5.855  10.785  -2.826
  606   2HD2  ASN  82          22HD      ASN  82  -6.655  12.314  -3.015
  607    H    THR  83           H        THR  83  -7.572   6.251  -2.831
  608    HA   THR  83           HA       THR  83  -7.817   4.594  -5.029
  609    HB   THR  83           HB       THR  83  -8.545   2.991  -3.117
  610    HG1  THR  83           HG1      THR  83  -8.932   5.162  -1.960
  611   1HG2  THR  83          21HG      THR  83  -6.197   2.888  -2.323
  612   2HG2  THR  83          22HG      THR  83  -5.882   4.444  -3.092
  613   3HG2  THR  83          23HG      THR  83  -6.276   3.037  -4.076
  614    H    LYS  84           H        LYS  84  -9.528   3.243  -5.656
  615    HA   LYS  84           HA       LYS  84 -12.204   4.233  -5.028
  616   1HB   LYS  84          1HB       LYS  84 -11.050   3.055  -7.559
  617   2HB   LYS  84          2HB       LYS  84 -12.783   3.206  -7.303
  618   1HG   LYS  84          1HG       LYS  84 -10.844   5.512  -7.230
  619   2HG   LYS  84          2HG       LYS  84 -11.826   5.062  -8.629
  620   1HD   LYS  84          1HD       LYS  84 -13.857   5.406  -7.344
  621   2HD   LYS  84          2HD       LYS  84 -12.915   5.738  -5.909
  622   1HE   LYS  84          1HE       LYS  84 -13.764   7.791  -6.924
  623   2HE   LYS  84          2HE       LYS  84 -12.006   7.747  -6.873
  624   1HZ   LYS  84          1HZ       LYS  84 -13.672   7.163  -9.276
  625   2HZ   LYS  84          2HZ       LYS  84 -11.974   7.198  -9.211
  626   3HZ   LYS  84          3HZ       LYS  84 -12.851   8.599  -8.947
  627    H    GLY  85           H        GLY  85 -13.640   2.147  -6.101
  628   1HA   GLY  85          1HA       GLY  85 -13.784   0.325  -4.026
  629   2HA   GLY  85          2HA       GLY  85 -14.486   0.114  -5.623
  630    H    ASN  86           H        ASN  86 -12.798  -0.528  -7.309
  631    HA   ASN  86           HA       ASN  86 -11.578  -2.883  -6.206
  632   1HB   ASN  86          1HB       ASN  86 -11.490  -1.900  -9.080
  633   2HB   ASN  86          2HB       ASN  86 -10.976  -3.495  -8.501
  634   1HD2  ASN  86          21HD      ASN  86 -12.514  -5.007  -7.976
  635   2HD2  ASN  86          22HD      ASN  86 -14.184  -4.798  -8.322
  636    H    VAL  87           H        VAL  87  -9.515  -2.787  -5.430
  637    HA   VAL  87           HA       VAL  87  -7.669  -0.746  -6.554
  638    HB   VAL  87           HB       VAL  87  -7.378  -1.757  -3.781
  639   1HG1  VAL  87          11HG      VAL  87  -6.535   0.787  -5.108
  640   2HG1  VAL  87          12HG      VAL  87  -5.536  -0.603  -4.675
  641   3HG1  VAL  87          13HG      VAL  87  -6.272   0.385  -3.408
  642   1HG2  VAL  87          21HG      VAL  87  -9.608  -0.995  -3.792
  643   2HG2  VAL  87          22HG      VAL  87  -9.152   0.536  -4.556
  644   3HG2  VAL  87          23HG      VAL  87  -8.626   0.171  -2.898
  645    H    ARG  88           H        ARG  88  -5.918  -1.626  -7.390
  646    HA   ARG  88           HA       ARG  88  -5.081  -4.301  -6.608
  647   1HB   ARG  88          1HB       ARG  88  -4.181  -2.388  -8.713
  648   2HB   ARG  88          2HB       ARG  88  -3.250  -3.814  -8.297
  649   1HG   ARG  88          1HG       ARG  88  -5.000  -5.253  -8.963
  650   2HG   ARG  88          2HG       ARG  88  -6.125  -3.903  -9.147
  651   1HD   ARG  88          1HD       ARG  88  -5.259  -4.635 -11.277
  652   2HD   ARG  88          2HD       ARG  88  -4.780  -2.980 -10.856
  653    HE   ARG  88           HE       ARG  88  -2.964  -5.289 -10.553
  654   1HH1  ARG  88          11HH      ARG  88  -3.556  -2.013 -11.802
  655   2HH1  ARG  88          12HH      ARG  88  -1.943  -1.720 -12.207
  656   1HH2  ARG  88          21HH      ARG  88  -0.708  -4.863 -11.102
  657   2HH2  ARG  88          22HH      ARG  88  -0.271  -3.385 -11.811
  658    H    PHE  89           H        PHE  89  -4.166  -4.283  -4.724
  659    HA   PHE  89           HA       PHE  89  -2.095  -2.333  -4.076
  660   1HB   PHE  89          1HB       PHE  89  -3.208  -4.637  -2.464
  661   2HB   PHE  89          2HB       PHE  89  -2.008  -3.483  -1.919
  662    HD1  PHE  89           HD1      PHE  89  -5.516  -4.093  -2.566
  663    HD2  PHE  89           HD2      PHE  89  -2.610  -1.239  -1.407
  664    HE1  PHE  89           HE1      PHE  89  -7.290  -2.627  -1.688
  665    HE2  PHE  89           HE2      PHE  89  -4.364   0.211  -0.547
  666    HZ   PHE  89           HZ       PHE  89  -6.722  -0.506  -0.686
  667    H    VAL  90           H        VAL  90  -0.283  -2.912  -5.191
  668    HA   VAL  90           HA       VAL  90   0.398  -5.719  -5.139
  669    HB   VAL  90           HB       VAL  90   1.907  -3.401  -6.383
  670   1HG1  VAL  90          11HG      VAL  90   3.123  -5.163  -7.632
  671   2HG1  VAL  90          12HG      VAL  90   2.235  -6.387  -6.722
  672   3HG1  VAL  90          13HG      VAL  90   3.345  -5.303  -5.887
  673   1HG2  VAL  90          21HG      VAL  90   1.047  -4.172  -8.543
  674   2HG2  VAL  90          22HG      VAL  90  -0.270  -3.700  -7.465
  675   3HG2  VAL  90          23HG      VAL  90   0.096  -5.407  -7.721
  676    H    ILE  91           H        ILE  91   0.730  -5.894  -3.026
  677    HA   ILE  91           HA       ILE  91   2.826  -4.309  -1.771
  678    HB   ILE  91           HB       ILE  91   0.532  -5.989  -0.809
  679   1HG1  ILE  91          11HG      ILE  91   1.235  -3.124  -0.349
  680   2HG1  ILE  91          12HG      ILE  91   0.054  -3.688  -1.529
  681   1HG2  ILE  91          21HG      ILE  91   1.141  -5.514   1.507
  682   2HG2  ILE  91          22HG      ILE  91   2.662  -4.813   0.959
  683   3HG2  ILE  91          23HG      ILE  91   2.341  -6.530   0.703
  684   1HD1  ILE  91          11HD      ILE  91  -0.987  -2.869   0.391
  685   2HD1  ILE  91          12HD      ILE  91  -0.038  -3.995   1.404
  686   3HD1  ILE  91          13HD      ILE  91  -1.213  -4.625   0.196
  687    H    GLY  92           H        GLY  92   4.379  -5.521  -0.515
  688   1HA   GLY  92          1HA       GLY  92   4.495  -8.287  -1.327
  689   2HA   GLY  92          2HA       GLY  92   5.951  -7.318  -1.481
  690    H    ARG  93           H        ARG  93   5.382  -9.629   0.113
  691    HA   ARG  93           HA       ARG  93   5.744  -8.611   2.862
  692   1HB   ARG  93          1HB       ARG  93   3.759 -10.012   2.597
  693   2HB   ARG  93          2HB       ARG  93   4.703 -11.256   1.797
  694   1HG   ARG  93          1HG       ARG  93   5.279 -10.435   4.624
  695   2HG   ARG  93          2HG       ARG  93   3.986 -11.574   4.252
  696   1HD   ARG  93          1HD       ARG  93   6.854 -11.897   3.405
  697   2HD   ARG  93          2HD       ARG  93   6.153 -12.623   4.846
  698    HE   ARG  93           HE       ARG  93   4.519 -13.610   3.106
  699   1HH1  ARG  93          11HH      ARG  93   8.058 -13.209   2.561
  700   2HH1  ARG  93          12HH      ARG  93   8.162 -14.510   1.503
  701   1HH2  ARG  93          21HH      ARG  93   4.735 -15.434   1.625
  702   2HH2  ARG  93          22HH      ARG  93   6.245 -15.799   0.948
  703    H    GLU  94           H        GLU  94   7.665  -8.836   3.727
  704    HA   GLU  94           HA       GLU  94   9.676 -10.132   2.173
  705   1HB   GLU  94          1HB       GLU  94  11.248  -9.321   3.971
  706   2HB   GLU  94          2HB       GLU  94  10.339  -8.058   3.171
  707   1HG   GLU  94          1HG       GLU  94   8.917  -7.791   5.080
  708   2HG   GLU  94          2HG       GLU  94   9.609  -9.220   5.846
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1  17.586 -12.790  -1.677
    2   2H    GLY   1          2H        GLY   1  17.668 -13.365  -0.087
    3   3H    GLY   1          3H        GLY   1  16.678 -12.054  -0.466
    4   1HA   GLY   1          1HA       GLY   1  16.339 -14.830  -1.429
    5   2HA   GLY   1          2HA       GLY   1  15.342 -14.022  -0.222
    6    H    HIS   2           H        HIS   2  13.447 -14.269  -1.505
    7    HA   HIS   2           HA       HIS   2  13.354 -12.415  -3.776
    8   1HB   HIS   2          1HB       HIS   2  13.341 -14.694  -4.687
    9   2HB   HIS   2          2HB       HIS   2  12.016 -15.135  -3.618
   10    HD1  HIS   2           HD1      HIS   2   9.627 -14.521  -4.397
   11    HD2  HIS   2           HD2      HIS   2  12.628 -13.007  -6.846
   12    HE1  HIS   2           HE1      HIS   2   8.466 -13.575  -6.416
   13    H    MET   3           H        MET   3  11.839 -10.925  -3.588
   14    HA   MET   3           HA       MET   3   9.930 -11.111  -1.414
   15   1HB   MET   3          1HB       MET   3  11.274  -9.079  -1.619
   16   2HB   MET   3          2HB       MET   3  10.726  -8.874  -3.272
   17   1HG   MET   3          1HG       MET   3   8.488  -8.409  -2.521
   18   2HG   MET   3          2HG       MET   3   8.950  -8.741  -0.852
   19   1HE   MET   3          1HE       MET   3   9.682  -6.427  -3.978
   20   2HE   MET   3          2HE       MET   3  11.302  -6.838  -3.418
   21   3HE   MET   3          3HE       MET   3  10.707  -5.191  -3.256
   22    H    GLU   4           H        GLU   4   7.832 -11.495  -1.714
   23    HA   GLU   4           HA       GLU   4   6.830 -12.088  -4.399
   24   1HB   GLU   4          1HB       GLU   4   6.360 -13.676  -2.552
   25   2HB   GLU   4          2HB       GLU   4   5.557 -12.381  -1.670
   26   1HG   GLU   4          1HG       GLU   4   3.901 -12.250  -3.562
   27   2HG   GLU   4          2HG       GLU   4   4.646 -13.693  -4.226
   28    H    LEU   5           H        LEU   5   6.184 -10.258  -5.472
   29    HA   LEU   5           HA       LEU   5   4.634  -8.331  -3.984
   30   1HB   LEU   5          1HB       LEU   5   5.357  -8.348  -6.932
   31   2HB   LEU   5          2HB       LEU   5   4.594  -7.039  -6.058
   32    HG   LEU   5           HG       LEU   5   6.742  -6.334  -6.299
   33   1HD1  LEU   5          11HD      LEU   5   7.711  -6.237  -4.100
   34   2HD1  LEU   5          12HD      LEU   5   6.770  -7.658  -3.651
   35   3HD1  LEU   5          13HD      LEU   5   5.939  -6.134  -4.008
   36   1HD2  LEU   5          21HD      LEU   5   8.774  -7.644  -5.873
   37   2HD2  LEU   5          22HD      LEU   5   7.769  -8.395  -7.115
   38   3HD2  LEU   5          23HD      LEU   5   7.780  -9.045  -5.479
   39    H    PHE   6           H        PHE   6   2.488  -8.296  -4.004
   40    HA   PHE   6           HA       PHE   6   1.167 -10.041  -5.882
   41   1HB   PHE   6          1HB       PHE   6  -0.347 -10.637  -3.942
   42   2HB   PHE   6          2HB       PHE   6   1.190 -11.477  -4.060
   43    HD1  PHE   6           HD1      PHE   6   2.832 -11.074  -2.277
   44    HD2  PHE   6           HD2      PHE   6  -0.842  -9.015  -2.381
   45    HE1  PHE   6           HE1      PHE   6   3.229 -10.343   0.024
   46    HE2  PHE   6           HE2      PHE   6  -0.489  -8.234  -0.036
   47    HZ   PHE   6           HZ       PHE   6   1.561  -8.906   1.164
   48    HA   PRO   7           HA       PRO   7  -1.687  -6.633  -6.087
   49   1HB   PRO   7          1HB       PRO   7  -3.360  -7.702  -7.744
   50   2HB   PRO   7          2HB       PRO   7  -1.746  -7.227  -8.281
   51   1HG   PRO   7          1HG       PRO   7  -2.752  -9.995  -7.587
   52   2HG   PRO   7          2HG       PRO   7  -1.676  -9.523  -8.937
   53   1HD   PRO   7          1HD       PRO   7  -0.929 -10.577  -6.465
   54   2HD   PRO   7          2HD       PRO   7   0.130  -9.631  -7.555
   55    H    VAL   8           H        VAL   8  -3.004  -6.282  -4.511
   56    HA   VAL   8           HA       VAL   8  -4.991  -8.321  -3.904
   57    HB   VAL   8           HB       VAL   8  -4.260  -5.965  -2.160
   58   1HG1  VAL   8          11HG      VAL   8  -5.928  -8.403  -1.614
   59   2HG1  VAL   8          12HG      VAL   8  -6.485  -6.733  -1.734
   60   3HG1  VAL   8          13HG      VAL   8  -5.447  -7.224  -0.395
   61   1HG2  VAL   8          21HG      VAL   8  -3.077  -7.576  -0.722
   62   2HG2  VAL   8          22HG      VAL   8  -2.361  -7.409  -2.332
   63   3HG2  VAL   8          23HG      VAL   8  -3.349  -8.821  -1.953
   64    H    GLU   9           H        GLU   9  -6.564  -7.828  -5.309
   65    HA   GLU   9           HA       GLU   9  -7.373  -5.082  -5.628
   66   1HB   GLU   9          1HB       GLU   9  -7.381  -6.756  -7.520
   67   2HB   GLU   9          2HB       GLU   9  -8.704  -7.579  -6.712
   68   1HG   GLU   9          1HG       GLU   9 -10.117  -5.628  -6.968
   69   2HG   GLU   9          2HG       GLU   9  -8.772  -4.721  -7.665
   70    H    LEU  10           H        LEU  10  -8.303  -4.291  -3.928
   71    HA   LEU  10           HA       LEU  10  -9.922  -5.994  -2.200
   72   1HB   LEU  10          1HB       LEU  10  -8.069  -4.070  -1.661
   73   2HB   LEU  10          2HB       LEU  10  -9.532  -3.114  -1.654
   74    HG   LEU  10           HG       LEU  10  -9.072  -3.672   0.591
   75   1HD1  LEU  10          11HD      LEU  10 -11.423  -3.843   0.127
   76   2HD1  LEU  10          12HD      LEU  10 -10.980  -5.100   1.289
   77   3HD1  LEU  10          13HD      LEU  10 -11.223  -5.504  -0.398
   78   1HD2  LEU  10          21HD      LEU  10  -8.697  -5.936   1.379
   79   2HD2  LEU  10          22HD      LEU  10  -7.487  -5.458   0.190
   80   3HD2  LEU  10          23HD      LEU  10  -8.805  -6.540  -0.271
   81    H    GLU  11           H        GLU  11 -12.107  -5.761  -2.274
   82    HA   GLU  11           HA       GLU  11 -13.127  -3.594  -3.903
   83   1HB   GLU  11          1HB       GLU  11 -13.820  -5.841  -4.578
   84   2HB   GLU  11          2HB       GLU  11 -14.503  -6.116  -2.979
   85   1HG   GLU  11          1HG       GLU  11 -16.249  -4.605  -3.347
   86   2HG   GLU  11          2HG       GLU  11 -15.436  -3.877  -4.733
   87    H    LYS  12           H        LYS  12 -13.049  -1.964  -2.602
   88    HA   LYS  12           HA       LYS  12 -14.231  -2.108   0.007
   89   1HB   LYS  12          1HB       LYS  12 -12.445  -0.231  -1.399
   90   2HB   LYS  12          2HB       LYS  12 -13.404   0.438  -0.103
   91   1HG   LYS  12          1HG       LYS  12 -11.435  -1.852   0.036
   92   2HG   LYS  12          2HG       LYS  12 -11.189  -0.228   0.701
   93   1HD   LYS  12          1HD       LYS  12 -13.614  -1.336   1.696
   94   2HD   LYS  12          2HD       LYS  12 -12.307  -2.530   1.912
   95   1HE   LYS  12          1HE       LYS  12 -12.458  -1.294   3.888
   96   2HE   LYS  12          2HE       LYS  12 -11.054  -0.735   3.110
   97   1HZ   LYS  12          1HZ       LYS  12 -12.333   1.214   2.150
   98   2HZ   LYS  12          2HZ       LYS  12 -12.353   1.261   3.819
   99   3HZ   LYS  12          3HZ       LYS  12 -13.691   0.737   2.973
  100    H    ASP  13           H        ASP  13 -15.119   0.188   0.530
  101    HA   ASP  13           HA       ASP  13 -17.679   0.411  -0.660
  102   1HB   ASP  13          1HB       ASP  13 -17.818   2.279   1.060
  103   2HB   ASP  13          2HB       ASP  13 -17.557   0.655   1.685
  104    H    GLU  14           H        GLU  14 -18.400   2.790  -0.893
  105    HA   GLU  14           HA       GLU  14 -16.887   3.838  -3.127
  106   1HB   GLU  14          1HB       GLU  14 -18.820   5.295  -3.488
  107   2HB   GLU  14          2HB       GLU  14 -19.293   3.611  -3.312
  108   1HG   GLU  14          1HG       GLU  14 -19.671   4.301  -0.807
  109   2HG   GLU  14          2HG       GLU  14 -19.752   5.917  -1.490
  110    H    ASP  15           H        ASP  15 -16.824   4.354   0.107
  111    HA   ASP  15           HA       ASP  15 -16.169   7.164  -0.000
  112   1HB   ASP  15          1HB       ASP  15 -17.203   6.275   2.037
  113   2HB   ASP  15          2HB       ASP  15 -15.881   5.139   2.233
  114    H    GLY  16           H        GLY  16 -14.548   4.050   0.393
  115   1HA   GLY  16          1HA       GLY  16 -12.560   4.148  -1.225
  116   2HA   GLY  16          2HA       GLY  16 -12.018   5.412  -0.134
  117    H    LEU  17           H        LEU  17 -10.623   4.758   1.279
  118    HA   LEU  17           HA       LEU  17 -10.513   1.861   1.810
  119   1HB   LEU  17          1HB       LEU  17  -8.262   3.749   2.294
  120   2HB   LEU  17          2HB       LEU  17  -8.226   2.013   2.084
  121    HG   LEU  17           HG       LEU  17  -8.692   4.078   0.012
  122   1HD1  LEU  17          11HD      LEU  17  -6.411   3.910   0.663
  123   2HD1  LEU  17          12HD      LEU  17  -6.597   3.188  -0.934
  124   3HD1  LEU  17          13HD      LEU  17  -6.438   2.158   0.490
  125   1HD2  LEU  17          21HD      LEU  17  -8.668   2.218  -1.605
  126   2HD2  LEU  17          22HD      LEU  17 -10.071   2.215  -0.540
  127   3HD2  LEU  17          23HD      LEU  17  -8.766   1.070  -0.257
  128    H    GLY  18           H        GLY  18 -10.143   5.055   3.221
  129   1HA   GLY  18          1HA       GLY  18 -10.294   5.785   5.352
  130   2HA   GLY  18          2HA       GLY  18 -11.044   4.243   5.767
  131    H    ILE  19           H        ILE  19  -7.901   4.444   4.243
  132    HA   ILE  19           HA       ILE  19  -6.810   3.329   6.743
  133    HB   ILE  19           HB       ILE  19  -5.127   2.135   5.514
  134   1HG1  ILE  19          11HG      ILE  19  -6.149   3.473   2.999
  135   2HG1  ILE  19          12HG      ILE  19  -4.665   3.902   3.848
  136   1HG2  ILE  19          21HG      ILE  19  -7.333   1.091   5.568
  137   2HG2  ILE  19          22HG      ILE  19  -6.484   0.678   4.077
  138   3HG2  ILE  19          23HG      ILE  19  -7.757   1.901   4.067
  139   1HD1  ILE  19          11HD      ILE  19  -5.236   1.241   2.553
  140   2HD1  ILE  19          12HD      ILE  19  -3.759   1.678   3.412
  141   3HD1  ILE  19          13HD      ILE  19  -4.181   2.505   1.915
  142    H    SER  20           H        SER  20  -4.187   3.620   6.561
  143    HA   SER  20           HA       SER  20  -3.561   6.418   6.007
  144   1HB   SER  20          1HB       SER  20  -3.290   5.050   8.696
  145   2HB   SER  20          2HB       SER  20  -2.702   6.664   8.351
  146    HG   SER  20           HG       SER  20  -5.233   6.529   7.617
  147    H    ILE  21           H        ILE  21  -1.284   6.761   5.883
  148    HA   ILE  21           HA       ILE  21   0.353   4.311   5.658
  149    HB   ILE  21           HB       ILE  21   1.517   5.326   3.757
  150   1HG1  ILE  21          11HG      ILE  21  -0.087   7.266   2.648
  151   2HG1  ILE  21          12HG      ILE  21  -0.284   7.591   4.341
  152   1HG2  ILE  21          21HG      ILE  21  -1.448   5.050   3.308
  153   2HG2  ILE  21          22HG      ILE  21  -0.253   3.754   3.281
  154   3HG2  ILE  21          23HG      ILE  21  -0.218   5.012   2.044
  155   1HD1  ILE  21          11HD      ILE  21   2.399   7.518   2.943
  156   2HD1  ILE  21          12HD      ILE  21   2.122   7.883   4.632
  157   3HD1  ILE  21          13HD      ILE  21   1.517   8.963   3.394
  158    H    ILE  22           H        ILE  22   2.673   4.764   5.865
  159    HA   ILE  22           HA       ILE  22   3.180   7.280   7.147
  160    HB   ILE  22           HB       ILE  22   2.881   5.747   8.952
  161   1HG1  ILE  22          11HG      ILE  22   5.829   6.328   8.581
  162   2HG1  ILE  22          12HG      ILE  22   4.631   7.421   9.261
  163   1HG2  ILE  22          21HG      ILE  22   5.005   4.024   7.719
  164   2HG2  ILE  22          22HG      ILE  22   3.279   3.654   7.827
  165   3HG2  ILE  22          23HG      ILE  22   4.257   3.750   9.297
  166   1HD1  ILE  22          11HD      ILE  22   5.499   4.799  10.455
  167   2HD1  ILE  22          12HD      ILE  22   4.325   5.914  11.158
  168   3HD1  ILE  22          13HD      ILE  22   6.015   6.398  10.982
  169    H    GLY  23           H        GLY  23   5.029   8.240   6.475
  170   1HA   GLY  23          1HA       GLY  23   6.526   6.717   4.520
  171   2HA   GLY  23          2HA       GLY  23   6.486   8.483   4.612
  172    H    MET  24           H        MET  24   8.095   5.693   5.330
  173    HA   MET  24           HA       MET  24  10.134   7.181   6.706
  174   1HB   MET  24          1HB       MET  24  10.357   5.443   8.527
  175   2HB   MET  24          2HB       MET  24   8.984   6.533   8.660
  176   1HG   MET  24          1HG       MET  24   7.508   4.836   7.869
  177   2HG   MET  24          2HG       MET  24   8.826   3.716   7.583
  178   1HE   MET  24          1HE       MET  24  10.685   4.241  10.191
  179   2HE   MET  24          2HE       MET  24  10.320   2.646   9.538
  180   3HE   MET  24          3HE       MET  24  10.073   2.975  11.251
  181    H    GLY  25           H        GLY  25  11.552   6.946   5.211
  182   1HA   GLY  25          1HA       GLY  25  12.044   4.792   3.538
  183   2HA   GLY  25          2HA       GLY  25  13.244   5.990   3.993
  184    H    VAL  26           H        VAL  26  12.362   2.805   4.145
  185    HA   VAL  26           HA       VAL  26  13.507   2.179   6.651
  186    HB   VAL  26           HB       VAL  26  11.630   0.873   5.906
  187   1HG1  VAL  26          11HG      VAL  26  11.755  -0.769   4.095
  188   2HG1  VAL  26          12HG      VAL  26  13.348  -0.149   3.663
  189   3HG1  VAL  26          13HG      VAL  26  11.930   0.889   3.519
  190   1HG2  VAL  26          21HG      VAL  26  12.470  -1.412   6.315
  191   2HG2  VAL  26          22HG      VAL  26  13.126  -0.226   7.440
  192   3HG2  VAL  26          23HG      VAL  26  14.118  -0.819   6.106
  193    H    GLY  27           H        GLY  27  15.527   2.912   6.637
  194   1HA   GLY  27          1HA       GLY  27  17.725   2.357   6.922
  195   2HA   GLY  27          2HA       GLY  27  17.399   0.846   6.113
  196    H    ALA  28           H        ALA  28  17.059   1.081   3.716
  197    HA   ALA  28           HA       ALA  28  18.148   1.234   1.723
  198   1HB   ALA  28          1HB       ALA  28  18.883   4.022   2.686
  199   2HB   ALA  28          2HB       ALA  28  17.421   3.599   1.795
  200   3HB   ALA  28          3HB       ALA  28  19.000   3.454   1.015
  201    H    ASP  29           H        ASP  29  19.314   0.255   4.068
  202    HA   ASP  29           HA       ASP  29  22.173   0.883   3.887
  203   1HB   ASP  29          1HB       ASP  29  21.129   1.153   6.068
  204   2HB   ASP  29          2HB       ASP  29  20.572  -0.512   6.014
  205    H    ALA  30           H        ALA  30  19.898  -1.817   3.996
  206    HA   ALA  30           HA       ALA  30  21.764  -3.892   3.885
  207   1HB   ALA  30          1HB       ALA  30  19.424  -4.198   4.541
  208   2HB   ALA  30          2HB       ALA  30  19.894  -5.320   3.260
  209   3HB   ALA  30          3HB       ALA  30  18.925  -3.898   2.878
  210    H    GLY  31           H        GLY  31  20.468  -1.895   1.369
  211   1HA   GLY  31          1HA       GLY  31  21.904  -1.737  -0.645
  212   2HA   GLY  31          2HA       GLY  31  21.987  -3.497  -0.585
  213    H    LEU  32           H        LEU  32  19.101  -3.480   0.223
  214    HA   LEU  32           HA       LEU  32  18.054  -3.877  -2.361
  215   1HB   LEU  32          1HB       LEU  32  16.680  -3.732   0.339
  216   2HB   LEU  32          2HB       LEU  32  15.839  -4.114  -1.145
  217    HG   LEU  32           HG       LEU  32  17.294  -6.147  -1.379
  218   1HD1  LEU  32          11HD      LEU  32  19.191  -5.469  -0.022
  219   2HD1  LEU  32          12HD      LEU  32  18.509  -7.001   0.540
  220   3HD1  LEU  32          13HD      LEU  32  18.180  -5.512   1.422
  221   1HD2  LEU  32          21HD      LEU  32  15.623  -5.943   1.114
  222   2HD2  LEU  32          22HD      LEU  32  16.154  -7.448   0.366
  223   3HD2  LEU  32          23HD      LEU  32  15.066  -6.371  -0.501
  224    H    GLU  33           H        GLU  33  17.506  -1.426   0.115
  225    HA   GLU  33           HA       GLU  33  16.844   0.718   0.083
  226   1HB   GLU  33          1HB       GLU  33  17.992   0.707  -2.702
  227   2HB   GLU  33          2HB       GLU  33  17.637   2.134  -1.746
  228   1HG   GLU  33          1HG       GLU  33  19.344   1.487  -0.135
  229   2HG   GLU  33          2HG       GLU  33  19.672   0.025  -1.067
  230    H    LYS  34           H        LYS  34  14.680  -0.151   0.111
  231    HA   LYS  34           HA       LYS  34  13.249   0.560  -2.352
  232   1HB   LYS  34          1HB       LYS  34  11.547  -0.984  -1.812
  233   2HB   LYS  34          2HB       LYS  34  13.014  -1.815  -1.324
  234   1HG   LYS  34          1HG       LYS  34  12.491  -0.960   1.080
  235   2HG   LYS  34          2HG       LYS  34  11.006  -0.428   0.398
  236   1HD   LYS  34          1HD       LYS  34  10.716  -2.574   1.500
  237   2HD   LYS  34          2HD       LYS  34  10.323  -2.632  -0.214
  238   1HE   LYS  34          1HE       LYS  34  12.400  -3.688  -0.704
  239   2HE   LYS  34          2HE       LYS  34  12.941  -3.535   0.973
  240   1HZ   LYS  34          1HZ       LYS  34  10.600  -5.146   0.056
  241   2HZ   LYS  34          2HZ       LYS  34  11.146  -4.996   1.638
  242   3HZ   LYS  34          3HZ       LYS  34  12.109  -5.766   0.496
  243    H    LEU  35           H        LEU  35  10.973   1.373  -1.732
  244    HA   LEU  35           HA       LEU  35  10.912   3.756  -0.391
  245   1HB   LEU  35          1HB       LEU  35   8.555   3.588  -0.435
  246   2HB   LEU  35          2HB       LEU  35   9.193   2.844  -1.892
  247    HG   LEU  35           HG       LEU  35   8.547   1.103   0.455
  248   1HD1  LEU  35          11HD      LEU  35   6.584   2.088  -1.572
  249   2HD1  LEU  35          12HD      LEU  35   6.634   2.468   0.169
  250   3HD1  LEU  35          13HD      LEU  35   6.349   0.810  -0.365
  251   1HD2  LEU  35          21HD      LEU  35   8.392   0.702  -2.514
  252   2HD2  LEU  35          22HD      LEU  35   8.040  -0.521  -1.290
  253   3HD2  LEU  35          23HD      LEU  35   9.681   0.101  -1.464
  254    H    GLY  36           H        GLY  36   9.544   4.229   1.534
  255   1HA   GLY  36          1HA       GLY  36   9.603   2.123   3.553
  256   2HA   GLY  36          2HA       GLY  36  10.142   3.761   3.923
  257    H    ILE  37           H        ILE  37   7.463   3.032   1.799
  258    HA   ILE  37           HA       ILE  37   5.798   4.504   3.657
  259    HB   ILE  37           HB       ILE  37   4.964   3.451   0.940
  260   1HG1  ILE  37          11HG      ILE  37   6.882   5.090   0.961
  261   2HG1  ILE  37          12HG      ILE  37   5.481   5.635   0.006
  262   1HG2  ILE  37          21HG      ILE  37   3.135   5.117   1.196
  263   2HG2  ILE  37          22HG      ILE  37   3.741   5.487   2.819
  264   3HG2  ILE  37          23HG      ILE  37   3.113   3.891   2.469
  265   1HD1  ILE  37          11HD      ILE  37   4.913   6.990   2.081
  266   2HD1  ILE  37          12HD      ILE  37   6.357   7.457   1.193
  267   3HD1  ILE  37          13HD      ILE  37   6.513   6.512   2.678
  268    H    PHE  38           H        PHE  38   5.234   3.318   5.194
  269    HA   PHE  38           HA       PHE  38   4.346   0.573   4.712
  270   1HB   PHE  38          1HB       PHE  38   5.019   2.028   7.256
  271   2HB   PHE  38          2HB       PHE  38   4.446   0.364   7.192
  272    HD1  PHE  38           HD1      PHE  38   7.292   2.547   6.907
  273    HD2  PHE  38           HD2      PHE  38   5.845  -1.358   6.060
  274    HE1  PHE  38           HE1      PHE  38   9.599   1.766   6.633
  275    HE2  PHE  38           HE2      PHE  38   8.138  -2.159   5.775
  276    HZ   PHE  38           HZ       PHE  38  10.034  -0.603   6.063
  277    H    VAL  39           H        VAL  39   2.427  -0.124   5.848
  278    HA   VAL  39           HA       VAL  39   0.394   1.856   5.567
  279    HB   VAL  39           HB       VAL  39   0.174  -0.986   6.613
  280   1HG1  VAL  39          11HG      VAL  39  -1.893   0.912   5.515
  281   2HG1  VAL  39          12HG      VAL  39  -1.715   0.430   7.204
  282   3HG1  VAL  39          13HG      VAL  39  -2.186  -0.760   5.989
  283   1HG2  VAL  39          21HG      VAL  39  -0.557  -1.589   4.340
  284   2HG2  VAL  39          22HG      VAL  39   1.097  -0.969   4.347
  285   3HG2  VAL  39          23HG      VAL  39  -0.220   0.059   3.808
  286    H    LYS  40           H        LYS  40  -0.246   3.088   7.116
  287    HA   LYS  40           HA       LYS  40   1.018   2.976   9.712
  288   1HB   LYS  40          1HB       LYS  40   0.800   5.103   8.599
  289   2HB   LYS  40          2HB       LYS  40  -0.919   4.870   8.402
  290   1HG   LYS  40          1HG       LYS  40  -0.562   6.477  10.099
  291   2HG   LYS  40          2HG       LYS  40  -1.161   5.007  10.859
  292   1HD   LYS  40          1HD       LYS  40   1.103   4.444  11.554
  293   2HD   LYS  40          2HD       LYS  40   1.714   5.906  10.761
  294   1HE   LYS  40          1HE       LYS  40   0.219   7.245  12.147
  295   2HE   LYS  40          2HE       LYS  40  -0.281   5.762  12.978
  296   1HZ   LYS  40          1HZ       LYS  40   1.992   5.487  13.764
  297   2HZ   LYS  40          2HZ       LYS  40   1.391   6.985  14.221
  298   3HZ   LYS  40          3HZ       LYS  40   2.477   6.890  12.943
  299    H    THR  41           H        THR  41  -2.262   2.887   8.376
  300    HA   THR  41           HA       THR  41  -3.144   1.276  10.585
  301    HB   THR  41           HB       THR  41  -4.790   3.597   9.886
  302    HG1  THR  41           HG1      THR  41  -2.573   3.571  11.735
  303   1HG2  THR  41          21HG      THR  41  -4.364   2.086  12.457
  304   2HG2  THR  41          22HG      THR  41  -5.742   1.957  11.348
  305   3HG2  THR  41          23HG      THR  41  -5.473   3.446  12.266
  306    H    VAL  42           H        VAL  42  -5.361   0.500   9.970
  307    HA   VAL  42           HA       VAL  42  -6.194   1.077   7.255
  308    HB   VAL  42           HB       VAL  42  -6.111  -1.736   8.461
  309   1HG1  VAL  42          11HG      VAL  42  -6.854  -2.504   6.277
  310   2HG1  VAL  42          12HG      VAL  42  -6.840  -0.839   5.704
  311   3HG1  VAL  42          13HG      VAL  42  -7.988  -1.320   6.954
  312   1HG2  VAL  42          21HG      VAL  42  -4.475  -2.312   6.751
  313   2HG2  VAL  42          22HG      VAL  42  -3.866  -1.036   7.812
  314   3HG2  VAL  42          23HG      VAL  42  -4.458  -0.639   6.200
  315    H    THR  43           H        THR  43  -8.505   1.055   7.163
  316    HA   THR  43           HA       THR  43  -9.945   1.482   9.454
  317    HB   THR  43           HB       THR  43 -10.810   1.981   7.137
  318    HG1  THR  43           HG1      THR  43 -12.732   1.908   7.975
  319   1HG2  THR  43          21HG      THR  43 -10.082  -0.069   6.061
  320   2HG2  THR  43          22HG      THR  43 -11.852   0.098   5.878
  321   3HG2  THR  43          23HG      THR  43 -11.156  -0.950   7.141
  322    H    GLU  44           H        GLU  44 -10.914   0.184  10.832
  323    HA   GLU  44           HA       GLU  44  -9.764  -2.262  11.530
  324   1HB   GLU  44          1HB       GLU  44 -10.781  -0.741  13.141
  325   2HB   GLU  44          2HB       GLU  44 -12.370  -1.064  12.482
  326   1HG   GLU  44          1HG       GLU  44 -12.056  -2.237  14.562
  327   2HG   GLU  44          2HG       GLU  44 -12.205  -3.380  13.229
  328    H    GLY  45           H        GLY  45 -13.088  -1.732  10.502
  329   1HA   GLY  45          1HA       GLY  45 -12.934  -4.244   9.062
  330   2HA   GLY  45          2HA       GLY  45 -14.196  -4.108  10.299
  331    H    GLY  46           H        GLY  46 -13.004  -1.653   8.122
  332   1HA   GLY  46          1HA       GLY  46 -15.564  -0.937   7.144
  333   2HA   GLY  46          2HA       GLY  46 -14.043  -0.548   6.341
  334    H    ALA  47           H        ALA  47 -13.030  -2.905   5.813
  335    HA   ALA  47           HA       ALA  47 -14.384  -5.023   4.810
  336   1HB   ALA  47          1HB       ALA  47 -14.653  -4.697   2.397
  337   2HB   ALA  47          2HB       ALA  47 -14.054  -3.054   2.522
  338   3HB   ALA  47          3HB       ALA  47 -15.603  -3.481   3.252
  339    H    ALA  48           H        ALA  48 -11.714  -2.831   4.564
  340    HA   ALA  48           HA       ALA  48 -10.047  -4.323   2.811
  341   1HB   ALA  48          1HB       ALA  48  -9.566  -1.985   3.281
  342   2HB   ALA  48          2HB       ALA  48  -8.189  -2.986   3.741
  343   3HB   ALA  48          3HB       ALA  48  -9.279  -2.368   4.977
  344    H    GLN  49           H        GLN  49  -9.988  -4.057   6.319
  345    HA   GLN  49           HA       GLN  49  -8.223  -6.288   6.532
  346   1HB   GLN  49          1HB       GLN  49  -9.773  -4.706   8.482
  347   2HB   GLN  49          2HB       GLN  49  -8.768  -6.075   9.019
  348   1HG   GLN  49          1HG       GLN  49  -6.873  -4.836   7.816
  349   2HG   GLN  49          2HG       GLN  49  -7.999  -3.476   7.747
  350   1HE2  GLN  49          21HE      GLN  49  -8.571  -2.463   9.635
  351   2HE2  GLN  49          22HE      GLN  49  -7.703  -2.620  11.103
  352    H    ARG  50           H        ARG  50 -11.471  -6.106   5.936
  353    HA   ARG  50           HA       ARG  50 -11.961  -8.594   7.286
  354   1HB   ARG  50          1HB       ARG  50 -13.867  -6.895   5.692
  355   2HB   ARG  50          2HB       ARG  50 -14.306  -8.413   6.473
  356   1HG   ARG  50          1HG       ARG  50 -13.176  -6.029   7.834
  357   2HG   ARG  50          2HG       ARG  50 -14.909  -6.443   7.847
  358   1HD   ARG  50          1HD       ARG  50 -14.312  -8.535   9.048
  359   2HD   ARG  50          2HD       ARG  50 -12.610  -8.074   8.999
  360    HE   ARG  50           HE       ARG  50 -14.574  -6.363  10.294
  361   1HH1  ARG  50          11HH      ARG  50 -11.655  -8.459  10.599
  362   2HH1  ARG  50          12HH      ARG  50 -11.269  -7.887  12.145
  363   1HH2  ARG  50          21HH      ARG  50 -13.953  -5.606  12.440
  364   2HH2  ARG  50          22HH      ARG  50 -12.580  -6.253  13.205
  365    H    ASP  51           H        ASP  51 -11.255  -7.342   4.142
  366    HA   ASP  51           HA       ASP  51 -11.746  -9.642   2.612
  367   1HB   ASP  51          1HB       ASP  51 -10.990  -7.578   1.545
  368   2HB   ASP  51          2HB       ASP  51  -9.439  -7.658   2.375
  369    H    GLY  52           H        GLY  52  -8.783  -8.654   4.242
  370   1HA   GLY  52          1HA       GLY  52  -7.712 -10.117   5.792
  371   2HA   GLY  52          2HA       GLY  52  -8.310 -11.480   4.865
  372    H    ARG  53           H        ARG  53  -7.374 -10.082   2.277
  373    HA   ARG  53           HA       ARG  53  -4.824 -11.395   2.309
  374   1HB   ARG  53          1HB       ARG  53  -6.604 -10.787   0.338
  375   2HB   ARG  53          2HB       ARG  53  -5.431  -9.511   0.108
  376   1HG   ARG  53          1HG       ARG  53  -4.892 -12.486  -0.030
  377   2HG   ARG  53          2HG       ARG  53  -4.975 -11.371  -1.385
  378   1HD   ARG  53          1HD       ARG  53  -2.995 -10.183  -0.417
  379   2HD   ARG  53          2HD       ARG  53  -2.908 -11.439   0.809
  380    HE   ARG  53           HE       ARG  53  -2.885 -12.331  -1.945
  381   1HH1  ARG  53          11HH      ARG  53  -0.956 -11.631   0.950
  382   2HH1  ARG  53          12HH      ARG  53   0.432 -12.423   0.363
  383   1HH2  ARG  53          21HH      ARG  53  -0.933 -13.386  -2.743
  384   2HH2  ARG  53          22HH      ARG  53   0.486 -13.397  -1.814
  385    H    ILE  54           H        ILE  54  -5.912  -8.117   2.643
  386    HA   ILE  54           HA       ILE  54  -3.160  -7.132   2.509
  387    HB   ILE  54           HB       ILE  54  -5.055  -5.942   1.273
  388   1HG1  ILE  54          11HG      ILE  54  -3.628  -4.259   3.344
  389   2HG1  ILE  54          12HG      ILE  54  -2.885  -4.859   1.864
  390   1HG2  ILE  54          21HG      ILE  54  -6.479  -4.429   2.643
  391   2HG2  ILE  54          22HG      ILE  54  -5.830  -5.218   4.090
  392   3HG2  ILE  54          23HG      ILE  54  -6.794  -6.143   2.944
  393   1HD1  ILE  54          11HD      ILE  54  -5.275  -3.041   1.990
  394   2HD1  ILE  54          12HD      ILE  54  -4.443  -3.603   0.536
  395   3HD1  ILE  54          13HD      ILE  54  -3.609  -2.527   1.656
  396    H    GLN  55           H        GLN  55  -2.177  -6.063   4.347
  397    HA   GLN  55           HA       GLN  55  -3.756  -6.158   6.748
  398   1HB   GLN  55          1HB       GLN  55  -0.952  -7.260   6.497
  399   2HB   GLN  55          2HB       GLN  55  -1.773  -6.996   8.026
  400   1HG   GLN  55          1HG       GLN  55  -3.448  -8.628   7.425
  401   2HG   GLN  55          2HG       GLN  55  -2.687  -8.868   5.855
  402   1HE2  GLN  55          21HE      GLN  55  -3.209 -10.723   8.016
  403   2HE2  GLN  55          22HE      GLN  55  -1.697 -11.419   8.466
  404    H    VAL  56           H        VAL  56  -2.759  -4.898   8.490
  405    HA   VAL  56           HA       VAL  56  -1.986  -2.275   7.611
  406    HB   VAL  56           HB       VAL  56  -3.506  -2.767   9.537
  407   1HG1  VAL  56          11HG      VAL  56  -2.596  -3.365  11.719
  408   2HG1  VAL  56          12HG      VAL  56  -1.021  -3.628  10.966
  409   3HG1  VAL  56          13HG      VAL  56  -2.386  -4.643  10.518
  410   1HG2  VAL  56          21HG      VAL  56  -2.624  -1.016  11.063
  411   2HG2  VAL  56          22HG      VAL  56  -2.552  -0.532   9.381
  412   3HG2  VAL  56          23HG      VAL  56  -1.088  -1.074  10.203
  413    H    ASN  57           H        ASN  57  -0.267  -5.022   8.414
  414    HA   ASN  57           HA       ASN  57   2.061  -3.519   9.359
  415   1HB   ASN  57          1HB       ASN  57   2.971  -5.525  10.180
  416   2HB   ASN  57          2HB       ASN  57   1.243  -5.567  10.523
  417   1HD2  ASN  57          21HD      ASN  57   0.645  -6.420   7.637
  418   2HD2  ASN  57          22HD      ASN  57   1.101  -8.064   7.621
  419    H    ASP  58           H        ASP  58   0.966  -3.914   6.547
  420    HA   ASP  58           HA       ASP  58   3.369  -4.954   5.278
  421   1HB   ASP  58          1HB       ASP  58   0.589  -4.495   4.204
  422   2HB   ASP  58          2HB       ASP  58   1.958  -4.868   3.163
  423    H    GLN  59           H        GLN  59   3.355  -3.772   2.896
  424    HA   GLN  59           HA       GLN  59   3.688  -0.925   3.381
  425   1HB   GLN  59          1HB       GLN  59   5.864  -1.868   3.710
  426   2HB   GLN  59          2HB       GLN  59   5.670  -2.919   2.316
  427   1HG   GLN  59          1HG       GLN  59   5.784  -1.030   0.839
  428   2HG   GLN  59          2HG       GLN  59   5.879   0.070   2.216
  429   1HE2  GLN  59          21HE      GLN  59   7.766   0.250   3.314
  430   2HE2  GLN  59          22HE      GLN  59   9.263  -0.392   2.716
  431    H    ILE  60           H        ILE  60   3.006   0.265   1.634
  432    HA   ILE  60           HA       ILE  60   1.567  -1.110  -0.472
  433    HB   ILE  60           HB       ILE  60   2.110   1.855  -0.183
  434   1HG1  ILE  60          11HG      ILE  60   0.911   1.083   1.832
  435   2HG1  ILE  60          12HG      ILE  60  -0.127   2.049   0.789
  436   1HG2  ILE  60          21HG      ILE  60   1.426   1.133  -2.399
  437   2HG2  ILE  60          22HG      ILE  60   0.142   2.084  -1.627
  438   3HG2  ILE  60          23HG      ILE  60   0.026   0.326  -1.703
  439   1HD1  ILE  60          11HD      ILE  60  -1.190   0.011  -0.041
  440   2HD1  ILE  60          12HD      ILE  60  -1.332   0.166   1.710
  441   3HD1  ILE  60          13HD      ILE  60  -0.149  -0.946   1.017
  442    H    VAL  61           H        VAL  61   2.635  -1.824  -2.239
  443    HA   VAL  61           HA       VAL  61   5.186  -0.570  -2.965
  444    HB   VAL  61           HB       VAL  61   3.875  -3.136  -3.925
  445   1HG1  VAL  61          11HG      VAL  61   5.955  -3.702  -4.960
  446   2HG1  VAL  61          12HG      VAL  61   6.652  -2.137  -4.509
  447   3HG1  VAL  61          13HG      VAL  61   5.304  -2.217  -5.658
  448   1HG2  VAL  61          21HG      VAL  61   4.586  -3.260  -1.610
  449   2HG2  VAL  61          22HG      VAL  61   6.206  -2.719  -2.060
  450   3HG2  VAL  61          23HG      VAL  61   5.601  -4.276  -2.631
  451    H    GLU  62           H        GLU  62   2.159  -1.530  -4.501
  452    HA   GLU  62           HA       GLU  62   2.391   0.717  -6.336
  453   1HB   GLU  62          1HB       GLU  62   3.540  -0.980  -7.577
  454   2HB   GLU  62          2HB       GLU  62   2.303  -2.174  -7.322
  455   1HG   GLU  62          1HG       GLU  62   0.774  -0.483  -8.583
  456   2HG   GLU  62          2HG       GLU  62   2.303   0.223  -9.102
  457    H    VAL  63           H        VAL  63   0.490   1.674  -5.918
  458    HA   VAL  63           HA       VAL  63  -1.857  -0.041  -5.839
  459    HB   VAL  63           HB       VAL  63  -1.316   2.653  -4.574
  460   1HG1  VAL  63          11HG      VAL  63  -3.282   3.034  -5.973
  461   2HG1  VAL  63          12HG      VAL  63  -3.729   2.989  -4.252
  462   3HG1  VAL  63          13HG      VAL  63  -4.065   1.602  -5.298
  463   1HG2  VAL  63          21HG      VAL  63  -1.131   0.516  -3.365
  464   2HG2  VAL  63          22HG      VAL  63  -2.826   0.205  -3.722
  465   3HG2  VAL  63          23HG      VAL  63  -2.380   1.582  -2.718
  466    H    ASP  64           H        ASP  64  -3.127  -0.157  -7.404
  467    HA   ASP  64           HA       ASP  64  -4.289   0.220  -9.278
  468   1HB   ASP  64          1HB       ASP  64  -5.036   2.202  -7.979
  469   2HB   ASP  64          2HB       ASP  64  -3.768   3.154  -8.734
  470    H    GLY  65           H        GLY  65  -1.296   0.102  -9.329
  471   1HA   GLY  65          1HA       GLY  65   0.214  -0.177 -11.069
  472   2HA   GLY  65          2HA       GLY  65  -0.971   0.544 -12.152
  473    H    ILE  66           H        ILE  66  -0.498   2.509  -9.453
  474    HA   ILE  66           HA       ILE  66   0.719   4.475 -11.104
  475    HB   ILE  66           HB       ILE  66  -0.974   4.754  -9.028
  476   1HG1  ILE  66          11HG      ILE  66   1.295   6.682  -9.567
  477   2HG1  ILE  66          12HG      ILE  66  -0.145   6.515 -10.573
  478   1HG2  ILE  66          21HG      ILE  66   1.726   5.007  -7.734
  479   2HG2  ILE  66          22HG      ILE  66   0.494   3.799  -7.359
  480   3HG2  ILE  66          23HG      ILE  66   0.193   5.510  -7.025
  481   1HD1  ILE  66          11HD      ILE  66  -0.348   8.430  -9.136
  482   2HD1  ILE  66          12HD      ILE  66  -0.009   7.413  -7.735
  483   3HD1  ILE  66          13HD      ILE  66  -1.508   7.184  -8.643
  484    H    SER  67           H        SER  67   1.945   1.997  -9.242
  485    HA   SER  67           HA       SER  67   3.854   1.432  -8.229
  486   1HB   SER  67          1HB       SER  67   4.786   2.951 -10.589
  487   2HB   SER  67          2HB       SER  67   5.782   1.747  -9.718
  488    HG   SER  67           HG       SER  67   4.008   1.379 -11.670
  489    H    LEU  68           H        LEU  68   3.586   2.653  -6.330
  490    HA   LEU  68           HA       LEU  68   4.939   5.234  -6.257
  491   1HB   LEU  68          1HB       LEU  68   3.788   5.569  -4.138
  492   2HB   LEU  68          2HB       LEU  68   2.667   5.169  -5.420
  493    HG   LEU  68           HG       LEU  68   3.206   2.735  -4.284
  494   1HD1  LEU  68          11HD      LEU  68   2.925   3.022  -1.880
  495   2HD1  LEU  68          12HD      LEU  68   3.009   4.776  -2.083
  496   3HD1  LEU  68          13HD      LEU  68   4.411   3.782  -2.457
  497   1HD2  LEU  68          21HD      LEU  68   0.945   2.939  -3.397
  498   2HD2  LEU  68          22HD      LEU  68   1.111   3.519  -5.053
  499   3HD2  LEU  68          23HD      LEU  68   0.990   4.683  -3.722
  500    H    VAL  69           H        VAL  69   5.815   2.337  -6.099
  501    HA   VAL  69           HA       VAL  69   7.345   1.948  -3.836
  502    HB   VAL  69           HB       VAL  69   6.975   0.143  -5.413
  503   1HG1  VAL  69          11HG      VAL  69   8.638   1.637  -7.421
  504   2HG1  VAL  69          12HG      VAL  69   6.901   1.333  -7.490
  505   3HG1  VAL  69          13HG      VAL  69   8.034  -0.011  -7.608
  506   1HG2  VAL  69          21HG      VAL  69   8.951  -0.195  -4.104
  507   2HG2  VAL  69          22HG      VAL  69   9.906   0.798  -5.204
  508   3HG2  VAL  69          23HG      VAL  69   9.282  -0.759  -5.741
  509    H    GLY  70           H        GLY  70   8.270   3.767  -3.138
  510   1HA   GLY  70          1HA       GLY  70  10.587   4.588  -2.878
  511   2HA   GLY  70          2HA       GLY  70  10.631   4.730  -4.627
  512    H    VAL  71           H        VAL  71   7.733   5.691  -3.035
  513    HA   VAL  71           HA       VAL  71   8.437   8.475  -3.667
  514    HB   VAL  71           HB       VAL  71   6.079   9.014  -3.729
  515   1HG1  VAL  71          11HG      VAL  71   7.037   8.159  -5.763
  516   2HG1  VAL  71          12HG      VAL  71   5.358   7.637  -5.608
  517   3HG1  VAL  71          13HG      VAL  71   6.669   6.506  -5.269
  518   1HG2  VAL  71          21HG      VAL  71   4.339   7.339  -3.363
  519   2HG2  VAL  71          22HG      VAL  71   5.321   7.544  -1.916
  520   3HG2  VAL  71          23HG      VAL  71   5.564   6.137  -2.952
  521    H    THR  72           H        THR  72   7.093  10.076  -2.218
  522    HA   THR  72           HA       THR  72   7.784   9.500   0.537
  523    HB   THR  72           HB       THR  72   7.031  11.987   0.674
  524    HG1  THR  72           HG1      THR  72   7.831  12.128  -1.982
  525   1HG2  THR  72          21HG      THR  72   9.370  11.264   0.921
  526   2HG2  THR  72          22HG      THR  72   9.290  12.734  -0.048
  527   3HG2  THR  72          23HG      THR  72   9.539  11.173  -0.830
  528    H    GLN  73           H        GLN  73   6.194  10.500   2.124
  529    HA   GLN  73           HA       GLN  73   3.866   8.957   1.920
  530   1HB   GLN  73          1HB       GLN  73   3.449   9.461   4.140
  531   2HB   GLN  73          2HB       GLN  73   5.134   9.908   4.051
  532   1HG   GLN  73          1HG       GLN  73   2.839  11.820   3.811
  533   2HG   GLN  73          2HG       GLN  73   3.710  11.499   5.302
  534   1HE2  GLN  73          21HE      GLN  73   6.305  11.329   4.039
  535   2HE2  GLN  73          22HE      GLN  73   6.711  12.914   3.554
  536    H    ASN  74           H        ASN  74   4.538  12.224   1.053
  537    HA   ASN  74           HA       ASN  74   1.804  13.045   0.959
  538   1HB   ASN  74          1HB       ASN  74   2.575  15.025  -0.317
  539   2HB   ASN  74          2HB       ASN  74   3.531  14.778   1.140
  540   1HD2  ASN  74          21HD      ASN  74   5.704  14.352   0.947
  541   2HD2  ASN  74          22HD      ASN  74   6.519  14.348  -0.566
  542    H    PHE  75           H        PHE  75   3.934  11.445  -1.263
  543    HA   PHE  75           HA       PHE  75   2.151  11.790  -3.476
  544   1HB   PHE  75          1HB       PHE  75   4.611  11.348  -3.753
  545   2HB   PHE  75          2HB       PHE  75   4.320   9.736  -3.114
  546    HD1  PHE  75           HD1      PHE  75   4.218  11.823  -6.045
  547    HD2  PHE  75           HD2      PHE  75   2.838   8.144  -4.420
  548    HE1  PHE  75           HE1      PHE  75   3.711  11.003  -8.304
  549    HE2  PHE  75           HE2      PHE  75   2.338   7.324  -6.649
  550    HZ   PHE  75           HZ       PHE  75   2.766   8.751  -8.619
  551    H    ALA  76           H        ALA  76   3.086   9.175  -1.289
  552    HA   ALA  76           HA       ALA  76   1.389   7.213  -2.244
  553   1HB   ALA  76          1HB       ALA  76   2.334   7.566   0.587
  554   2HB   ALA  76          2HB       ALA  76   3.242   6.807  -0.724
  555   3HB   ALA  76          3HB       ALA  76   1.742   6.075  -0.152
  556    H    ALA  77           H        ALA  77   0.763   9.501   0.452
  557    HA   ALA  77           HA       ALA  77  -1.757   8.497   1.112
  558   1HB   ALA  77          1HB       ALA  77  -2.153  10.652   2.216
  559   2HB   ALA  77          2HB       ALA  77  -0.754  11.327   1.376
  560   3HB   ALA  77          3HB       ALA  77  -0.534  10.038   2.558
  561    H    THR  78           H        THR  78  -0.784  10.831  -1.318
  562    HA   THR  78           HA       THR  78  -3.353  11.686  -2.091
  563    HB   THR  78           HB       THR  78  -0.801  11.452  -3.648
  564    HG1  THR  78           HG1      THR  78  -0.429  12.985  -2.132
  565   1HG2  THR  78          21HG      THR  78  -2.651  11.559  -5.167
  566   2HG2  THR  78          22HG      THR  78  -1.762  13.091  -5.229
  567   3HG2  THR  78          23HG      THR  78  -3.301  12.985  -4.356
  568    H    VAL  79           H        VAL  79  -1.327   9.008  -3.198
  569    HA   VAL  79           HA       VAL  79  -3.050   8.058  -5.220
  570    HB   VAL  79           HB       VAL  79  -1.208   6.346  -3.544
  571   1HG1  VAL  79          11HG      VAL  79  -2.203   5.993  -6.375
  572   2HG1  VAL  79          12HG      VAL  79  -2.845   5.180  -4.967
  573   3HG1  VAL  79          13HG      VAL  79  -1.185   4.866  -5.469
  574   1HG2  VAL  79          21HG      VAL  79   0.043   8.213  -4.380
  575   2HG2  VAL  79          22HG      VAL  79  -0.643   8.001  -5.977
  576   3HG2  VAL  79          23HG      VAL  79   0.466   6.780  -5.324
  577    H    LEU  80           H        LEU  80  -2.603   6.977  -1.868
  578    HA   LEU  80           HA       LEU  80  -4.736   5.148  -1.914
  579   1HB   LEU  80          1HB       LEU  80  -3.298   6.462   0.388
  580   2HB   LEU  80          2HB       LEU  80  -4.632   5.370   0.656
  581    HG   LEU  80           HG       LEU  80  -2.645   4.132   1.020
  582   1HD1  LEU  80          11HD      LEU  80  -4.359   2.942  -0.166
  583   2HD1  LEU  80          12HD      LEU  80  -2.745   2.351  -0.564
  584   3HD1  LEU  80          13HD      LEU  80  -3.614   3.372  -1.706
  585   1HD2  LEU  80          21HD      LEU  80  -1.653   4.985  -1.692
  586   2HD2  LEU  80          22HD      LEU  80  -0.847   3.854  -0.602
  587   3HD2  LEU  80          23HD      LEU  80  -1.035   5.549  -0.143
  588    H    ARG  81           H        ARG  81  -4.763   8.527  -1.645
  589    HA   ARG  81           HA       ARG  81  -7.480   8.679  -0.672
  590   1HB   ARG  81          1HB       ARG  81  -5.923  10.425   0.004
  591   2HB   ARG  81          2HB       ARG  81  -5.505  10.766  -1.653
  592   1HG   ARG  81          1HG       ARG  81  -8.302  11.214  -0.687
  593   2HG   ARG  81          2HG       ARG  81  -7.039  12.393  -0.338
  594   1HD   ARG  81          1HD       ARG  81  -6.597  12.683  -2.675
  595   2HD   ARG  81          2HD       ARG  81  -7.698  11.400  -3.108
  596    HE   ARG  81           HE       ARG  81  -8.497  14.018  -1.996
  597   1HH1  ARG  81          11HH      ARG  81  -9.485  10.962  -3.541
  598   2HH1  ARG  81          12HH      ARG  81 -10.975  11.560  -4.090
  599   1HH2  ARG  81          21HH      ARG  81 -10.572  14.813  -2.711
  600   2HH2  ARG  81          22HH      ARG  81 -11.635  13.807  -3.588
  601    H    ASN  82           H        ASN  82  -5.852   8.515  -3.699
  602    HA   ASN  82           HA       ASN  82  -8.132   9.445  -5.246
  603   1HB   ASN  82          1HB       ASN  82  -5.306   8.841  -5.868
  604   2HB   ASN  82          2HB       ASN  82  -6.481   8.588  -7.162
  605   1HD2  ASN  82          21HD      ASN  82  -5.114  10.923  -4.973
  606   2HD2  ASN  82          22HD      ASN  82  -5.651  12.316  -5.857
  607    H    THR  83           H        THR  83  -7.587   6.756  -3.738
  608    HA   THR  83           HA       THR  83  -8.134   4.785  -5.697
  609    HB   THR  83           HB       THR  83  -8.605   3.367  -3.679
  610    HG1  THR  83           HG1      THR  83  -7.563   5.172  -1.891
  611   1HG2  THR  83          21HG      THR  83  -6.014   4.937  -3.649
  612   2HG2  THR  83          22HG      THR  83  -6.347   3.543  -4.667
  613   3HG2  THR  83          23HG      THR  83  -6.257   3.348  -2.924
  614    H    LYS  84           H        LYS  84 -10.127   3.275  -4.938
  615    HA   LYS  84           HA       LYS  84 -12.473   4.635  -4.251
  616   1HB   LYS  84          1HB       LYS  84 -13.667   3.907  -6.419
  617   2HB   LYS  84          2HB       LYS  84 -12.652   5.328  -6.507
  618   1HG   LYS  84          1HG       LYS  84 -12.318   4.106  -8.506
  619   2HG   LYS  84          2HG       LYS  84 -10.886   3.877  -7.506
  620   1HD   LYS  84          1HD       LYS  84 -11.535   1.665  -6.936
  621   2HD   LYS  84          2HD       LYS  84 -13.151   1.901  -7.598
  622   1HE   LYS  84          1HE       LYS  84 -10.595   1.907  -9.209
  623   2HE   LYS  84          2HE       LYS  84 -11.695   0.539  -9.064
  624   1HZ   LYS  84          1HZ       LYS  84 -13.440   1.935 -10.076
  625   2HZ   LYS  84          2HZ       LYS  84 -12.112   1.761 -11.096
  626   3HZ   LYS  84          3HZ       LYS  84 -12.325   3.179 -10.281
  627    H    GLY  85           H        GLY  85 -14.233   2.583  -5.188
  628   1HA   GLY  85          1HA       GLY  85 -14.101   0.693  -3.233
  629   2HA   GLY  85          2HA       GLY  85 -14.908   0.446  -4.767
  630    H    ASN  86           H        ASN  86 -13.428  -0.333  -6.568
  631    HA   ASN  86           HA       ASN  86 -11.887  -2.546  -5.500
  632   1HB   ASN  86          1HB       ASN  86 -12.496  -1.811  -8.360
  633   2HB   ASN  86          2HB       ASN  86 -11.613  -3.252  -7.880
  634   1HD2  ASN  86          21HD      ASN  86 -12.760  -4.950  -6.856
  635   2HD2  ASN  86          22HD      ASN  86 -14.484  -5.023  -6.877
  636    H    VAL  87           H        VAL  87  -9.941  -2.138  -4.812
  637    HA   VAL  87           HA       VAL  87  -8.174  -0.361  -6.406
  638    HB   VAL  87           HB       VAL  87  -7.505  -1.208  -3.675
  639   1HG1  VAL  87          11HG      VAL  87  -5.871  -0.034  -4.945
  640   2HG1  VAL  87          12HG      VAL  87  -6.392   0.942  -3.569
  641   3HG1  VAL  87          13HG      VAL  87  -6.980   1.314  -5.195
  642   1HG2  VAL  87          21HG      VAL  87  -9.420   1.046  -4.218
  643   2HG2  VAL  87          22HG      VAL  87  -8.693   0.589  -2.655
  644   3HG2  VAL  87          23HG      VAL  87  -9.773  -0.524  -3.488
  645    H    ARG  88           H        ARG  88  -6.327  -1.244  -7.128
  646    HA   ARG  88           HA       ARG  88  -5.691  -3.972  -6.295
  647   1HB   ARG  88          1HB       ARG  88  -4.783  -2.304  -8.635
  648   2HB   ARG  88          2HB       ARG  88  -4.191  -3.925  -8.276
  649   1HG   ARG  88          1HG       ARG  88  -6.287  -4.886  -8.618
  650   2HG   ARG  88          2HG       ARG  88  -7.101  -3.317  -8.655
  651   1HD   ARG  88          1HD       ARG  88  -5.917  -2.766 -10.684
  652   2HD   ARG  88          2HD       ARG  88  -5.118  -4.352 -10.660
  653    HE   ARG  88           HE       ARG  88  -7.661  -5.071 -10.631
  654   1HH1  ARG  88          11HH      ARG  88  -6.148  -2.517 -12.590
  655   2HH1  ARG  88          12HH      ARG  88  -7.160  -2.743 -13.931
  656   1HH2  ARG  88          21HH      ARG  88  -9.057  -5.378 -12.486
  657   2HH2  ARG  88          22HH      ARG  88  -8.870  -4.422 -13.875
  658    H    PHE  89           H        PHE  89  -4.711  -3.810  -4.456
  659    HA   PHE  89           HA       PHE  89  -2.503  -1.947  -4.075
  660   1HB   PHE  89          1HB       PHE  89  -3.622  -4.058  -2.217
  661   2HB   PHE  89          2HB       PHE  89  -2.382  -2.882  -1.831
  662    HD1  PHE  89           HD1      PHE  89  -5.931  -3.482  -2.276
  663    HD2  PHE  89           HD2      PHE  89  -2.957  -0.569  -1.472
  664    HE1  PHE  89           HE1      PHE  89  -7.659  -1.944  -1.443
  665    HE2  PHE  89           HE2      PHE  89  -4.669   0.964  -0.644
  666    HZ   PHE  89           HZ       PHE  89  -7.014   0.286  -0.619
  667    H    VAL  90           H        VAL  90  -0.780  -2.702  -5.222
  668    HA   VAL  90           HA       VAL  90  -0.218  -5.519  -5.008
  669    HB   VAL  90           HB       VAL  90   1.194  -3.360  -6.557
  670   1HG1  VAL  90          11HG      VAL  90   2.718  -5.201  -6.011
  671   2HG1  VAL  90          12HG      VAL  90   2.341  -5.236  -7.734
  672   3HG1  VAL  90          13HG      VAL  90   1.553  -6.369  -6.635
  673   1HG2  VAL  90          21HG      VAL  90  -0.661  -5.514  -7.551
  674   2HG2  VAL  90          22HG      VAL  90   0.165  -4.317  -8.552
  675   3HG2  VAL  90          23HG      VAL  90  -1.055  -3.807  -7.389
  676    H    ILE  91           H        ILE  91   0.364  -5.682  -3.038
  677    HA   ILE  91           HA       ILE  91   2.598  -4.167  -1.919
  678    HB   ILE  91           HB       ILE  91   0.338  -5.832  -0.805
  679   1HG1  ILE  91          11HG      ILE  91   1.104  -2.971  -0.387
  680   2HG1  ILE  91          12HG      ILE  91  -0.103  -3.516  -1.541
  681   1HG2  ILE  91          21HG      ILE  91   2.314  -6.348   0.559
  682   2HG2  ILE  91          22HG      ILE  91   1.102  -5.427   1.441
  683   3HG2  ILE  91          23HG      ILE  91   2.559  -4.620   0.847
  684   1HD1  ILE  91          11HD      ILE  91  -1.069  -2.654   0.385
  685   2HD1  ILE  91          12HD      ILE  91  -0.185  -3.820   1.408
  686   3HD1  ILE  91          13HD      ILE  91  -1.400  -4.386   0.210
  687    H    GLY  92           H        GLY  92   4.177  -5.576  -0.663
  688   1HA   GLY  92          1HA       GLY  92   4.239  -8.260  -1.747
  689   2HA   GLY  92          2HA       GLY  92   5.652  -7.245  -1.956
  690    H    ARG  93           H        ARG  93   5.753  -9.635  -0.616
  691    HA   ARG  93           HA       ARG  93   6.674  -8.784   2.068
  692   1HB   ARG  93          1HB       ARG  93   4.386  -9.859   2.171
  693   2HB   ARG  93          2HB       ARG  93   5.175 -11.331   1.607
  694   1HG   ARG  93          1HG       ARG  93   6.779 -11.088   3.506
  695   2HG   ARG  93          2HG       ARG  93   5.745  -9.797   4.114
  696   1HD   ARG  93          1HD       ARG  93   5.250 -11.735   5.193
  697   2HD   ARG  93          2HD       ARG  93   3.883 -11.355   4.127
  698    HE   ARG  93           HE       ARG  93   5.932 -13.418   3.588
  699   1HH1  ARG  93          11HH      ARG  93   2.577 -12.291   3.258
  700   2HH1  ARG  93          12HH      ARG  93   2.068 -13.618   2.339
  701   1HH2  ARG  93          21HH      ARG  93   5.170 -15.314   2.294
  702   2HH2  ARG  93          22HH      ARG  93   3.541 -15.359   1.819
  703    H    GLU  94           H        GLU  94   8.518  -9.857   2.666
  704    HA   GLU  94           HA       GLU  94   9.790 -11.444   0.648
  705   1HB   GLU  94          1HB       GLU  94  11.711 -11.457   2.307
  706   2HB   GLU  94          2HB       GLU  94  11.245  -9.880   1.690
  707   1HG   GLU  94          1HG       GLU  94  10.067  -9.393   3.745
  708   2HG   GLU  94          2HG       GLU  94  10.411 -11.012   4.347
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1  16.778 -14.063   0.325
    2   2H    GLY   1          2H        GLY   1  17.216 -13.169   1.700
    3   3H    GLY   1          3H        GLY   1  16.807 -12.390   0.249
    4   1HA   GLY   1          1HA       GLY   1  14.952 -14.019   1.812
    5   2HA   GLY   1          2HA       GLY   1  15.010 -12.255   1.825
    6    H    HIS   2           H        HIS   2  13.022 -14.379   0.822
    7    HA   HIS   2           HA       HIS   2  12.915 -13.641  -1.999
    8   1HB   HIS   2          1HB       HIS   2  11.139 -15.522  -0.426
    9   2HB   HIS   2          2HB       HIS   2  11.041 -15.242  -2.151
   10    HD1  HIS   2           HD1      HIS   2  12.650 -17.380   0.330
   11    HD2  HIS   2           HD2      HIS   2  13.327 -16.221  -3.590
   12    HE1  HIS   2           HE1      HIS   2  14.302 -19.048  -0.620
   13    H    MET   3           H        MET   3  12.251 -11.486  -1.942
   14    HA   MET   3           HA       MET   3   9.830 -10.917  -0.472
   15   1HB   MET   3          1HB       MET   3  11.608  -9.138  -0.721
   16   2HB   MET   3          2HB       MET   3  11.216  -9.083  -2.435
   17   1HG   MET   3          1HG       MET   3   8.965  -8.389  -1.977
   18   2HG   MET   3          2HG       MET   3   9.216  -8.565  -0.244
   19   1HE   MET   3          1HE       MET   3   7.936  -5.963  -1.414
   20   2HE   MET   3          2HE       MET   3   8.840  -4.719  -0.551
   21   3HE   MET   3          3HE       MET   3   8.325  -6.180   0.291
   22    H    GLU   4           H        GLU   4   8.030 -11.522  -1.183
   23    HA   GLU   4           HA       GLU   4   7.588 -11.999  -4.028
   24   1HB   GLU   4          1HB       GLU   4   7.027 -13.747  -2.321
   25   2HB   GLU   4          2HB       GLU   4   5.913 -12.557  -1.629
   26   1HG   GLU   4          1HG       GLU   4   4.535 -12.606  -3.592
   27   2HG   GLU   4          2HG       GLU   4   5.693 -13.621  -4.436
   28    H    LEU   5           H        LEU   5   6.750 -10.329  -5.101
   29    HA   LEU   5           HA       LEU   5   5.109  -8.411  -3.692
   30   1HB   LEU   5          1HB       LEU   5   6.013  -8.442  -6.580
   31   2HB   LEU   5          2HB       LEU   5   5.193  -7.125  -5.769
   32    HG   LEU   5           HG       LEU   5   7.354  -6.419  -5.901
   33   1HD1  LEU   5          11HD      LEU   5   7.193  -7.634  -3.205
   34   2HD1  LEU   5          12HD      LEU   5   6.492  -6.090  -3.708
   35   3HD1  LEU   5          13HD      LEU   5   8.249  -6.301  -3.675
   36   1HD2  LEU   5          21HD      LEU   5   8.456  -8.446  -6.640
   37   2HD2  LEU   5          22HD      LEU   5   8.350  -9.120  -5.014
   38   3HD2  LEU   5          23HD      LEU   5   9.365  -7.711  -5.320
   39    H    PHE   6           H        PHE   6   2.933  -8.457  -3.841
   40    HA   PHE   6           HA       PHE   6   1.790 -10.106  -5.907
   41   1HB   PHE   6          1HB       PHE   6   0.209 -10.988  -4.124
   42   2HB   PHE   6          2HB       PHE   6   1.798 -11.730  -4.235
   43    HD1  PHE   6           HD1      PHE   6   3.296 -11.514  -2.350
   44    HD2  PHE   6           HD2      PHE   6  -0.432  -9.521  -2.392
   45    HE1  PHE   6           HE1      PHE   6   3.558 -11.052   0.038
   46    HE2  PHE   6           HE2      PHE   6  -0.202  -9.025   0.040
   47    HZ   PHE   6           HZ       PHE   6   1.803  -9.795   1.251
   48    HA   PRO   7           HA       PRO   7  -1.196  -6.847  -5.999
   49   1HB   PRO   7          1HB       PRO   7  -2.904  -7.918  -7.648
   50   2HB   PRO   7          2HB       PRO   7  -1.313  -7.395  -8.201
   51   1HG   PRO   7          1HG       PRO   7  -2.251 -10.192  -7.555
   52   2HG   PRO   7          2HG       PRO   7  -1.227  -9.659  -8.912
   53   1HD   PRO   7          1HD       PRO   7  -0.338 -10.775  -6.542
   54   2HD   PRO   7          2HD       PRO   7   0.644  -9.719  -7.594
   55    H    VAL   8           H        VAL   8  -2.533  -6.504  -4.419
   56    HA   VAL   8           HA       VAL   8  -4.464  -8.567  -3.767
   57    HB   VAL   8           HB       VAL   8  -3.813  -6.098  -2.134
   58   1HG1  VAL   8          11HG      VAL   8  -5.387  -8.554  -1.413
   59   2HG1  VAL   8          12HG      VAL   8  -6.023  -6.937  -1.714
   60   3HG1  VAL   8          13HG      VAL   8  -4.985  -7.232  -0.314
   61   1HG2  VAL   8          21HG      VAL   8  -1.879  -7.517  -2.240
   62   2HG2  VAL   8          22HG      VAL   8  -2.837  -8.916  -1.734
   63   3HG2  VAL   8          23HG      VAL   8  -2.574  -7.564  -0.617
   64    H    GLU   9           H        GLU   9  -5.985  -8.186  -5.272
   65    HA   GLU   9           HA       GLU   9  -6.849  -5.507  -5.819
   66   1HB   GLU   9          1HB       GLU   9  -6.661  -7.283  -7.561
   67   2HB   GLU   9          2HB       GLU   9  -7.990  -8.129  -6.783
   68   1HG   GLU   9          1HG       GLU   9  -9.499  -6.378  -7.343
   69   2HG   GLU   9          2HG       GLU   9  -8.180  -5.353  -7.916
   70    H    LEU  10           H        LEU  10  -7.942  -4.595  -4.295
   71    HA   LEU  10           HA       LEU  10  -9.674  -6.170  -2.555
   72   1HB   LEU  10          1HB       LEU  10  -7.751  -4.330  -2.044
   73   2HB   LEU  10          2HB       LEU  10  -9.143  -3.283  -2.193
   74    HG   LEU  10           HG       LEU  10  -8.803  -3.702   0.108
   75   1HD1  LEU  10          11HD      LEU  10 -10.840  -4.797   0.826
   76   2HD1  LEU  10          12HD      LEU  10 -11.056  -5.461  -0.789
   77   3HD1  LEU  10          13HD      LEU  10 -11.130  -3.720  -0.541
   78   1HD2  LEU  10          21HD      LEU  10  -8.742  -6.636  -0.550
   79   2HD2  LEU  10          22HD      LEU  10  -8.700  -5.947   1.071
   80   3HD2  LEU  10          23HD      LEU  10  -7.377  -5.637  -0.052
   81    H    GLU  11           H        GLU  11 -11.877  -5.743  -2.647
   82    HA   GLU  11           HA       GLU  11 -12.679  -3.566  -4.419
   83   1HB   GLU  11          1HB       GLU  11 -13.500  -5.835  -5.056
   84   2HB   GLU  11          2HB       GLU  11 -14.337  -5.930  -3.513
   85   1HG   GLU  11          1HG       GLU  11 -15.697  -4.005  -4.126
   86   2HG   GLU  11          2HG       GLU  11 -14.855  -3.903  -5.673
   87    H    LYS  12           H        LYS  12 -12.643  -1.919  -3.118
   88    HA   LYS  12           HA       LYS  12 -13.729  -2.059  -0.493
   89   1HB   LYS  12          1HB       LYS  12 -12.127  -0.096  -1.975
   90   2HB   LYS  12          2HB       LYS  12 -13.047   0.544  -0.643
   91   1HG   LYS  12          1HG       LYS  12 -10.935  -1.623  -0.624
   92   2HG   LYS  12          2HG       LYS  12 -10.791  -0.004   0.074
   93   1HD   LYS  12          1HD       LYS  12 -13.061  -1.403   1.168
   94   2HD   LYS  12          2HD       LYS  12 -11.602  -2.389   1.373
   95   1HE   LYS  12          1HE       LYS  12 -11.862  -1.152   3.320
   96   2HE   LYS  12          2HE       LYS  12 -10.615  -0.301   2.447
   97   1HZ   LYS  12          1HZ       LYS  12 -13.496   0.513   2.529
   98   2HZ   LYS  12          2HZ       LYS  12 -12.331   1.325   1.675
   99   3HZ   LYS  12          3HZ       LYS  12 -12.265   1.286   3.352
  100    H    ASP  13           H        ASP  13 -14.800  -0.006   0.224
  101    HA   ASP  13           HA       ASP  13 -17.399   0.015  -0.988
  102   1HB   ASP  13          1HB       ASP  13 -17.949   1.106   1.213
  103   2HB   ASP  13          2HB       ASP  13 -17.333  -0.537   1.320
  104    H    GLU  14           H        GLU  14 -18.460   2.256  -0.331
  105    HA   GLU  14           HA       GLU  14 -17.510   4.026  -2.323
  106   1HB   GLU  14          1HB       GLU  14 -19.466   5.408  -1.725
  107   2HB   GLU  14          2HB       GLU  14 -19.870   3.725  -2.018
  108   1HG   GLU  14          1HG       GLU  14 -19.944   3.350   0.423
  109   2HG   GLU  14          2HG       GLU  14 -19.609   5.061   0.669
  110    H    ASP  15           H        ASP  15 -16.765   3.846   0.998
  111    HA   ASP  15           HA       ASP  15 -16.290   6.658   1.397
  112   1HB   ASP  15          1HB       ASP  15 -16.769   5.008   3.239
  113   2HB   ASP  15          2HB       ASP  15 -15.163   4.348   2.991
  114    H    GLY  16           H        GLY  16 -14.557   3.924   0.251
  115   1HA   GLY  16          1HA       GLY  16 -12.713   4.437  -1.303
  116   2HA   GLY  16          2HA       GLY  16 -12.161   5.613  -0.102
  117    H    LEU  17           H        LEU  17 -10.400   4.842   0.893
  118    HA   LEU  17           HA       LEU  17 -10.423   1.968   1.536
  119   1HB   LEU  17          1HB       LEU  17  -8.078   3.784   1.980
  120   2HB   LEU  17          2HB       LEU  17  -8.114   2.040   1.883
  121    HG   LEU  17           HG       LEU  17  -8.389   4.003  -0.289
  122   1HD1  LEU  17          11HD      LEU  17  -6.324   1.914   0.341
  123   2HD1  LEU  17          12HD      LEU  17  -6.139   3.668   0.431
  124   3HD1  LEU  17          13HD      LEU  17  -6.342   2.880  -1.134
  125   1HD2  LEU  17          21HD      LEU  17  -8.498   2.084  -1.850
  126   2HD2  LEU  17          22HD      LEU  17  -9.906   2.188  -0.795
  127   3HD2  LEU  17          23HD      LEU  17  -8.647   0.996  -0.467
  128    H    GLY  18           H        GLY  18  -9.736   5.146   2.857
  129   1HA   GLY  18          1HA       GLY  18 -10.045   5.986   4.944
  130   2HA   GLY  18          2HA       GLY  18 -10.895   4.505   5.381
  131    H    ILE  19           H        ILE  19  -7.684   4.475   4.003
  132    HA   ILE  19           HA       ILE  19  -6.816   3.382   6.580
  133    HB   ILE  19           HB       ILE  19  -5.082   2.126   5.485
  134   1HG1  ILE  19          11HG      ILE  19  -5.895   3.459   2.893
  135   2HG1  ILE  19          12HG      ILE  19  -4.467   3.865   3.848
  136   1HG2  ILE  19          21HG      ILE  19  -7.586   1.949   3.820
  137   2HG2  ILE  19          22HG      ILE  19  -7.376   1.213   5.389
  138   3HG2  ILE  19          23HG      ILE  19  -6.390   0.665   4.025
  139   1HD1  ILE  19          11HD      ILE  19  -3.890   2.425   1.961
  140   2HD1  ILE  19          12HD      ILE  19  -4.997   1.188   2.564
  141   3HD1  ILE  19          13HD      ILE  19  -3.573   1.627   3.501
  142    H    SER  20           H        SER  20  -4.196   3.609   6.659
  143    HA   SER  20           HA       SER  20  -3.483   6.418   6.186
  144   1HB   SER  20          1HB       SER  20  -4.476   5.993   8.581
  145   2HB   SER  20          2HB       SER  20  -3.087   4.978   8.809
  146    HG   SER  20           HG       SER  20  -2.599   7.551   7.880
  147    H    ILE  21           H        ILE  21  -1.191   6.698   6.195
  148    HA   ILE  21           HA       ILE  21   0.313   4.197   5.828
  149    HB   ILE  21           HB       ILE  21   1.567   5.272   4.020
  150   1HG1  ILE  21          11HG      ILE  21   0.179   7.487   3.087
  151   2HG1  ILE  21          12HG      ILE  21  -0.038   7.629   4.802
  152   1HG2  ILE  21          21HG      ILE  21  -1.406   5.288   3.543
  153   2HG2  ILE  21          22HG      ILE  21  -0.320   3.906   3.395
  154   3HG2  ILE  21          23HG      ILE  21  -0.176   5.265   2.280
  155   1HD1  ILE  21          11HD      ILE  21   2.657   7.432   3.486
  156   2HD1  ILE  21          12HD      ILE  21   2.337   7.753   5.179
  157   3HD1  ILE  21          13HD      ILE  21   1.861   8.910   3.955
  158    H    ILE  22           H        ILE  22   2.681   4.521   6.134
  159    HA   ILE  22           HA       ILE  22   3.324   6.965   7.565
  160    HB   ILE  22           HB       ILE  22   3.094   5.427   9.297
  161   1HG1  ILE  22          11HG      ILE  22   6.049   5.705   8.773
  162   2HG1  ILE  22          12HG      ILE  22   5.005   6.903   9.529
  163   1HG2  ILE  22          21HG      ILE  22   3.140   3.322   8.213
  164   2HG2  ILE  22          22HG      ILE  22   4.375   3.306   9.473
  165   3HG2  ILE  22          23HG      ILE  22   4.847   3.543   7.783
  166   1HD1  ILE  22          11HD      ILE  22   6.305   5.739  11.182
  167   2HD1  ILE  22          12HD      ILE  22   5.672   4.187  10.626
  168   3HD1  ILE  22          13HD      ILE  22   4.593   5.363  11.380
  169    H    GLY  23           H        GLY  23   5.124   7.942   7.040
  170   1HA   GLY  23          1HA       GLY  23   6.636   6.772   4.851
  171   2HA   GLY  23          2HA       GLY  23   6.665   8.463   5.357
  172    H    MET  24           H        MET  24   8.099   5.439   5.552
  173    HA   MET  24           HA       MET  24  10.214   6.615   7.091
  174   1HB   MET  24          1HB       MET  24  10.396   4.575   8.598
  175   2HB   MET  24          2HB       MET  24   9.123   5.745   8.941
  176   1HG   MET  24          1HG       MET  24   7.483   4.297   7.968
  177   2HG   MET  24          2HG       MET  24   8.696   3.123   7.506
  178   1HE   MET  24          1HE       MET  24  10.087   1.671   9.234
  179   2HE   MET  24          2HE       MET  24   9.916   1.782  10.986
  180   3HE   MET  24          3HE       MET  24  10.638   3.115  10.089
  181    H    GLY  25           H        GLY  25  11.508   6.702   5.561
  182   1HA   GLY  25          1HA       GLY  25  12.005   4.925   3.505
  183   2HA   GLY  25          2HA       GLY  25  13.172   6.082   4.121
  184    H    VAL  26           H        VAL  26  12.503   2.927   3.631
  185    HA   VAL  26           HA       VAL  26  14.582   2.003   5.475
  186    HB   VAL  26           HB       VAL  26  12.205   1.630   6.278
  187   1HG1  VAL  26          11HG      VAL  26  10.906  -0.197   5.267
  188   2HG1  VAL  26          12HG      VAL  26  12.077  -0.243   3.947
  189   3HG1  VAL  26          13HG      VAL  26  11.115   1.204   4.215
  190   1HG2  VAL  26          21HG      VAL  26  12.560  -0.698   7.001
  191   2HG2  VAL  26          22HG      VAL  26  14.032   0.265   7.157
  192   3HG2  VAL  26          23HG      VAL  26  13.842  -0.854   5.803
  193    H    GLY  27           H        GLY  27  15.487  -0.070   4.695
  194   1HA   GLY  27          1HA       GLY  27  15.872  -1.770   3.183
  195   2HA   GLY  27          2HA       GLY  27  14.618  -1.105   2.153
  196    H    ALA  28           H        ALA  28  17.732   0.018   3.402
  197    HA   ALA  28           HA       ALA  28  18.513   0.729   0.639
  198   1HB   ALA  28          1HB       ALA  28  19.694   1.569   3.275
  199   2HB   ALA  28          2HB       ALA  28  18.611   2.560   2.290
  200   3HB   ALA  28          3HB       ALA  28  20.225   2.135   1.693
  201    H    ASP  29           H        ASP  29  18.664  -1.665   2.726
  202    HA   ASP  29           HA       ASP  29  21.290  -2.343   3.299
  203   1HB   ASP  29          1HB       ASP  29  18.929  -4.208   2.961
  204   2HB   ASP  29          2HB       ASP  29  20.412  -4.489   3.860
  205    H    ALA  30           H        ALA  30  19.213  -3.253   0.634
  206    HA   ALA  30           HA       ALA  30  21.310  -4.904  -0.522
  207   1HB   ALA  30          1HB       ALA  30  19.066  -5.797  -0.435
  208   2HB   ALA  30          2HB       ALA  30  19.576  -5.600  -2.119
  209   3HB   ALA  30          3HB       ALA  30  18.468  -4.438  -1.377
  210    H    GLY  31           H        GLY  31  20.738  -1.737  -0.514
  211   1HA   GLY  31          1HA       GLY  31  21.944  -0.175  -1.813
  212   2HA   GLY  31          2HA       GLY  31  22.125  -1.428  -3.033
  213    H    LEU  32           H        LEU  32  18.911  -1.243  -2.130
  214    HA   LEU  32           HA       LEU  32  18.383   0.083  -4.654
  215   1HB   LEU  32          1HB       LEU  32  16.575  -1.479  -2.837
  216   2HB   LEU  32          2HB       LEU  32  15.966  -0.545  -4.178
  217    HG   LEU  32           HG       LEU  32  16.073  -2.806  -4.834
  218   1HD1  LEU  32          11HD      LEU  32  16.637  -1.238  -6.557
  219   2HD1  LEU  32          12HD      LEU  32  17.506  -2.755  -6.779
  220   3HD1  LEU  32          13HD      LEU  32  18.349  -1.350  -6.133
  221   1HD2  LEU  32          21HD      LEU  32  17.666  -3.688  -3.251
  222   2HD2  LEU  32          22HD      LEU  32  18.975  -2.800  -4.025
  223   3HD2  LEU  32          23HD      LEU  32  18.164  -4.110  -4.888
  224    H    GLU  33           H        GLU  33  17.619   0.567  -1.243
  225    HA   GLU  33           HA       GLU  33  16.583   2.183  -0.089
  226   1HB   GLU  33          1HB       GLU  33  17.363   3.949  -2.420
  227   2HB   GLU  33          2HB       GLU  33  16.751   4.548  -0.883
  228   1HG   GLU  33          1HG       GLU  33  18.744   3.607   0.216
  229   2HG   GLU  33          2HG       GLU  33  19.345   3.105  -1.368
  230    H    LYS  34           H        LYS  34  14.579   1.247  -0.199
  231    HA   LYS  34           HA       LYS  34  13.007   1.734  -2.575
  232   1HB   LYS  34          1HB       LYS  34  11.660  -0.129  -1.771
  233   2HB   LYS  34          2HB       LYS  34  13.358  -0.584  -1.843
  234   1HG   LYS  34          1HG       LYS  34  13.376   0.074   0.671
  235   2HG   LYS  34          2HG       LYS  34  11.632  -0.090   0.549
  236   1HD   LYS  34          1HD       LYS  34  13.660  -2.226  -0.102
  237   2HD   LYS  34          2HD       LYS  34  12.688  -2.144   1.364
  238   1HE   LYS  34          1HE       LYS  34  10.659  -2.431   0.036
  239   2HE   LYS  34          2HE       LYS  34  11.623  -2.463  -1.441
  240   1HZ   LYS  34          1HZ       LYS  34  11.104  -4.703  -0.735
  241   2HZ   LYS  34          2HZ       LYS  34  11.779  -4.435   0.781
  242   3HZ   LYS  34          3HZ       LYS  34  12.757  -4.428  -0.599
  243    H    LEU  35           H        LEU  35  10.580   1.593  -1.752
  244    HA   LEU  35           HA       LEU  35   9.915   4.032  -0.550
  245   1HB   LEU  35          1HB       LEU  35   7.648   3.130  -0.632
  246   2HB   LEU  35          2HB       LEU  35   8.500   2.859  -2.141
  247    HG   LEU  35           HG       LEU  35   9.020   0.576  -0.760
  248   1HD1  LEU  35          11HD      LEU  35   6.206   1.348  -0.095
  249   2HD1  LEU  35          12HD      LEU  35   7.551   1.055   1.011
  250   3HD1  LEU  35          13HD      LEU  35   6.896  -0.266   0.048
  251   1HD2  LEU  35          21HD      LEU  35   7.452  -0.490  -2.270
  252   2HD2  LEU  35          22HD      LEU  35   8.482   0.694  -3.064
  253   3HD2  LEU  35          23HD      LEU  35   6.789   1.097  -2.709
  254    H    GLY  36           H        GLY  36   9.217   4.428   1.566
  255   1HA   GLY  36          1HA       GLY  36   9.525   2.169   3.405
  256   2HA   GLY  36          2HA       GLY  36   9.941   3.833   3.823
  257    H    ILE  37           H        ILE  37   7.194   2.900   1.937
  258    HA   ILE  37           HA       ILE  37   5.577   4.228   3.910
  259    HB   ILE  37           HB       ILE  37   4.786   3.286   1.157
  260   1HG1  ILE  37          11HG      ILE  37   6.577   5.038   1.270
  261   2HG1  ILE  37          12HG      ILE  37   5.117   5.586   0.411
  262   1HG2  ILE  37          21HG      ILE  37   2.901   3.464   2.661
  263   2HG2  ILE  37          22HG      ILE  37   2.847   4.818   1.523
  264   3HG2  ILE  37          23HG      ILE  37   3.427   5.059   3.181
  265   1HD1  ILE  37          11HD      ILE  37   6.086   6.228   3.173
  266   2HD1  ILE  37          12HD      ILE  37   4.511   6.727   2.552
  267   3HD1  ILE  37          13HD      ILE  37   5.987   7.335   1.801
  268    H    PHE  38           H        PHE  38   5.095   2.961   5.451
  269    HA   PHE  38           HA       PHE  38   4.102   0.261   4.900
  270   1HB   PHE  38          1HB       PHE  38   4.805   1.617   7.502
  271   2HB   PHE  38          2HB       PHE  38   4.145  -0.001   7.388
  272    HD1  PHE  38           HD1      PHE  38   5.496  -1.845   6.670
  273    HD2  PHE  38           HD2      PHE  38   7.081   2.092   6.839
  274    HE1  PHE  38           HE1      PHE  38   7.755  -2.766   6.504
  275    HE2  PHE  38           HE2      PHE  38   9.349   1.213   6.671
  276    HZ   PHE  38           HZ       PHE  38   9.707  -1.253   6.509
  277    H    VAL  39           H        VAL  39   2.148  -0.388   6.115
  278    HA   VAL  39           HA       VAL  39   0.165   1.658   5.822
  279    HB   VAL  39           HB       VAL  39  -0.097  -1.188   6.847
  280   1HG1  VAL  39          11HG      VAL  39  -2.470  -0.935   6.257
  281   2HG1  VAL  39          12HG      VAL  39  -2.171   0.745   5.812
  282   3HG1  VAL  39          13HG      VAL  39  -1.968   0.227   7.485
  283   1HG2  VAL  39          21HG      VAL  39  -0.527  -0.121   4.050
  284   2HG2  VAL  39          22HG      VAL  39  -0.835  -1.776   4.578
  285   3HG2  VAL  39          23HG      VAL  39   0.809  -1.141   4.565
  286    H    LYS  40           H        LYS  40  -0.539   2.881   7.410
  287    HA   LYS  40           HA       LYS  40   0.618   2.558  10.025
  288   1HB   LYS  40          1HB       LYS  40  -0.843   4.671   8.638
  289   2HB   LYS  40          2HB       LYS  40  -1.180   4.588  10.361
  290   1HG   LYS  40          1HG       LYS  40   1.447   4.716   9.065
  291   2HG   LYS  40          2HG       LYS  40   0.608   6.145   9.690
  292   1HD   LYS  40          1HD       LYS  40   1.564   3.763  11.343
  293   2HD   LYS  40          2HD       LYS  40   2.320   5.352  11.316
  294   1HE   LYS  40          1HE       LYS  40   0.334   6.349  12.247
  295   2HE   LYS  40          2HE       LYS  40  -0.507   4.799  12.202
  296   1HZ   LYS  40          1HZ       LYS  40   0.276   5.227  14.388
  297   2HZ   LYS  40          2HZ       LYS  40   1.838   5.494  13.881
  298   3HZ   LYS  40          3HZ       LYS  40   1.164   3.943  13.770
  299    H    THR  41           H        THR  41  -2.534   2.958   8.627
  300    HA   THR  41           HA       THR  41  -3.720   1.152  10.607
  301    HB   THR  41           HB       THR  41  -5.171   3.608   9.930
  302    HG1  THR  41           HG1      THR  41  -4.030   4.860  11.439
  303   1HG2  THR  41          21HG      THR  41  -6.250   1.933  11.280
  304   2HG2  THR  41          22HG      THR  41  -5.991   3.381  12.257
  305   3HG2  THR  41          23HG      THR  41  -4.939   1.979  12.466
  306    H    VAL  42           H        VAL  42  -5.889   0.586   9.889
  307    HA   VAL  42           HA       VAL  42  -6.488   1.171   7.124
  308    HB   VAL  42           HB       VAL  42  -6.814  -1.530   8.541
  309   1HG1  VAL  42          11HG      VAL  42  -8.679  -1.106   7.057
  310   2HG1  VAL  42          12HG      VAL  42  -7.656  -2.381   6.386
  311   3HG1  VAL  42          13HG      VAL  42  -7.572  -0.737   5.741
  312   1HG2  VAL  42          21HG      VAL  42  -4.509  -1.137   7.819
  313   2HG2  VAL  42          22HG      VAL  42  -5.076  -0.799   6.184
  314   3HG2  VAL  42          23HG      VAL  42  -5.264  -2.415   6.866
  315    H    THR  43           H        THR  43  -8.915   1.107   6.875
  316    HA   THR  43           HA       THR  43 -10.330   2.218   9.017
  317    HB   THR  43           HB       THR  43 -10.924   2.460   6.569
  318    HG1  THR  43           HG1      THR  43 -12.861   2.877   7.174
  319   1HG2  THR  43          21HG      THR  43 -10.524   0.144   5.924
  320   2HG2  THR  43          22HG      THR  43 -12.156   0.646   5.457
  321   3HG2  THR  43          23HG      THR  43 -11.907  -0.371   6.885
  322    H    GLU  44           H        GLU  44 -12.043   1.155  10.245
  323    HA   GLU  44           HA       GLU  44 -11.062  -1.085  11.548
  324   1HB   GLU  44          1HB       GLU  44 -12.504   0.577  12.578
  325   2HB   GLU  44          2HB       GLU  44 -13.853   0.018  11.609
  326   1HG   GLU  44          1HG       GLU  44 -14.000  -2.000  12.789
  327   2HG   GLU  44          2HG       GLU  44 -12.420  -1.763  13.545
  328    H    GLY  45           H        GLY  45 -13.336  -0.967   8.946
  329   1HA   GLY  45          1HA       GLY  45 -12.864  -3.824   8.654
  330   2HA   GLY  45          2HA       GLY  45 -14.531  -3.302   8.788
  331    H    GLY  46           H        GLY  46 -14.785  -1.213   7.410
  332   1HA   GLY  46          1HA       GLY  46 -15.716  -0.829   5.367
  333   2HA   GLY  46          2HA       GLY  46 -14.019  -0.834   4.890
  334    H    ALA  47           H        ALA  47 -13.418  -2.190   3.739
  335    HA   ALA  47           HA       ALA  47 -14.631  -4.837   3.469
  336   1HB   ALA  47          1HB       ALA  47 -14.575  -4.789   1.058
  337   2HB   ALA  47          2HB       ALA  47 -13.855  -3.198   1.075
  338   3HB   ALA  47          3HB       ALA  47 -15.531  -3.409   1.622
  339    H    ALA  48           H        ALA  48 -12.100  -3.235   4.367
  340    HA   ALA  48           HA       ALA  48 -10.003  -4.598   2.795
  341   1HB   ALA  48          1HB       ALA  48  -9.763  -2.375   4.825
  342   2HB   ALA  48          2HB       ALA  48  -9.741  -2.178   3.070
  343   3HB   ALA  48          3HB       ALA  48  -8.444  -3.055   3.875
  344    H    GLN  49           H        GLN  49 -10.763  -3.860   6.261
  345    HA   GLN  49           HA       GLN  49  -9.137  -6.089   6.940
  346   1HB   GLN  49          1HB       GLN  49 -10.777  -4.164   8.518
  347   2HB   GLN  49          2HB       GLN  49 -10.059  -5.576   9.313
  348   1HG   GLN  49          1HG       GLN  49  -7.842  -4.778   8.407
  349   2HG   GLN  49          2HG       GLN  49  -8.684  -3.317   7.892
  350   1HE2  GLN  49          21HE      GLN  49 -10.365  -3.143  10.186
  351   2HE2  GLN  49          22HE      GLN  49  -9.384  -2.737  11.529
  352    H    ARG  50           H        ARG  50 -12.327  -5.558   6.074
  353    HA   ARG  50           HA       ARG  50 -13.302  -8.023   7.143
  354   1HB   ARG  50          1HB       ARG  50 -14.448  -6.104   5.123
  355   2HB   ARG  50          2HB       ARG  50 -15.234  -7.634   5.495
  356   1HG   ARG  50          1HG       ARG  50 -14.566  -5.538   7.529
  357   2HG   ARG  50          2HG       ARG  50 -16.154  -5.691   6.753
  358   1HD   ARG  50          1HD       ARG  50 -16.387  -7.929   7.682
  359   2HD   ARG  50          2HD       ARG  50 -14.780  -7.843   8.390
  360    HE   ARG  50           HE       ARG  50 -16.509  -5.745   9.255
  361   1HH1  ARG  50          11HH      ARG  50 -15.651  -9.132   9.821
  362   2HH1  ARG  50          12HH      ARG  50 -16.083  -9.139  11.456
  363   1HH2  ARG  50          21HH      ARG  50 -17.114  -5.732  11.527
  364   2HH2  ARG  50          22HH      ARG  50 -16.936  -7.149  12.452
  365    H    ASP  51           H        ASP  51 -11.626  -6.976   4.288
  366    HA   ASP  51           HA       ASP  51 -11.945  -9.400   2.817
  367   1HB   ASP  51          1HB       ASP  51 -11.165  -7.420   1.648
  368   2HB   ASP  51          2HB       ASP  51  -9.779  -7.274   2.724
  369    H    GLY  52           H        GLY  52  -9.139  -8.115   4.558
  370   1HA   GLY  52          1HA       GLY  52  -7.995  -9.168   6.290
  371   2HA   GLY  52          2HA       GLY  52  -8.900 -10.629   5.968
  372    H    ARG  53           H        ARG  53  -7.663  -9.683   2.990
  373    HA   ARG  53           HA       ARG  53  -5.479 -11.574   3.300
  374   1HB   ARG  53          1HB       ARG  53  -7.073 -11.260   1.232
  375   2HB   ARG  53          2HB       ARG  53  -6.061  -9.885   0.856
  376   1HG   ARG  53          1HG       ARG  53  -5.135 -12.755   1.026
  377   2HG   ARG  53          2HG       ARG  53  -5.498 -11.886  -0.456
  378   1HD   ARG  53          1HD       ARG  53  -3.678 -10.300   0.075
  379   2HD   ARG  53          2HD       ARG  53  -3.310 -11.233   1.521
  380    HE   ARG  53           HE       ARG  53  -3.223 -12.469  -1.130
  381   1HH1  ARG  53          11HH      ARG  53  -1.610 -11.744   1.929
  382   2HH1  ARG  53          12HH      ARG  53  -0.116 -12.417   1.515
  383   1HH2  ARG  53          21HH      ARG  53  -1.156 -13.426  -1.763
  384   2HH2  ARG  53          22HH      ARG  53   0.147 -13.412  -0.704
  385    H    ILE  54           H        ILE  54  -6.129  -8.209   2.903
  386    HA   ILE  54           HA       ILE  54  -3.326  -7.450   2.924
  387    HB   ILE  54           HB       ILE  54  -5.093  -6.231   1.536
  388   1HG1  ILE  54          11HG      ILE  54  -3.690  -4.481   3.574
  389   2HG1  ILE  54          12HG      ILE  54  -2.890  -5.209   2.187
  390   1HG2  ILE  54          21HG      ILE  54  -5.979  -5.326   4.269
  391   2HG2  ILE  54          22HG      ILE  54  -6.939  -6.240   3.110
  392   3HG2  ILE  54          23HG      ILE  54  -6.506  -4.559   2.767
  393   1HD1  ILE  54          11HD      ILE  54  -4.319  -3.966   0.689
  394   2HD1  ILE  54          12HD      ILE  54  -3.461  -2.880   1.771
  395   3HD1  ILE  54          13HD      ILE  54  -5.179  -3.266   2.058
  396    H    GLN  55           H        GLN  55  -2.356  -6.344   4.757
  397    HA   GLN  55           HA       GLN  55  -4.081  -6.309   7.067
  398   1HB   GLN  55          1HB       GLN  55  -1.245  -7.341   6.955
  399   2HB   GLN  55          2HB       GLN  55  -2.076  -7.001   8.457
  400   1HG   GLN  55          1HG       GLN  55  -2.911  -9.031   6.389
  401   2HG   GLN  55          2HG       GLN  55  -2.099  -9.389   7.906
  402   1HE2  GLN  55          21HE      GLN  55  -3.706  -7.411   9.389
  403   2HE2  GLN  55          22HE      GLN  55  -5.269  -8.097   9.559
  404    H    VAL  56           H        VAL  56  -2.686  -5.138   8.937
  405    HA   VAL  56           HA       VAL  56  -2.341  -2.377   7.961
  406    HB   VAL  56           HB       VAL  56  -2.185  -3.330  10.806
  407   1HG1  VAL  56          11HG      VAL  56  -1.643  -1.025  10.437
  408   2HG1  VAL  56          12HG      VAL  56  -3.151  -1.159  11.343
  409   3HG1  VAL  56          13HG      VAL  56  -3.187  -0.754   9.630
  410   1HG2  VAL  56          21HG      VAL  56  -4.747  -2.863   9.295
  411   2HG2  VAL  56          22HG      VAL  56  -4.610  -3.065  11.043
  412   3HG2  VAL  56          23HG      VAL  56  -4.157  -4.388   9.964
  413    H    ASN  57           H        ASN  57  -0.464  -5.028   8.608
  414    HA   ASN  57           HA       ASN  57   1.780  -3.386   9.534
  415   1HB   ASN  57          1HB       ASN  57   2.839  -5.468  10.266
  416   2HB   ASN  57          2HB       ASN  57   1.246  -5.274  10.989
  417   1HD2  ASN  57          21HD      ASN  57  -0.442  -6.699  10.362
  418   2HD2  ASN  57          22HD      ASN  57  -0.069  -8.161   9.537
  419    H    ASP  58           H        ASP  58   0.556  -4.178   6.775
  420    HA   ASP  58           HA       ASP  58   2.886  -5.251   5.438
  421   1HB   ASP  58          1HB       ASP  58   0.165  -4.435   4.438
  422   2HB   ASP  58          2HB       ASP  58   1.495  -4.755   3.336
  423    H    GLN  59           H        GLN  59   3.161  -4.063   3.169
  424    HA   GLN  59           HA       GLN  59   3.709  -1.261   3.725
  425   1HB   GLN  59          1HB       GLN  59   5.708  -2.695   4.140
  426   2HB   GLN  59          2HB       GLN  59   5.599  -3.246   2.474
  427   1HG   GLN  59          1HG       GLN  59   5.971  -0.989   1.699
  428   2HG   GLN  59          2HG       GLN  59   6.042  -0.415   3.357
  429   1HE2  GLN  59          21HE      GLN  59   8.076   0.356   3.150
  430   2HE2  GLN  59          22HE      GLN  59   9.471  -0.650   3.005
  431    H    ILE  60           H        ILE  60   3.129   0.012   2.025
  432    HA   ILE  60           HA       ILE  60   1.689  -1.201  -0.171
  433    HB   ILE  60           HB       ILE  60   2.376   1.715   0.297
  434   1HG1  ILE  60          11HG      ILE  60   1.016   0.873   2.167
  435   2HG1  ILE  60          12HG      ILE  60   0.082   1.961   1.143
  436   1HG2  ILE  60          21HG      ILE  60   0.234   0.511  -1.404
  437   2HG2  ILE  60          22HG      ILE  60   1.787   1.029  -2.012
  438   3HG2  ILE  60          23HG      ILE  60   0.668   2.227  -1.322
  439   1HD1  ILE  60          11HD      ILE  60  -0.075  -1.042   1.149
  440   2HD1  ILE  60          12HD      ILE  60  -1.006   0.031   0.103
  441   3HD1  ILE  60          13HD      ILE  60  -1.257   0.064   1.849
  442    H    VAL  61           H        VAL  61   2.872  -1.990  -1.883
  443    HA   VAL  61           HA       VAL  61   5.443  -0.746  -2.457
  444    HB   VAL  61           HB       VAL  61   4.219  -3.305  -3.529
  445   1HG1  VAL  61          11HG      VAL  61   6.389  -3.847  -4.421
  446   2HG1  VAL  61          12HG      VAL  61   7.021  -2.272  -3.920
  447   3HG1  VAL  61          13HG      VAL  61   5.754  -2.374  -5.156
  448   1HG2  VAL  61          21HG      VAL  61   5.874  -4.441  -2.136
  449   2HG2  VAL  61          22HG      VAL  61   4.763  -3.466  -1.184
  450   3HG2  VAL  61          23HG      VAL  61   6.404  -2.883  -1.495
  451    H    GLU  62           H        GLU  62   2.464  -1.571  -4.145
  452    HA   GLU  62           HA       GLU  62   2.785   0.710  -5.884
  453   1HB   GLU  62          1HB       GLU  62   4.132  -0.904  -7.069
  454   2HB   GLU  62          2HB       GLU  62   2.880  -2.113  -7.016
  455   1HG   GLU  62          1HG       GLU  62   1.479  -0.652  -8.445
  456   2HG   GLU  62          2HG       GLU  62   2.829   0.479  -8.525
  457    H    VAL  63           H        VAL  63   0.856   1.532  -5.341
  458    HA   VAL  63           HA       VAL  63  -1.480  -0.173  -5.506
  459    HB   VAL  63           HB       VAL  63  -0.989   2.530  -4.245
  460   1HG1  VAL  63          11HG      VAL  63  -3.707   1.422  -4.980
  461   2HG1  VAL  63          12HG      VAL  63  -2.944   2.867  -5.656
  462   3HG1  VAL  63          13HG      VAL  63  -3.393   2.827  -3.945
  463   1HG2  VAL  63          21HG      VAL  63  -2.458   0.067  -3.397
  464   2HG2  VAL  63          22HG      VAL  63  -2.010   1.448  -2.389
  465   3HG2  VAL  63          23HG      VAL  63  -0.762   0.390  -3.076
  466    H    ASP  64           H        ASP  64  -2.741  -0.260  -7.125
  467    HA   ASP  64           HA       ASP  64  -3.977   0.238  -8.969
  468   1HB   ASP  64          1HB       ASP  64  -4.605   2.258  -7.640
  469   2HB   ASP  64          2HB       ASP  64  -3.252   3.124  -8.341
  470    H    GLY  65           H        GLY  65  -0.927   0.120  -8.941
  471   1HA   GLY  65          1HA       GLY  65   0.615  -0.228 -10.644
  472   2HA   GLY  65          2HA       GLY  65  -0.590   0.357 -11.789
  473    H    ILE  66           H        ILE  66  -0.094   2.429  -9.128
  474    HA   ILE  66           HA       ILE  66   0.944   4.476 -10.844
  475    HB   ILE  66           HB       ILE  66  -0.687   4.640  -8.707
  476   1HG1  ILE  66          11HG      ILE  66   1.433   6.723  -9.272
  477   2HG1  ILE  66          12HG      ILE  66   0.004   6.456 -10.271
  478   1HG2  ILE  66          21HG      ILE  66   0.500   5.454  -6.733
  479   2HG2  ILE  66          22HG      ILE  66   2.036   5.043  -7.502
  480   3HG2  ILE  66          23HG      ILE  66   0.888   3.767  -7.101
  481   1HD1  ILE  66          11HD      ILE  66  -1.409   7.028  -8.376
  482   2HD1  ILE  66          12HD      ILE  66  -0.301   8.344  -8.791
  483   3HD1  ILE  66          13HD      ILE  66   0.039   7.297  -7.405
  484    H    SER  67           H        SER  67   2.287   2.130  -8.902
  485    HA   SER  67           HA       SER  67   4.240   1.752  -7.850
  486   1HB   SER  67          1HB       SER  67   6.263   1.962  -9.431
  487   2HB   SER  67          2HB       SER  67   4.919   0.941  -9.943
  488    HG   SER  67           HG       SER  67   5.015   3.659 -10.705
  489    H    LEU  68           H        LEU  68   3.979   3.077  -6.206
  490    HA   LEU  68           HA       LEU  68   5.287   5.608  -6.255
  491   1HB   LEU  68          1HB       LEU  68   4.157   5.989  -4.123
  492   2HB   LEU  68          2HB       LEU  68   3.064   5.454  -5.364
  493    HG   LEU  68           HG       LEU  68   2.265   4.528  -3.465
  494   1HD1  LEU  68          11HD      LEU  68   2.276   2.221  -3.534
  495   2HD1  LEU  68          12HD      LEU  68   3.709   2.208  -4.525
  496   3HD1  LEU  68          13HD      LEU  68   2.199   2.925  -5.149
  497   1HD2  LEU  68          21HD      LEU  68   3.500   3.240  -1.753
  498   2HD2  LEU  68          22HD      LEU  68   4.024   4.921  -1.883
  499   3HD2  LEU  68          23HD      LEU  68   4.999   3.639  -2.595
  500    H    VAL  69           H        VAL  69   6.896   3.367  -6.530
  501    HA   VAL  69           HA       VAL  69   8.144   2.599  -4.110
  502    HB   VAL  69           HB       VAL  69   9.234   2.399  -6.932
  503   1HG1  VAL  69          11HG      VAL  69  10.606   0.568  -6.075
  504   2HG1  VAL  69          12HG      VAL  69   9.980   0.855  -4.452
  505   3HG1  VAL  69          13HG      VAL  69  10.958   2.086  -5.249
  506   1HG2  VAL  69          21HG      VAL  69   7.593   0.402  -5.368
  507   2HG2  VAL  69          22HG      VAL  69   8.356   0.094  -6.927
  508   3HG2  VAL  69          23HG      VAL  69   7.074   1.297  -6.797
  509    H    GLY  70           H        GLY  70   8.803   4.402  -3.011
  510   1HA   GLY  70          1HA       GLY  70  10.910   5.440  -2.421
  511   2HA   GLY  70          2HA       GLY  70  11.191   5.703  -4.138
  512    H    VAL  71           H        VAL  71   8.013   6.308  -3.019
  513    HA   VAL  71           HA       VAL  71   8.478   9.164  -3.370
  514    HB   VAL  71           HB       VAL  71   6.056   9.433  -3.378
  515   1HG1  VAL  71          11HG      VAL  71   5.467   8.109  -5.326
  516   2HG1  VAL  71          12HG      VAL  71   6.878   7.086  -5.059
  517   3HG1  VAL  71          13HG      VAL  71   7.091   8.789  -5.470
  518   1HG2  VAL  71          21HG      VAL  71   5.877   6.472  -2.781
  519   2HG2  VAL  71          22HG      VAL  71   4.522   7.588  -3.030
  520   3HG2  VAL  71          23HG      VAL  71   5.566   7.770  -1.634
  521    H    THR  72           H        THR  72   6.913  10.471  -1.802
  522    HA   THR  72           HA       THR  72   7.794   9.795   0.870
  523    HB   THR  72           HB       THR  72   6.814  12.082   1.343
  524    HG1  THR  72           HG1      THR  72   7.110  12.538  -1.444
  525   1HG2  THR  72          21HG      THR  72   8.802  13.236   0.416
  526   2HG2  THR  72          22HG      THR  72   9.124  11.834  -0.608
  527   3HG2  THR  72          23HG      THR  72   9.216  11.687   1.147
  528    H    GLN  73           H        GLN  73   6.272  10.356   2.531
  529    HA   GLN  73           HA       GLN  73   4.025   8.768   2.461
  530   1HB   GLN  73          1HB       GLN  73   3.542   9.554   4.677
  531   2HB   GLN  73          2HB       GLN  73   5.270   9.502   4.469
  532   1HG   GLN  73          1HG       GLN  73   3.507  11.839   4.412
  533   2HG   GLN  73          2HG       GLN  73   4.587  11.423   5.750
  534   1HE2  GLN  73          21HE      GLN  73   6.947  11.249   5.080
  535   2HE2  GLN  73          22HE      GLN  73   7.517  12.396   3.963
  536    H    ASN  74           H        ASN  74   4.330  12.180   1.713
  537    HA   ASN  74           HA       ASN  74   1.555  12.612   1.743
  538   1HB   ASN  74          1HB       ASN  74   1.993  14.771   0.587
  539   2HB   ASN  74          2HB       ASN  74   3.007  14.541   2.005
  540   1HD2  ASN  74          21HD      ASN  74   5.175  14.402   1.728
  541   2HD2  ASN  74          22HD      ASN  74   5.970  14.685   0.228
  542    H    PHE  75           H        PHE  75   3.792  11.681  -0.801
  543    HA   PHE  75           HA       PHE  75   1.923  11.874  -2.912
  544   1HB   PHE  75          1HB       PHE  75   4.396  11.608  -3.257
  545   2HB   PHE  75          2HB       PHE  75   4.237   9.953  -2.689
  546    HD1  PHE  75           HD1      PHE  75   3.016   8.262  -4.076
  547    HD2  PHE  75           HD2      PHE  75   3.745  12.206  -5.500
  548    HE1  PHE  75           HE1      PHE  75   2.545   7.516  -6.349
  549    HE2  PHE  75           HE2      PHE  75   3.265  11.456  -7.787
  550    HZ   PHE  75           HZ       PHE  75   2.672   9.112  -8.218
  551    H    ALA  76           H        ALA  76   3.006   9.221  -0.842
  552    HA   ALA  76           HA       ALA  76   1.319   7.265  -1.883
  553   1HB   ALA  76          1HB       ALA  76   3.245   6.783  -0.473
  554   2HB   ALA  76          2HB       ALA  76   1.779   6.002   0.124
  555   3HB   ALA  76          3HB       ALA  76   2.396   7.452   0.924
  556    H    ALA  77           H        ALA  77   0.794   9.466   0.884
  557    HA   ALA  77           HA       ALA  77  -1.731   8.458   1.631
  558   1HB   ALA  77          1HB       ALA  77  -1.997  10.512   2.905
  559   2HB   ALA  77          2HB       ALA  77  -0.680  11.259   2.003
  560   3HB   ALA  77          3HB       ALA  77  -0.352   9.899   3.081
  561    H    THR  78           H        THR  78  -0.793  10.351  -0.997
  562    HA   THR  78           HA       THR  78  -3.450  11.349  -1.546
  563    HB   THR  78           HB       THR  78  -0.853  11.445  -3.081
  564    HG1  THR  78           HG1      THR  78  -0.798  12.771  -1.309
  565   1HG2  THR  78          21HG      THR  78  -3.494  12.793  -3.717
  566   2HG2  THR  78          22HG      THR  78  -2.757  11.469  -4.614
  567   3HG2  THR  78          23HG      THR  78  -1.974  13.056  -4.587
  568    H    VAL  79           H        VAL  79  -1.216   8.926  -2.842
  569    HA   VAL  79           HA       VAL  79  -2.845   7.943  -4.888
  570    HB   VAL  79           HB       VAL  79  -0.953   6.280  -3.190
  571   1HG1  VAL  79          11HG      VAL  79  -0.781   4.836  -5.131
  572   2HG1  VAL  79          12HG      VAL  79  -1.909   5.862  -6.012
  573   3HG1  VAL  79          13HG      VAL  79  -2.457   4.966  -4.596
  574   1HG2  VAL  79          21HG      VAL  79  -0.448   7.950  -5.626
  575   2HG2  VAL  79          22HG      VAL  79   0.692   6.772  -4.969
  576   3HG2  VAL  79          23HG      VAL  79   0.226   8.182  -4.015
  577    H    LEU  80           H        LEU  80  -2.509   6.795  -1.562
  578    HA   LEU  80           HA       LEU  80  -4.614   4.895  -1.710
  579   1HB   LEU  80          1HB       LEU  80  -3.161   6.143   0.621
  580   2HB   LEU  80          2HB       LEU  80  -4.453   4.993   0.846
  581    HG   LEU  80           HG       LEU  80  -2.400   3.827   1.135
  582   1HD1  LEU  80          11HD      LEU  80  -3.359   3.132  -1.608
  583   2HD1  LEU  80          12HD      LEU  80  -4.114   2.658  -0.097
  584   3HD1  LEU  80          13HD      LEU  80  -2.487   2.089  -0.478
  585   1HD2  LEU  80          21HD      LEU  80  -0.625   3.688  -0.524
  586   2HD2  LEU  80          22HD      LEU  80  -0.872   5.359  -0.003
  587   3HD2  LEU  80          23HD      LEU  80  -1.499   4.815  -1.561
  588    H    ARG  81           H        ARG  81  -4.860   8.084  -1.894
  589    HA   ARG  81           HA       ARG  81  -7.490   8.211  -0.586
  590   1HB   ARG  81          1HB       ARG  81  -5.832   9.778   0.345
  591   2HB   ARG  81          2HB       ARG  81  -5.528  10.424  -1.245
  592   1HG   ARG  81          1HG       ARG  81  -8.304  10.615  -0.294
  593   2HG   ARG  81          2HG       ARG  81  -7.109  11.560   0.587
  594   1HD   ARG  81          1HD       ARG  81  -6.387  12.628  -1.472
  595   2HD   ARG  81          2HD       ARG  81  -7.513  11.644  -2.400
  596    HE   ARG  81           HE       ARG  81  -9.317  12.724  -1.195
  597   1HH1  ARG  81          11HH      ARG  81  -6.183  14.439  -1.152
  598   2HH1  ARG  81          12HH      ARG  81  -6.881  15.983  -0.984
  599   1HH2  ARG  81          21HH      ARG  81 -10.240  14.886  -0.966
  600   2HH2  ARG  81          22HH      ARG  81  -9.209  16.243  -0.889
  601    H    ASN  82           H        ASN  82  -5.802   8.248  -3.528
  602    HA   ASN  82           HA       ASN  82  -7.973   9.422  -5.104
  603   1HB   ASN  82          1HB       ASN  82  -5.201   8.463  -5.812
  604   2HB   ASN  82          2HB       ASN  82  -6.397   8.744  -7.059
  605   1HD2  ASN  82          21HD      ASN  82  -6.059  10.678  -4.167
  606   2HD2  ASN  82          22HD      ASN  82  -5.534  12.126  -4.940
  607    H    THR  83           H        THR  83  -7.211   6.520  -3.798
  608    HA   THR  83           HA       THR  83  -7.667   4.682  -5.812
  609    HB   THR  83           HB       THR  83  -8.190   3.260  -3.707
  610    HG1  THR  83           HG1      THR  83  -8.525   4.759  -2.169
  611   1HG2  THR  83          21HG      THR  83  -5.527   4.643  -4.086
  612   2HG2  THR  83          22HG      THR  83  -6.075   3.236  -4.990
  613   3HG2  THR  83          23HG      THR  83  -5.779   3.109  -3.256
  614    H    LYS  84           H        LYS  84  -9.376   3.145  -5.826
  615    HA   LYS  84           HA       LYS  84 -12.038   4.367  -5.574
  616   1HB   LYS  84          1HB       LYS  84 -10.951   2.304  -7.508
  617   2HB   LYS  84          2HB       LYS  84 -12.615   2.865  -7.433
  618   1HG   LYS  84          1HG       LYS  84 -10.298   4.666  -7.943
  619   2HG   LYS  84          2HG       LYS  84 -11.236   3.887  -9.227
  620   1HD   LYS  84          1HD       LYS  84 -13.224   4.928  -8.459
  621   2HD   LYS  84          2HD       LYS  84 -12.418   5.587  -7.062
  622   1HE   LYS  84          1HE       LYS  84 -11.727   6.282  -9.929
  623   2HE   LYS  84          2HE       LYS  84 -12.685   7.303  -8.857
  624   1HZ   LYS  84          1HZ       LYS  84 -10.748   7.476  -7.393
  625   2HZ   LYS  84          2HZ       LYS  84 -10.390   8.045  -8.936
  626   3HZ   LYS  84          3HZ       LYS  84  -9.819   6.554  -8.456
  627    H    GLY  85           H        GLY  85 -13.484   2.186  -5.987
  628   1HA   GLY  85          1HA       GLY  85 -13.364   0.616  -3.655
  629   2HA   GLY  85          2HA       GLY  85 -14.322   0.260  -5.095
  630    H    ASN  86           H        ASN  86 -12.824  -0.307  -7.029
  631    HA   ASN  86           HA       ASN  86 -11.371  -2.646  -6.225
  632   1HB   ASN  86          1HB       ASN  86 -11.939  -1.444  -8.932
  633   2HB   ASN  86          2HB       ASN  86 -10.836  -2.799  -8.738
  634   1HD2  ASN  86          21HD      ASN  86 -11.641  -4.790  -8.169
  635   2HD2  ASN  86          22HD      ASN  86 -13.307  -5.193  -8.257
  636    H    VAL  87           H        VAL  87  -9.512  -2.446  -5.355
  637    HA   VAL  87           HA       VAL  87  -7.567  -0.517  -6.488
  638    HB   VAL  87           HB       VAL  87  -7.330  -1.595  -3.750
  639   1HG1  VAL  87          11HG      VAL  87  -6.148   0.499  -3.340
  640   2HG1  VAL  87          12HG      VAL  87  -6.426   0.955  -5.025
  641   3HG1  VAL  87          13HG      VAL  87  -5.464  -0.479  -4.639
  642   1HG2  VAL  87          21HG      VAL  87  -8.525   0.307  -2.807
  643   2HG2  VAL  87          22HG      VAL  87  -9.542  -0.774  -3.761
  644   3HG2  VAL  87          23HG      VAL  87  -9.040   0.784  -4.439
  645    H    ARG  88           H        ARG  88  -5.773  -1.429  -7.189
  646    HA   ARG  88           HA       ARG  88  -5.194  -4.171  -6.317
  647   1HB   ARG  88          1HB       ARG  88  -4.202  -2.606  -8.701
  648   2HB   ARG  88          2HB       ARG  88  -3.629  -4.211  -8.256
  649   1HG   ARG  88          1HG       ARG  88  -5.780  -5.155  -8.581
  650   2HG   ARG  88          2HG       ARG  88  -6.507  -3.567  -8.839
  651   1HD   ARG  88          1HD       ARG  88  -5.137  -3.307 -10.849
  652   2HD   ARG  88          2HD       ARG  88  -4.454  -4.916 -10.570
  653    HE   ARG  88           HE       ARG  88  -6.912  -5.623 -10.676
  654   1HH1  ARG  88          11HH      ARG  88  -5.454  -3.095 -12.723
  655   2HH1  ARG  88          12HH      ARG  88  -6.564  -3.294 -13.990
  656   1HH2  ARG  88          21HH      ARG  88  -8.399  -5.904 -12.416
  657   2HH2  ARG  88          22HH      ARG  88  -8.316  -4.955 -13.820
  658    H    PHE  89           H        PHE  89  -4.324  -3.945  -4.442
  659    HA   PHE  89           HA       PHE  89  -2.146  -2.077  -4.016
  660   1HB   PHE  89          1HB       PHE  89  -3.245  -4.246  -2.202
  661   2HB   PHE  89          2HB       PHE  89  -2.048  -3.044  -1.775
  662    HD1  PHE  89           HD1      PHE  89  -2.696  -0.792  -1.281
  663    HD2  PHE  89           HD2      PHE  89  -5.587  -3.696  -2.366
  664    HE1  PHE  89           HE1      PHE  89  -4.464   0.667  -0.425
  665    HE2  PHE  89           HE2      PHE  89  -7.374  -2.229  -1.522
  666    HZ   PHE  89           HZ       PHE  89  -6.806  -0.042  -0.540
  667    H    VAL  90           H        VAL  90  -0.348  -2.782  -5.112
  668    HA   VAL  90           HA       VAL  90   0.203  -5.613  -4.988
  669    HB   VAL  90           HB       VAL  90   1.742  -3.413  -6.387
  670   1HG1  VAL  90          11HG      VAL  90   2.007  -6.419  -6.615
  671   2HG1  VAL  90          12HG      VAL  90   3.165  -5.327  -5.860
  672   3HG1  VAL  90          13HG      VAL  90   2.884  -5.245  -7.599
  673   1HG2  VAL  90          21HG      VAL  90  -0.460  -3.699  -7.388
  674   2HG2  VAL  90          22HG      VAL  90  -0.172  -5.433  -7.565
  675   3HG2  VAL  90          23HG      VAL  90   0.795  -4.278  -8.481
  676    H    ILE  91           H        ILE  91   0.620  -5.802  -2.937
  677    HA   ILE  91           HA       ILE  91   2.794  -4.332  -1.695
  678    HB   ILE  91           HB       ILE  91   0.472  -5.988  -0.723
  679   1HG1  ILE  91          11HG      ILE  91   1.242  -3.141  -0.149
  680   2HG1  ILE  91          12HG      ILE  91   0.092  -3.607  -1.388
  681   1HG2  ILE  91          21HG      ILE  91   2.640  -4.870   1.054
  682   2HG2  ILE  91          22HG      ILE  91   2.381  -6.575   0.692
  683   3HG2  ILE  91          23HG      ILE  91   1.153  -5.673   1.576
  684   1HD1  ILE  91          11HD      ILE  91  -0.186  -4.073   1.535
  685   2HD1  ILE  91          12HD      ILE  91  -1.316  -4.534   0.225
  686   3HD1  ILE  91          13HD      ILE  91  -0.946  -2.818   0.531
  687    H    GLY  92           H        GLY  92   4.343  -5.665  -0.522
  688   1HA   GLY  92          1HA       GLY  92   4.452  -8.364  -1.587
  689   2HA   GLY  92          2HA       GLY  92   5.883  -7.373  -1.680
  690    H    ARG  93           H        ARG  93   6.055  -9.655  -0.389
  691    HA   ARG  93           HA       ARG  93   6.473  -8.839   2.432
  692   1HB   ARG  93          1HB       ARG  93   4.350 -10.119   2.130
  693   2HB   ARG  93          2HB       ARG  93   5.359 -11.467   1.604
  694   1HG   ARG  93          1HG       ARG  93   6.669 -11.065   3.745
  695   2HG   ARG  93          2HG       ARG  93   5.263 -10.135   4.264
  696   1HD   ARG  93          1HD       ARG  93   5.116 -12.279   5.029
  697   2HD   ARG  93          2HD       ARG  93   3.876 -12.052   3.767
  698    HE   ARG  93           HE       ARG  93   6.386 -13.162   2.847
  699   1HH1  ARG  93          11HH      ARG  93   3.204 -14.056   4.129
  700   2HH1  ARG  93          12HH      ARG  93   3.205 -15.598   3.391
  701   1HH2  ARG  93          21HH      ARG  93   6.328 -15.246   1.791
  702   2HH2  ARG  93          22HH      ARG  93   4.990 -16.282   2.049
  703    H    GLU  94           H        GLU  94   8.397  -9.570   3.184
  704    HA   GLU  94           HA       GLU  94   9.872 -11.459   1.534
  705   1HB   GLU  94          1HB       GLU  94  10.688  -9.987   4.072
  706   2HB   GLU  94          2HB       GLU  94  11.735 -11.008   3.106
  707   1HG   GLU  94          1HG       GLU  94  11.571  -9.427   1.266
  708   2HG   GLU  94          2HG       GLU  94  10.506  -8.402   2.229
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1  17.016  -7.321   0.365
    2   2H    GLY   1          2H        GLY   1  15.538  -7.329  -0.470
    3   3H    GLY   1          3H        GLY   1  16.822  -8.229  -1.058
    4   1HA   GLY   1          1HA       GLY   1  16.737  -9.677   0.841
    5   2HA   GLY   1          2HA       GLY   1  15.415  -8.711   1.493
    6    H    HIS   2           H        HIS   2  14.304 -10.823   1.419
    7    HA   HIS   2           HA       HIS   2  13.413 -11.491  -1.296
    8   1HB   HIS   2          1HB       HIS   2  13.286 -13.123   1.248
    9   2HB   HIS   2          2HB       HIS   2  12.488 -13.596  -0.245
   10    HD1  HIS   2           HD1      HIS   2  13.929 -14.775  -1.991
   11    HD2  HIS   2           HD2      HIS   2  16.141 -13.160   1.132
   12    HE1  HIS   2           HE1      HIS   2  16.258 -15.659  -2.267
   13    H    MET   3           H        MET   3  11.738 -10.291  -1.820
   14    HA   MET   3           HA       MET   3   9.496 -10.105   0.089
   15   1HB   MET   3          1HB       MET   3  10.636  -7.919  -0.398
   16   2HB   MET   3          2HB       MET   3  10.253  -8.146  -2.097
   17   1HG   MET   3          1HG       MET   3   8.634  -6.647  -1.223
   18   2HG   MET   3          2HG       MET   3   7.833  -8.198  -1.457
   19   1HE   MET   3          1HE       MET   3  10.239  -7.004   1.493
   20   2HE   MET   3          2HE       MET   3   9.024  -6.473   2.654
   21   3HE   MET   3          3HE       MET   3   9.216  -5.614   1.126
   22    H    GLU   4           H        GLU   4   7.574 -10.894  -0.678
   23    HA   GLU   4           HA       GLU   4   7.501 -11.748  -3.483
   24   1HB   GLU   4          1HB       GLU   4   7.124 -13.498  -1.760
   25   2HB   GLU   4          2HB       GLU   4   5.805 -12.521  -1.124
   26   1HG   GLU   4          1HG       GLU   4   4.562 -12.806  -3.187
   27   2HG   GLU   4          2HG       GLU   4   5.894 -13.732  -3.869
   28    H    LEU   5           H        LEU   5   6.545 -10.268  -4.757
   29    HA   LEU   5           HA       LEU   5   4.579  -8.484  -3.621
   30   1HB   LEU   5          1HB       LEU   5   5.749  -8.584  -6.406
   31   2HB   LEU   5          2HB       LEU   5   4.688  -7.339  -5.787
   32    HG   LEU   5           HG       LEU   5   6.773  -6.380  -5.769
   33   1HD1  LEU   5          11HD      LEU   5   5.557  -6.073  -3.701
   34   2HD1  LEU   5          12HD      LEU   5   7.310  -5.937  -3.499
   35   3HD1  LEU   5          13HD      LEU   5   6.479  -7.418  -3.009
   36   1HD2  LEU   5          21HD      LEU   5   7.914  -8.861  -4.503
   37   2HD2  LEU   5          22HD      LEU   5   8.802  -7.364  -4.780
   38   3HD2  LEU   5          23HD      LEU   5   8.190  -8.293  -6.153
   39    H    PHE   6           H        PHE   6   2.441  -8.536  -4.076
   40    HA   PHE   6           HA       PHE   6   1.496 -10.294  -6.143
   41   1HB   PHE   6          1HB       PHE   6  -0.202 -11.140  -4.434
   42   2HB   PHE   6          2HB       PHE   6   1.386 -11.909  -4.442
   43    HD1  PHE   6           HD1      PHE   6   2.830 -11.501  -2.486
   44    HD2  PHE   6           HD2      PHE   6  -1.024  -9.797  -2.800
   45    HE1  PHE   6           HE1      PHE   6   2.907 -10.962  -0.106
   46    HE2  PHE   6           HE2      PHE   6  -0.982  -9.229  -0.379
   47    HZ   PHE   6           HZ       PHE   6   0.998  -9.819   0.967
   48    HA   PRO   7           HA       PRO   7  -1.525  -7.029  -6.475
   49   1HB   PRO   7          1HB       PRO   7  -3.076  -8.133  -8.263
   50   2HB   PRO   7          2HB       PRO   7  -1.451  -7.590  -8.676
   51   1HG   PRO   7          1HG       PRO   7  -2.393 -10.390  -8.083
   52   2HG   PRO   7          2HG       PRO   7  -1.283  -9.845  -9.372
   53   1HD   PRO   7          1HD       PRO   7  -0.537 -10.943  -6.948
   54   2HD   PRO   7          2HD       PRO   7   0.487  -9.852  -7.916
   55    H    VAL   8           H        VAL   8  -3.041  -6.636  -5.072
   56    HA   VAL   8           HA       VAL   8  -5.080  -8.669  -4.582
   57    HB   VAL   8           HB       VAL   8  -4.370  -6.374  -2.759
   58   1HG1  VAL   8          11HG      VAL   8  -5.630  -7.595  -1.062
   59   2HG1  VAL   8          12HG      VAL   8  -6.051  -8.808  -2.274
   60   3HG1  VAL   8          13HG      VAL   8  -6.604  -7.140  -2.461
   61   1HG2  VAL   8          21HG      VAL   8  -2.481  -7.816  -2.914
   62   2HG2  VAL   8          22HG      VAL   8  -3.474  -9.232  -2.540
   63   3HG2  VAL   8          23HG      VAL   8  -3.220  -7.968  -1.315
   64    H    GLU   9           H        GLU   9  -6.683  -8.034  -6.030
   65    HA   GLU   9           HA       GLU   9  -7.260  -5.218  -6.170
   66   1HB   GLU   9          1HB       GLU   9  -7.511  -6.623  -8.213
   67   2HB   GLU   9          2HB       GLU   9  -8.782  -7.532  -7.406
   68   1HG   GLU   9          1HG       GLU   9 -10.053  -5.397  -7.167
   69   2HG   GLU   9          2HG       GLU   9  -8.828  -4.627  -8.170
   70    H    LEU  10           H        LEU  10  -8.243  -4.381  -4.517
   71    HA   LEU  10           HA       LEU  10  -9.785  -6.059  -2.705
   72   1HB   LEU  10          1HB       LEU  10  -7.952  -4.284  -2.169
   73   2HB   LEU  10          2HB       LEU  10  -9.248  -3.144  -2.487
   74    HG   LEU  10           HG       LEU  10 -10.552  -4.285  -0.656
   75   1HD1  LEU  10          11HD      LEU  10  -7.889  -5.547  -0.139
   76   2HD1  LEU  10          12HD      LEU  10  -9.365  -6.373  -0.645
   77   3HD1  LEU  10          13HD      LEU  10  -9.285  -5.590   0.931
   78   1HD2  LEU  10          21HD      LEU  10  -9.408  -3.137   1.105
   79   2HD2  LEU  10          22HD      LEU  10  -9.352  -2.167  -0.374
   80   3HD2  LEU  10          23HD      LEU  10  -7.926  -3.070   0.149
   81    H    GLU  11           H        GLU  11 -11.934  -5.405  -2.155
   82    HA   GLU  11           HA       GLU  11 -13.126  -3.523  -4.034
   83   1HB   GLU  11          1HB       GLU  11 -13.866  -5.779  -4.531
   84   2HB   GLU  11          2HB       GLU  11 -14.364  -6.026  -2.865
   85   1HG   GLU  11          1HG       GLU  11 -16.132  -4.432  -3.106
   86   2HG   GLU  11          2HG       GLU  11 -15.545  -3.962  -4.700
   87    H    LYS  12           H        LYS  12 -12.931  -1.815  -2.794
   88    HA   LYS  12           HA       LYS  12 -13.844  -1.917  -0.115
   89   1HB   LYS  12          1HB       LYS  12 -12.263  -0.013  -1.667
   90   2HB   LYS  12          2HB       LYS  12 -13.152   0.668  -0.328
   91   1HG   LYS  12          1HG       LYS  12 -11.208  -1.613  -0.269
   92   2HG   LYS  12          2HG       LYS  12 -10.873   0.027   0.336
   93   1HD   LYS  12          1HD       LYS  12 -13.247  -1.232   1.504
   94   2HD   LYS  12          2HD       LYS  12 -11.783  -2.169   1.803
   95   1HE   LYS  12          1HE       LYS  12 -12.282  -0.792   3.622
   96   2HE   LYS  12          2HE       LYS  12 -10.853  -0.104   2.884
   97   1HZ   LYS  12          1HZ       LYS  12 -12.379   1.687   3.417
   98   2HZ   LYS  12          2HZ       LYS  12 -13.664   0.861   2.735
   99   3HZ   LYS  12          3HZ       LYS  12 -12.474   1.522   1.742
  100    H    ASP  13           H        ASP  13 -14.773   0.168   0.623
  101    HA   ASP  13           HA       ASP  13 -17.501   0.296  -0.170
  102   1HB   ASP  13          1HB       ASP  13 -16.057   2.149   1.727
  103   2HB   ASP  13          2HB       ASP  13 -17.725   1.600   1.771
  104    H    GLU  14           H        GLU  14 -18.426   2.573  -0.487
  105    HA   GLU  14           HA       GLU  14 -16.978   3.835  -2.608
  106   1HB   GLU  14          1HB       GLU  14 -18.864   5.378  -2.755
  107   2HB   GLU  14          2HB       GLU  14 -19.397   3.707  -2.724
  108   1HG   GLU  14          1HG       GLU  14 -20.073   3.895  -0.451
  109   2HG   GLU  14          2HG       GLU  14 -19.354   5.501  -0.328
  110    H    ASP  15           H        ASP  15 -16.978   4.174   0.705
  111    HA   ASP  15           HA       ASP  15 -16.210   6.867   1.076
  112   1HB   ASP  15          1HB       ASP  15 -16.693   5.349   2.953
  113   2HB   ASP  15          2HB       ASP  15 -15.274   4.400   2.553
  114    H    GLY  16           H        GLY  16 -14.551   4.028   0.003
  115   1HA   GLY  16          1HA       GLY  16 -12.730   4.397  -1.570
  116   2HA   GLY  16          2HA       GLY  16 -12.151   5.648  -0.465
  117    H    LEU  17           H        LEU  17 -10.398   4.941   0.444
  118    HA   LEU  17           HA       LEU  17 -10.243   2.114   1.200
  119   1HB   LEU  17          1HB       LEU  17  -8.448   3.101  -0.318
  120   2HB   LEU  17          2HB       LEU  17  -8.091   4.159   1.021
  121    HG   LEU  17           HG       LEU  17  -7.151   2.645   2.200
  122   1HD1  LEU  17          11HD      LEU  17  -8.855   0.782   2.044
  123   2HD1  LEU  17          12HD      LEU  17  -7.279   0.117   1.618
  124   3HD1  LEU  17          13HD      LEU  17  -8.438   0.538   0.354
  125   1HD2  LEU  17          21HD      LEU  17  -6.623   1.971  -0.656
  126   2HD2  LEU  17          22HD      LEU  17  -5.570   1.562   0.694
  127   3HD2  LEU  17          23HD      LEU  17  -5.889   3.257   0.307
  128    H    GLY  18           H        GLY  18  -9.103   5.238   2.363
  129   1HA   GLY  18          1HA       GLY  18  -9.117   6.155   4.446
  130   2HA   GLY  18          2HA       GLY  18 -10.271   4.915   4.916
  131    H    ILE  19           H        ILE  19  -6.991   4.307   3.670
  132    HA   ILE  19           HA       ILE  19  -6.468   3.286   6.347
  133    HB   ILE  19           HB       ILE  19  -4.800   1.774   5.519
  134   1HG1  ILE  19          11HG      ILE  19  -5.286   3.008   2.784
  135   2HG1  ILE  19          12HG      ILE  19  -3.822   3.097   3.743
  136   1HG2  ILE  19          21HG      ILE  19  -7.087   1.028   5.488
  137   2HG2  ILE  19          22HG      ILE  19  -6.190   0.300   4.152
  138   3HG2  ILE  19          23HG      ILE  19  -7.299   1.640   3.856
  139   1HD1  ILE  19          11HD      ILE  19  -3.564   1.506   1.966
  140   2HD1  ILE  19          12HD      ILE  19  -5.005   0.662   2.491
  141   3HD1  ILE  19          13HD      ILE  19  -3.553   0.641   3.518
  142    H    SER  20           H        SER  20  -4.062   3.248   6.914
  143    HA   SER  20           HA       SER  20  -2.987   5.933   6.385
  144   1HB   SER  20          1HB       SER  20  -2.864   4.254   8.905
  145   2HB   SER  20          2HB       SER  20  -2.247   5.891   8.748
  146    HG   SER  20           HG       SER  20  -4.676   6.094   7.974
  147    H    ILE  21           H        ILE  21  -0.716   6.056   6.278
  148    HA   ILE  21           HA       ILE  21   0.684   3.489   5.847
  149    HB   ILE  21           HB       ILE  21   1.918   4.555   4.009
  150   1HG1  ILE  21          11HG      ILE  21   0.511   6.650   3.020
  151   2HG1  ILE  21          12HG      ILE  21   0.216   6.880   4.722
  152   1HG2  ILE  21          21HG      ILE  21   0.055   3.131   3.469
  153   2HG2  ILE  21          22HG      ILE  21   0.153   4.458   2.314
  154   3HG2  ILE  21          23HG      ILE  21  -1.057   4.490   3.597
  155   1HD1  ILE  21          11HD      ILE  21   2.966   6.764   3.469
  156   2HD1  ILE  21          12HD      ILE  21   2.618   7.034   5.163
  157   3HD1  ILE  21          13HD      ILE  21   2.130   8.219   3.968
  158    H    ILE  22           H        ILE  22   3.037   3.754   5.958
  159    HA   ILE  22           HA       ILE  22   3.737   6.060   7.518
  160    HB   ILE  22           HB       ILE  22   3.559   4.335   9.128
  161   1HG1  ILE  22          11HG      ILE  22   6.482   4.823   8.524
  162   2HG1  ILE  22          12HG      ILE  22   5.421   5.890   9.426
  163   1HG2  ILE  22          21HG      ILE  22   3.706   2.382   7.743
  164   2HG2  ILE  22          22HG      ILE  22   4.869   2.254   9.067
  165   3HG2  ILE  22          23HG      ILE  22   5.418   2.696   7.444
  166   1HD1  ILE  22          11HD      ILE  22   5.194   4.193  11.155
  167   2HD1  ILE  22          12HD      ILE  22   6.878   4.655  10.899
  168   3HD1  ILE  22          13HD      ILE  22   6.274   3.127  10.250
  169    H    GLY  23           H        GLY  23   5.582   7.061   6.974
  170   1HA   GLY  23          1HA       GLY  23   6.841   6.101   4.563
  171   2HA   GLY  23          2HA       GLY  23   7.017   7.704   5.259
  172    H    MET  24           H        MET  24   8.198   4.496   5.136
  173    HA   MET  24           HA       MET  24  10.423   5.221   6.951
  174   1HB   MET  24          1HB       MET  24   9.508   2.476   6.013
  175   2HB   MET  24          2HB       MET  24  10.889   2.781   7.045
  176   1HG   MET  24          1HG       MET  24   8.003   3.322   7.766
  177   2HG   MET  24          2HG       MET  24   8.950   1.937   8.268
  178   1HE   MET  24          1HE       MET  24  11.643   3.470  10.633
  179   2HE   MET  24          2HE       MET  24  11.820   3.159   8.911
  180   3HE   MET  24          3HE       MET  24  10.973   1.996   9.931
  181    H    GLY  25           H        GLY  25  12.481   4.082   6.179
  182   1HA   GLY  25          1HA       GLY  25  12.619   4.181   3.242
  183   2HA   GLY  25          2HA       GLY  25  13.832   4.978   4.245
  184    H    VAL  26           H        VAL  26  12.251   1.821   3.983
  185    HA   VAL  26           HA       VAL  26  14.437   0.474   5.182
  186    HB   VAL  26           HB       VAL  26  12.067  -0.370   5.251
  187   1HG1  VAL  26          11HG      VAL  26  11.433   0.062   2.975
  188   2HG1  VAL  26          12HG      VAL  26  11.160  -1.636   3.383
  189   3HG1  VAL  26          13HG      VAL  26  12.556  -1.164   2.407
  190   1HG2  VAL  26          21HG      VAL  26  13.828  -1.888   5.864
  191   2HG2  VAL  26          22HG      VAL  26  14.118  -2.291   4.173
  192   3HG2  VAL  26          23HG      VAL  26  12.607  -2.770   4.944
  193    H    GLY  27           H        GLY  27  16.163  -0.452   4.312
  194   1HA   GLY  27          1HA       GLY  27  17.581  -1.318   2.746
  195   2HA   GLY  27          2HA       GLY  27  16.312  -1.160   1.547
  196    H    ALA  28           H        ALA  28  16.603   1.797   2.983
  197    HA   ALA  28           HA       ALA  28  17.815   2.890   0.632
  198   1HB   ALA  28          1HB       ALA  28  17.086   4.285   3.203
  199   2HB   ALA  28          2HB       ALA  28  16.023   4.089   1.808
  200   3HB   ALA  28          3HB       ALA  28  17.484   5.070   1.675
  201    H    ASP  29           H        ASP  29  18.731   3.029   4.004
  202    HA   ASP  29           HA       ASP  29  21.372   3.976   3.531
  203   1HB   ASP  29          1HB       ASP  29  20.328   4.310   5.707
  204   2HB   ASP  29          2HB       ASP  29  20.193   2.573   5.939
  205    H    ALA  30           H        ALA  30  19.958   0.836   3.701
  206    HA   ALA  30           HA       ALA  30  22.310  -0.700   3.884
  207   1HB   ALA  30          1HB       ALA  30  20.080  -1.604   4.361
  208   2HB   ALA  30          2HB       ALA  30  20.940  -2.579   3.168
  209   3HB   ALA  30          3HB       ALA  30  19.671  -1.469   2.650
  210    H    GLY  31           H        GLY  31  20.691   0.783   1.121
  211   1HA   GLY  31          1HA       GLY  31  22.322   1.364  -0.675
  212   2HA   GLY  31          2HA       GLY  31  22.905  -0.283  -0.494
  213    H    LEU  32           H        LEU  32  19.578  -0.355  -0.303
  214    HA   LEU  32           HA       LEU  32  19.439  -1.394  -3.024
  215   1HB   LEU  32          1HB       LEU  32  17.316  -1.469  -0.832
  216   2HB   LEU  32          2HB       LEU  32  17.205  -2.172  -2.400
  217    HG   LEU  32           HG       LEU  32  18.948  -3.818  -1.890
  218   1HD1  LEU  32          11HD      LEU  32  18.950  -2.671   0.898
  219   2HD1  LEU  32          12HD      LEU  32  20.271  -2.540  -0.260
  220   3HD1  LEU  32          13HD      LEU  32  19.801  -4.122   0.367
  221   1HD2  LEU  32          21HD      LEU  32  17.656  -5.131  -0.301
  222   2HD2  LEU  32          22HD      LEU  32  16.612  -4.333  -1.476
  223   3HD2  LEU  32          23HD      LEU  32  16.752  -3.693   0.159
  224    H    GLU  33           H        GLU  33  17.898   0.923  -0.915
  225    HA   GLU  33           HA       GLU  33  16.417   2.556  -1.150
  226   1HB   GLU  33          1HB       GLU  33  17.599   2.859  -3.902
  227   2HB   GLU  33          2HB       GLU  33  16.467   3.992  -3.184
  228   1HG   GLU  33          1HG       GLU  33  18.185   4.295  -1.351
  229   2HG   GLU  33          2HG       GLU  33  19.301   3.424  -2.411
  230    H    LYS  34           H        LYS  34  14.700   1.215  -0.913
  231    HA   LYS  34           HA       LYS  34  13.112   0.990  -3.278
  232   1HB   LYS  34          1HB       LYS  34  14.073  -1.242  -2.630
  233   2HB   LYS  34          2HB       LYS  34  13.439  -0.956  -1.011
  234   1HG   LYS  34          1HG       LYS  34  11.355  -1.344  -1.562
  235   2HG   LYS  34          2HG       LYS  34  11.614  -0.842  -3.251
  236   1HD   LYS  34          1HD       LYS  34  12.692  -3.431  -2.088
  237   2HD   LYS  34          2HD       LYS  34  11.118  -3.346  -2.886
  238   1HE   LYS  34          1HE       LYS  34  12.255  -2.455  -4.911
  239   2HE   LYS  34          2HE       LYS  34  13.803  -2.698  -4.113
  240   1HZ   LYS  34          1HZ       LYS  34  13.281  -4.489  -5.593
  241   2HZ   LYS  34          2HZ       LYS  34  11.846  -4.825  -4.804
  242   3HZ   LYS  34          3HZ       LYS  34  13.337  -5.065  -4.017
  243    H    LEU  35           H        LEU  35  10.806   0.597  -2.264
  244    HA   LEU  35           HA       LEU  35  10.227   3.006  -0.902
  245   1HB   LEU  35          1HB       LEU  35   7.939   2.371  -0.942
  246   2HB   LEU  35          2HB       LEU  35   8.665   1.895  -2.466
  247    HG   LEU  35           HG       LEU  35   8.561  -0.177  -0.366
  248   1HD1  LEU  35          11HD      LEU  35   6.146   0.774  -1.893
  249   2HD1  LEU  35          12HD      LEU  35   6.385   0.861  -0.147
  250   3HD1  LEU  35          13HD      LEU  35   6.239  -0.698  -0.933
  251   1HD2  LEU  35          21HD      LEU  35   8.034  -1.598  -2.267
  252   2HD2  LEU  35          22HD      LEU  35   9.485  -0.646  -2.584
  253   3HD2  LEU  35          23HD      LEU  35   7.943  -0.187  -3.314
  254    H    GLY  36           H        GLY  36   9.582   3.297   1.181
  255   1HA   GLY  36          1HA       GLY  36   9.669   0.950   2.928
  256   2HA   GLY  36          2HA       GLY  36  10.290   2.534   3.419
  257    H    ILE  37           H        ILE  37   7.475   2.262   1.441
  258    HA   ILE  37           HA       ILE  37   5.997   3.512   3.566
  259    HB   ILE  37           HB       ILE  37   4.982   2.766   0.816
  260   1HG1  ILE  37          11HG      ILE  37   6.924   4.354   0.785
  261   2HG1  ILE  37          12HG      ILE  37   5.447   5.073   0.121
  262   1HG2  ILE  37          21HG      ILE  37   3.227   3.073   2.457
  263   2HG2  ILE  37          22HG      ILE  37   3.220   4.449   1.349
  264   3HG2  ILE  37          23HG      ILE  37   3.922   4.603   2.965
  265   1HD1  ILE  37          11HD      ILE  37   6.759   5.514   2.779
  266   2HD1  ILE  37          12HD      ILE  37   5.177   6.181   2.352
  267   3HD1  ILE  37          13HD      ILE  37   6.611   6.679   1.458
  268    H    PHE  38           H        PHE  38   5.454   2.168   5.029
  269    HA   PHE  38           HA       PHE  38   4.318  -0.440   4.326
  270   1HB   PHE  38          1HB       PHE  38   5.255   0.727   6.928
  271   2HB   PHE  38          2HB       PHE  38   4.484  -0.844   6.827
  272    HD1  PHE  38           HD1      PHE  38   5.631  -2.697   5.625
  273    HD2  PHE  38           HD2      PHE  38   7.544   1.022   6.378
  274    HE1  PHE  38           HE1      PHE  38   7.819  -3.743   5.208
  275    HE2  PHE  38           HE2      PHE  38   9.734  -0.010   5.962
  276    HZ   PHE  38           HZ       PHE  38   9.876  -2.397   5.376
  277    H    VAL  39           H        VAL  39   2.371  -1.115   5.574
  278    HA   VAL  39           HA       VAL  39   0.494   1.034   5.489
  279    HB   VAL  39           HB       VAL  39   0.102  -1.817   6.466
  280   1HG1  VAL  39          11HG      VAL  39  -1.656  -0.303   7.175
  281   2HG1  VAL  39          12HG      VAL  39  -2.266  -1.422   5.955
  282   3HG1  VAL  39          13HG      VAL  39  -1.883   0.240   5.513
  283   1HG2  VAL  39          21HG      VAL  39  -0.757  -2.335   4.222
  284   2HG2  VAL  39          22HG      VAL  39   0.933  -1.823   4.157
  285   3HG2  VAL  39          23HG      VAL  39  -0.341  -0.707   3.694
  286    H    LYS  40           H        LYS  40  -0.081   2.178   7.182
  287    HA   LYS  40           HA       LYS  40   1.321   1.683   9.670
  288   1HB   LYS  40          1HB       LYS  40   1.388   3.939   8.814
  289   2HB   LYS  40          2HB       LYS  40  -0.362   4.003   8.717
  290   1HG   LYS  40          1HG       LYS  40   0.432   5.287  10.583
  291   2HG   LYS  40          2HG       LYS  40  -0.477   3.889  11.154
  292   1HD   LYS  40          1HD       LYS  40   1.670   2.708  11.526
  293   2HD   LYS  40          2HD       LYS  40   2.520   4.190  11.073
  294   1HE   LYS  40          1HE       LYS  40   1.396   5.382  12.819
  295   2HE   LYS  40          2HE       LYS  40   0.530   3.909  13.276
  296   1HZ   LYS  40          1HZ       LYS  40   3.477   4.304  13.393
  297   2HZ   LYS  40          2HZ       LYS  40   2.696   2.892  13.807
  298   3HZ   LYS  40          3HZ       LYS  40   2.447   4.289  14.727
  299    H    THR  41           H        THR  41  -1.956   2.007   8.408
  300    HA   THR  41           HA       THR  41  -3.013   0.326  10.471
  301    HB   THR  41           HB       THR  41  -4.351   2.928  10.179
  302    HG1  THR  41           HG1      THR  41  -1.989   2.379  11.648
  303   1HG2  THR  41          21HG      THR  41  -4.049   1.014  12.484
  304   2HG2  THR  41          22HG      THR  41  -5.470   1.232  11.448
  305   3HG2  THR  41          23HG      THR  41  -4.967   2.516  12.556
  306    H    VAL  42           H        VAL  42  -5.373   0.001   9.902
  307    HA   VAL  42           HA       VAL  42  -6.002   0.802   7.179
  308    HB   VAL  42           HB       VAL  42  -6.449  -1.947   8.456
  309   1HG1  VAL  42          11HG      VAL  42  -8.299  -1.267   7.044
  310   2HG1  VAL  42          12HG      VAL  42  -7.403  -2.603   6.301
  311   3HG1  VAL  42          13HG      VAL  42  -7.180  -0.944   5.726
  312   1HG2  VAL  42          21HG      VAL  42  -4.142  -1.610   7.678
  313   2HG2  VAL  42          22HG      VAL  42  -4.756  -1.198   6.078
  314   3HG2  VAL  42          23HG      VAL  42  -4.995  -2.822   6.721
  315    H    THR  43           H        THR  43  -8.306   1.057   6.926
  316    HA   THR  43           HA       THR  43  -9.618   2.122   9.156
  317    HB   THR  43           HB       THR  43 -10.110   2.787   6.792
  318    HG1  THR  43           HG1      THR  43 -12.044   3.293   7.357
  319   1HG2  THR  43          21HG      THR  43 -11.407   0.113   6.684
  320   2HG2  THR  43          22HG      THR  43  -9.914   0.550   5.854
  321   3HG2  THR  43          23HG      THR  43 -11.450   1.314   5.376
  322    H    GLU  44           H        GLU  44 -11.277   1.265  10.308
  323    HA   GLU  44           HA       GLU  44 -11.053  -1.563  10.818
  324   1HB   GLU  44          1HB       GLU  44 -11.190   0.180  12.611
  325   2HB   GLU  44          2HB       GLU  44 -12.845   0.486  12.119
  326   1HG   GLU  44          1HG       GLU  44 -13.389  -1.860  12.649
  327   2HG   GLU  44          2HG       GLU  44 -11.743  -2.063  13.253
  328    H    GLY  45           H        GLY  45 -13.528   0.736   9.992
  329   1HA   GLY  45          1HA       GLY  45 -15.193  -1.458   9.058
  330   2HA   GLY  45          2HA       GLY  45 -15.869   0.107   9.616
  331    H    GLY  46           H        GLY  46 -13.606  -1.314   7.499
  332   1HA   GLY  46          1HA       GLY  46 -14.962  -0.210   5.262
  333   2HA   GLY  46          2HA       GLY  46 -13.217   0.076   5.436
  334    H    ALA  47           H        ALA  47 -14.638  -1.525   3.608
  335    HA   ALA  47           HA       ALA  47 -14.579  -4.251   4.137
  336   1HB   ALA  47          1HB       ALA  47 -14.876  -4.666   1.817
  337   2HB   ALA  47          2HB       ALA  47 -14.175  -3.112   1.403
  338   3HB   ALA  47          3HB       ALA  47 -15.741  -3.177   2.225
  339    H    ALA  48           H        ALA  48 -11.839  -2.548   4.201
  340    HA   ALA  48           HA       ALA  48 -10.050  -4.242   2.707
  341   1HB   ALA  48          1HB       ALA  48  -9.467  -2.179   4.843
  342   2HB   ALA  48          2HB       ALA  48  -9.485  -1.896   3.102
  343   3HB   ALA  48          3HB       ALA  48  -8.267  -2.954   3.809
  344    H    GLN  49           H        GLN  49 -10.724  -3.663   6.179
  345    HA   GLN  49           HA       GLN  49  -9.344  -6.080   6.825
  346   1HB   GLN  49          1HB       GLN  49 -10.864  -4.125   8.537
  347   2HB   GLN  49          2HB       GLN  49 -10.155  -5.602   9.189
  348   1HG   GLN  49          1HG       GLN  49  -7.946  -4.878   8.382
  349   2HG   GLN  49          2HG       GLN  49  -8.681  -3.391   7.795
  350   1HE2  GLN  49          21HE      GLN  49 -10.387  -3.054  10.038
  351   2HE2  GLN  49          22HE      GLN  49  -9.426  -2.589  11.388
  352    H    ARG  50           H        ARG  50 -12.278  -5.485   5.581
  353    HA   ARG  50           HA       ARG  50 -13.640  -7.710   6.793
  354   1HB   ARG  50          1HB       ARG  50 -14.242  -6.212   4.246
  355   2HB   ARG  50          2HB       ARG  50 -15.248  -7.474   4.915
  356   1HG   ARG  50          1HG       ARG  50 -14.540  -5.005   6.377
  357   2HG   ARG  50          2HG       ARG  50 -16.009  -5.119   5.375
  358   1HD   ARG  50          1HD       ARG  50 -16.548  -7.136   6.877
  359   2HD   ARG  50          2HD       ARG  50 -15.270  -6.526   7.933
  360    HE   ARG  50           HE       ARG  50 -17.611  -4.971   7.116
  361   1HH1  ARG  50          11HH      ARG  50 -15.334  -5.936   9.677
  362   2HH1  ARG  50          12HH      ARG  50 -16.008  -4.910  10.845
  363   1HH2  ARG  50          21HH      ARG  50 -18.525  -3.557   8.751
  364   2HH2  ARG  50          22HH      ARG  50 -17.834  -3.506  10.292
  365    H    ASP  51           H        ASP  51 -11.834  -6.867   3.875
  366    HA   ASP  51           HA       ASP  51 -12.097  -9.128   2.318
  367   1HB   ASP  51          1HB       ASP  51 -11.037  -7.125   1.521
  368   2HB   ASP  51          2HB       ASP  51  -9.721  -7.308   2.665
  369    H    GLY  52           H        GLY  52  -9.310  -8.508   4.448
  370   1HA   GLY  52          1HA       GLY  52  -8.617 -10.096   6.101
  371   2HA   GLY  52          2HA       GLY  52  -9.384 -11.355   5.154
  372    H    ARG  53           H        ARG  53  -7.939 -10.001   2.706
  373    HA   ARG  53           HA       ARG  53  -5.552 -11.654   3.054
  374   1HB   ARG  53          1HB       ARG  53  -7.152 -11.392   0.912
  375   2HB   ARG  53          2HB       ARG  53  -6.091 -10.049   0.569
  376   1HG   ARG  53          1HG       ARG  53  -5.098 -12.885   0.934
  377   2HG   ARG  53          2HG       ARG  53  -5.593 -12.245  -0.619
  378   1HD   ARG  53          1HD       ARG  53  -3.194 -12.192  -0.501
  379   2HD   ARG  53          2HD       ARG  53  -3.769 -10.536  -0.380
  380    HE   ARG  53           HE       ARG  53  -3.383 -10.743   2.051
  381   1HH1  ARG  53          11HH      ARG  53  -1.538 -12.980  -0.035
  382   2HH1  ARG  53          12HH      ARG  53  -0.226 -13.022   1.042
  383   1HH2  ARG  53          21HH      ARG  53  -1.586 -10.822   3.434
  384   2HH2  ARG  53          22HH      ARG  53  -0.227 -11.774   3.004
  385    H    ILE  54           H        ILE  54  -6.504  -8.347   2.333
  386    HA   ILE  54           HA       ILE  54  -3.806  -7.375   2.469
  387    HB   ILE  54           HB       ILE  54  -5.807  -6.284   1.206
  388   1HG1  ILE  54          11HG      ILE  54  -4.142  -4.480   2.972
  389   2HG1  ILE  54          12HG      ILE  54  -3.561  -5.249   1.497
  390   1HG2  ILE  54          21HG      ILE  54  -7.422  -6.232   2.990
  391   2HG2  ILE  54          22HG      ILE  54  -7.028  -4.555   2.572
  392   3HG2  ILE  54          23HG      ILE  54  -6.312  -5.319   4.002
  393   1HD1  ILE  54          11HD      ILE  54  -5.326  -4.048   0.243
  394   2HD1  ILE  54          12HD      ILE  54  -4.137  -3.003   0.988
  395   3HD1  ILE  54          13HD      ILE  54  -5.751  -3.188   1.719
  396    H    GLN  55           H        GLN  55  -2.856  -6.173   4.268
  397    HA   GLN  55           HA       GLN  55  -4.372  -6.424   6.725
  398   1HB   GLN  55          1HB       GLN  55  -1.496  -7.344   6.542
  399   2HB   GLN  55          2HB       GLN  55  -2.551  -7.439   7.935
  400   1HG   GLN  55          1HG       GLN  55  -3.935  -9.078   6.763
  401   2HG   GLN  55          2HG       GLN  55  -2.845  -8.987   5.380
  402   1HE2  GLN  55          21HE      GLN  55  -0.674  -9.643   5.698
  403   2HE2  GLN  55          22HE      GLN  55  -0.290 -10.851   6.876
  404    H    VAL  56           H        VAL  56  -2.534  -5.627   8.528
  405    HA   VAL  56           HA       VAL  56  -2.056  -2.809   7.839
  406    HB   VAL  56           HB       VAL  56  -1.807  -4.233  10.494
  407   1HG1  VAL  56          11HG      VAL  56  -1.961  -1.305   9.843
  408   2HG1  VAL  56          12HG      VAL  56  -0.570  -2.195  10.466
  409   3HG1  VAL  56          13HG      VAL  56  -2.001  -1.983  11.474
  410   1HG2  VAL  56          21HG      VAL  56  -4.161  -2.662   9.452
  411   2HG2  VAL  56          22HG      VAL  56  -3.990  -3.327  11.079
  412   3HG2  VAL  56          23HG      VAL  56  -4.095  -4.409   9.690
  413    H    ASN  57           H        ASN  57  -0.354  -5.716   8.713
  414    HA   ASN  57           HA       ASN  57   2.076  -4.157   9.056
  415   1HB   ASN  57          1HB       ASN  57   1.428  -7.012   9.667
  416   2HB   ASN  57          2HB       ASN  57   3.079  -6.389   9.770
  417   1HD2  ASN  57          21HD      ASN  57  -0.093  -6.425  11.207
  418   2HD2  ASN  57          22HD      ASN  57   0.352  -5.613  12.658
  419    H    ASP  58           H        ASP  58   0.806  -4.732   6.424
  420    HA   ASP  58           HA       ASP  58   3.069  -6.033   5.107
  421   1HB   ASP  58          1HB       ASP  58   0.239  -5.519   4.163
  422   2HB   ASP  58          2HB       ASP  58   1.527  -5.940   3.042
  423    H    GLN  59           H        GLN  59   3.003  -4.871   2.618
  424    HA   GLN  59           HA       GLN  59   3.638  -2.069   3.259
  425   1HB   GLN  59          1HB       GLN  59   5.626  -3.551   3.210
  426   2HB   GLN  59          2HB       GLN  59   5.210  -3.955   1.547
  427   1HG   GLN  59          1HG       GLN  59   5.535  -1.658   0.887
  428   2HG   GLN  59          2HG       GLN  59   5.893  -1.211   2.549
  429   1HE2  GLN  59          21HE      GLN  59   7.864  -0.490   2.093
  430   2HE2  GLN  59          22HE      GLN  59   9.202  -1.481   1.638
  431    H    ILE  60           H        ILE  60   2.687  -0.620   1.846
  432    HA   ILE  60           HA       ILE  60   1.194  -1.566  -0.436
  433    HB   ILE  60           HB       ILE  60   1.926   1.297   0.215
  434   1HG1  ILE  60          11HG      ILE  60   0.631   0.395   2.106
  435   2HG1  ILE  60          12HG      ILE  60  -0.323   1.524   1.142
  436   1HG2  ILE  60          21HG      ILE  60   0.142   1.887  -1.306
  437   2HG2  ILE  60          22HG      ILE  60  -0.332   0.199  -1.399
  438   3HG2  ILE  60          23HG      ILE  60   1.192   0.691  -2.110
  439   1HD1  ILE  60          11HD      ILE  60  -0.528  -1.469   1.026
  440   2HD1  ILE  60          12HD      ILE  60  -1.480  -0.323   0.079
  441   3HD1  ILE  60          13HD      ILE  60  -1.661  -0.382   1.832
  442    H    VAL  61           H        VAL  61   2.421  -2.247  -2.120
  443    HA   VAL  61           HA       VAL  61   4.953  -0.910  -2.617
  444    HB   VAL  61           HB       VAL  61   3.751  -3.428  -3.779
  445   1HG1  VAL  61          11HG      VAL  61   6.534  -2.374  -4.158
  446   2HG1  VAL  61          12HG      VAL  61   5.244  -2.462  -5.380
  447   3HG1  VAL  61          13HG      VAL  61   5.895  -3.945  -4.675
  448   1HG2  VAL  61          21HG      VAL  61   5.451  -4.570  -2.413
  449   2HG2  VAL  61          22HG      VAL  61   4.270  -3.679  -1.471
  450   3HG2  VAL  61          23HG      VAL  61   5.890  -3.012  -1.707
  451    H    GLU  62           H        GLU  62   2.049  -1.738  -4.402
  452    HA   GLU  62           HA       GLU  62   2.354   0.631  -6.022
  453   1HB   GLU  62          1HB       GLU  62   3.617  -0.820  -7.406
  454   2HB   GLU  62          2HB       GLU  62   2.491  -2.145  -7.250
  455   1HG   GLU  62          1HG       GLU  62   0.839  -0.908  -8.546
  456   2HG   GLU  62          2HG       GLU  62   1.932   0.465  -8.630
  457    H    VAL  63           H        VAL  63   0.494   1.505  -5.553
  458    HA   VAL  63           HA       VAL  63  -1.897  -0.147  -5.659
  459    HB   VAL  63           HB       VAL  63  -1.302   2.447  -4.240
  460   1HG1  VAL  63          11HG      VAL  63  -4.080   1.546  -5.061
  461   2HG1  VAL  63          12HG      VAL  63  -3.234   2.975  -5.673
  462   3HG1  VAL  63          13HG      VAL  63  -3.691   2.891  -3.970
  463   1HG2  VAL  63          21HG      VAL  63  -2.447   1.286  -2.494
  464   2HG2  VAL  63          22HG      VAL  63  -1.211   0.233  -3.209
  465   3HG2  VAL  63          23HG      VAL  63  -2.902   0.007  -3.611
  466    H    ASP  64           H        ASP  64  -3.133  -0.196  -7.202
  467    HA   ASP  64           HA       ASP  64  -4.426   0.295  -8.910
  468   1HB   ASP  64          1HB       ASP  64  -5.000   2.390  -7.763
  469   2HB   ASP  64          2HB       ASP  64  -3.630   3.189  -8.516
  470    H    GLY  65           H        GLY  65  -1.315   0.682  -8.952
  471   1HA   GLY  65          1HA       GLY  65   0.070   0.003 -10.816
  472   2HA   GLY  65          2HA       GLY  65  -1.160   0.710 -11.872
  473    H    ILE  66           H        ILE  66  -0.563   2.658  -9.180
  474    HA   ILE  66           HA       ILE  66   0.527   4.718 -10.774
  475    HB   ILE  66           HB       ILE  66  -0.982   4.918  -8.606
  476   1HG1  ILE  66          11HG      ILE  66   1.407   6.740  -8.909
  477   2HG1  ILE  66          12HG      ILE  66   0.017   6.778  -9.992
  478   1HG2  ILE  66          21HG      ILE  66   1.769   4.835  -7.396
  479   2HG2  ILE  66          22HG      ILE  66   0.469   3.669  -7.130
  480   3HG2  ILE  66          23HG      ILE  66   0.289   5.334  -6.569
  481   1HD1  ILE  66          11HD      ILE  66   0.036   7.306  -7.063
  482   2HD1  ILE  66          12HD      ILE  66  -1.404   7.321  -8.082
  483   3HD1  ILE  66          13HD      ILE  66  -0.128   8.526  -8.331
  484    H    SER  67           H        SER  67   1.906   2.171  -9.137
  485    HA   SER  67           HA       SER  67   3.873   1.579  -8.274
  486   1HB   SER  67          1HB       SER  67   5.876   2.074  -9.782
  487   2HB   SER  67          2HB       SER  67   4.493   1.290 -10.547
  488    HG   SER  67           HG       SER  67   4.254   3.964 -10.657
  489    H    LEU  68           H        LEU  68   3.790   2.580  -6.308
  490    HA   LEU  68           HA       LEU  68   5.049   5.195  -6.102
  491   1HB   LEU  68          1HB       LEU  68   4.067   5.281  -3.884
  492   2HB   LEU  68          2HB       LEU  68   2.856   4.938  -5.096
  493    HG   LEU  68           HG       LEU  68   3.674   2.459  -4.230
  494   1HD1  LEU  68          11HD      LEU  68   3.388   4.286  -1.856
  495   2HD1  LEU  68          12HD      LEU  68   4.848   3.464  -2.383
  496   3HD1  LEU  68          13HD      LEU  68   3.470   2.518  -1.803
  497   1HD2  LEU  68          21HD      LEU  68   1.483   3.105  -4.864
  498   2HD2  LEU  68          22HD      LEU  68   1.303   4.111  -3.414
  499   3HD2  LEU  68          23HD      LEU  68   1.440   2.346  -3.274
  500    H    VAL  69           H        VAL  69   6.123   2.390  -6.347
  501    HA   VAL  69           HA       VAL  69   7.793   1.761  -4.226
  502    HB   VAL  69           HB       VAL  69   8.463   1.465  -7.166
  503   1HG1  VAL  69          11HG      VAL  69   9.932  -0.375  -6.464
  504   2HG1  VAL  69          12HG      VAL  69   9.566  -0.023  -4.777
  505   3HG1  VAL  69          13HG      VAL  69  10.432   1.160  -5.754
  506   1HG2  VAL  69          21HG      VAL  69   7.551  -0.816  -6.926
  507   2HG2  VAL  69          22HG      VAL  69   6.339   0.432  -6.654
  508   3HG2  VAL  69          23HG      VAL  69   7.047  -0.419  -5.285
  509    H    GLY  70           H        GLY  70   8.713   3.505  -3.260
  510   1HA   GLY  70          1HA       GLY  70  10.910   4.457  -2.961
  511   2HA   GLY  70          2HA       GLY  70  10.971   4.701  -4.701
  512    H    VAL  71           H        VAL  71   8.202   5.473  -2.658
  513    HA   VAL  71           HA       VAL  71   8.703   8.300  -3.306
  514    HB   VAL  71           HB       VAL  71   6.315   8.743  -3.285
  515   1HG1  VAL  71          11HG      VAL  71   7.269   8.049  -5.392
  516   2HG1  VAL  71          12HG      VAL  71   5.605   7.481  -5.235
  517   3HG1  VAL  71          13HG      VAL  71   6.943   6.360  -4.999
  518   1HG2  VAL  71          21HG      VAL  71   4.653   6.984  -2.992
  519   2HG2  VAL  71          22HG      VAL  71   5.663   7.126  -1.554
  520   3HG2  VAL  71          23HG      VAL  71   5.928   5.804  -2.689
  521    H    THR  72           H        THR  72   7.277   9.739  -1.744
  522    HA   THR  72           HA       THR  72   8.167   9.145   0.951
  523    HB   THR  72           HB       THR  72   7.241  11.499   1.280
  524    HG1  THR  72           HG1      THR  72   7.511  11.960  -1.436
  525   1HG2  THR  72          21HG      THR  72   9.234  12.543   0.269
  526   2HG2  THR  72          22HG      THR  72   9.519  11.074  -0.675
  527   3HG2  THR  72          23HG      THR  72   9.627  11.034   1.091
  528    H    GLN  73           H        GLN  73   6.639   9.925   2.646
  529    HA   GLN  73           HA       GLN  73   4.393   8.243   2.540
  530   1HB   GLN  73          1HB       GLN  73   4.025   8.699   4.801
  531   2HB   GLN  73          2HB       GLN  73   5.711   9.131   4.640
  532   1HG   GLN  73          1HG       GLN  73   3.440  11.082   4.555
  533   2HG   GLN  73          2HG       GLN  73   4.379  10.715   5.998
  534   1HE2  GLN  73          21HE      GLN  73   6.919  10.521   4.623
  535   2HE2  GLN  73          22HE      GLN  73   7.296  12.127   4.148
  536    H    ASN  74           H        ASN  74   4.806  11.632   1.837
  537    HA   ASN  74           HA       ASN  74   2.011  12.203   1.906
  538   1HB   ASN  74          1HB       ASN  74   2.548  14.374   0.840
  539   2HB   ASN  74          2HB       ASN  74   3.572  14.058   2.233
  540   1HD2  ASN  74          21HD      ASN  74   5.785  13.872   1.935
  541   2HD2  ASN  74          22HD      ASN  74   6.524  14.145   0.413
  542    H    PHE  75           H        PHE  75   4.225  11.203  -0.605
  543    HA   PHE  75           HA       PHE  75   2.402  11.497  -2.733
  544   1HB   PHE  75          1HB       PHE  75   4.880  11.047  -3.004
  545   2HB   PHE  75          2HB       PHE  75   4.556   9.395  -2.483
  546    HD1  PHE  75           HD1      PHE  75   4.525  11.696  -5.248
  547    HD2  PHE  75           HD2      PHE  75   3.042   7.922  -3.925
  548    HE1  PHE  75           HE1      PHE  75   3.991  11.080  -7.566
  549    HE2  PHE  75           HE2      PHE  75   2.509   7.314  -6.208
  550    HZ   PHE  75           HZ       PHE  75   2.984   8.885  -8.060
  551    H    ALA  76           H        ALA  76   3.317   8.746  -0.698
  552    HA   ALA  76           HA       ALA  76   1.488   6.922  -1.733
  553   1HB   ALA  76          1HB       ALA  76   1.901   5.608   0.238
  554   2HB   ALA  76          2HB       ALA  76   2.638   7.000   1.042
  555   3HB   ALA  76          3HB       ALA  76   3.400   6.295  -0.387
  556    H    ALA  77           H        ALA  77   1.127   9.085   1.095
  557    HA   ALA  77           HA       ALA  77  -1.379   8.196   1.918
  558   1HB   ALA  77          1HB       ALA  77  -1.603  10.339   3.065
  559   2HB   ALA  77          2HB       ALA  77  -0.290  11.008   2.093
  560   3HB   ALA  77          3HB       ALA  77   0.037   9.712   3.241
  561    H    THR  78           H        THR  78  -0.479  10.435  -0.598
  562    HA   THR  78           HA       THR  78  -3.082  11.335  -1.211
  563    HB   THR  78           HB       THR  78  -0.581  11.161  -2.886
  564    HG1  THR  78           HG1      THR  78  -0.289  12.555  -1.182
  565   1HG2  THR  78          21HG      THR  78  -1.640  12.827  -4.378
  566   2HG2  THR  78          22HG      THR  78  -3.123  12.711  -3.419
  567   3HG2  THR  78          23HG      THR  78  -2.533  11.306  -4.311
  568    H    VAL  79           H        VAL  79  -1.062   8.721  -2.511
  569    HA   VAL  79           HA       VAL  79  -2.819   7.794  -4.495
  570    HB   VAL  79           HB       VAL  79  -0.933   6.054  -2.911
  571   1HG1  VAL  79          11HG      VAL  79  -2.000   5.768  -5.724
  572   2HG1  VAL  79          12HG      VAL  79  -2.562   4.880  -4.330
  573   3HG1  VAL  79          13HG      VAL  79  -0.917   4.637  -4.908
  574   1HG2  VAL  79          21HG      VAL  79   0.331   7.905  -3.703
  575   2HG2  VAL  79          22HG      VAL  79  -0.448   7.832  -5.265
  576   3HG2  VAL  79          23HG      VAL  79   0.677   6.544  -4.780
  577    H    LEU  80           H        LEU  80  -2.320   6.611  -1.185
  578    HA   LEU  80           HA       LEU  80  -4.434   4.724  -1.298
  579   1HB   LEU  80          1HB       LEU  80  -2.906   5.837   1.051
  580   2HB   LEU  80          2HB       LEU  80  -4.186   4.663   1.244
  581    HG   LEU  80           HG       LEU  80  -2.157   3.460   1.380
  582   1HD1  LEU  80          11HD      LEU  80  -3.168   3.049  -1.403
  583   2HD1  LEU  80          12HD      LEU  80  -3.841   2.362   0.069
  584   3HD1  LEU  80          13HD      LEU  80  -2.214   1.915  -0.443
  585   1HD2  LEU  80          21HD      LEU  80  -1.265   4.684  -1.217
  586   2HD2  LEU  80          22HD      LEU  80  -0.367   3.513  -0.238
  587   3HD2  LEU  80          23HD      LEU  80  -0.673   5.133   0.377
  588    H    ARG  81           H        ARG  81  -4.605   7.994  -1.115
  589    HA   ARG  81           HA       ARG  81  -7.183   7.913   0.146
  590   1HB   ARG  81          1HB       ARG  81  -5.915   9.742   0.939
  591   2HB   ARG  81          2HB       ARG  81  -5.325  10.148  -0.647
  592   1HG   ARG  81          1HG       ARG  81  -8.231  10.521  -0.002
  593   2HG   ARG  81          2HG       ARG  81  -7.041  11.713   0.521
  594   1HD   ARG  81          1HD       ARG  81  -6.318  12.003  -1.825
  595   2HD   ARG  81          2HD       ARG  81  -7.477  10.797  -2.332
  596    HE   ARG  81           HE       ARG  81  -8.754  12.861  -0.889
  597   1HH1  ARG  81          11HH      ARG  81  -7.498  12.075  -4.124
  598   2HH1  ARG  81          12HH      ARG  81  -8.420  13.231  -4.941
  599   1HH2  ARG  81          21HH      ARG  81 -10.057  14.482  -2.030
  600   2HH2  ARG  81          22HH      ARG  81  -9.934  14.631  -3.708
  601    H    ASN  82           H        ASN  82  -5.627   8.279  -2.934
  602    HA   ASN  82           HA       ASN  82  -7.922   9.224  -4.390
  603   1HB   ASN  82          1HB       ASN  82  -5.104   8.647  -5.061
  604   2HB   ASN  82          2HB       ASN  82  -6.275   8.519  -6.373
  605   1HD2  ASN  82          21HD      ASN  82  -4.916  10.652  -3.974
  606   2HD2  ASN  82          22HD      ASN  82  -5.372  12.115  -4.786
  607    H    THR  83           H        THR  83  -7.329   6.448  -3.088
  608    HA   THR  83           HA       THR  83  -7.913   4.555  -5.044
  609    HB   THR  83           HB       THR  83  -8.553   3.249  -2.937
  610    HG1  THR  83           HG1      THR  83  -8.895   5.350  -1.791
  611   1HG2  THR  83          21HG      THR  83  -6.177   3.057  -2.292
  612   2HG2  THR  83          22HG      THR  83  -5.828   4.545  -3.172
  613   3HG2  THR  83          23HG      THR  83  -6.355   3.109  -4.044
  614    H    LYS  84           H        LYS  84  -9.890   3.154  -4.695
  615    HA   LYS  84           HA       LYS  84 -12.358   4.522  -4.250
  616   1HB   LYS  84          1HB       LYS  84 -12.941   3.575  -6.722
  617   2HB   LYS  84          2HB       LYS  84 -12.368   5.213  -6.462
  618   1HG   LYS  84          1HG       LYS  84 -11.161   4.292  -8.323
  619   2HG   LYS  84          2HG       LYS  84 -10.057   4.406  -6.959
  620   1HD   LYS  84          1HD       LYS  84 -10.628   1.969  -6.507
  621   2HD   LYS  84          2HD       LYS  84 -11.361   1.957  -8.105
  622   1HE   LYS  84          1HE       LYS  84  -8.467   2.595  -7.460
  623   2HE   LYS  84          2HE       LYS  84  -9.070   1.128  -8.214
  624   1HZ   LYS  84          1HZ       LYS  84  -9.743   2.453 -10.143
  625   2HZ   LYS  84          2HZ       LYS  84  -8.086   2.654  -9.793
  626   3HZ   LYS  84          3HZ       LYS  84  -9.168   3.853  -9.384
  627    H    GLY  85           H        GLY  85 -13.926   2.514  -5.533
  628   1HA   GLY  85          1HA       GLY  85 -14.044   0.509  -3.648
  629   2HA   GLY  85          2HA       GLY  85 -14.740   0.401  -5.253
  630    H    ASN  86           H        ASN  86 -13.146  -0.302  -7.013
  631    HA   ASN  86           HA       ASN  86 -11.712  -2.566  -5.890
  632   1HB   ASN  86          1HB       ASN  86 -12.491  -1.957  -8.735
  633   2HB   ASN  86          2HB       ASN  86 -11.440  -3.298  -8.298
  634   1HD2  ASN  86          21HD      ASN  86 -12.292  -5.006  -7.114
  635   2HD2  ASN  86          22HD      ASN  86 -13.983  -5.325  -7.035
  636    H    VAL  87           H        VAL  87  -9.783  -2.275  -5.288
  637    HA   VAL  87           HA       VAL  87  -8.027  -0.446  -6.834
  638    HB   VAL  87           HB       VAL  87  -7.434  -1.288  -4.059
  639   1HG1  VAL  87          11HG      VAL  87  -6.795   1.178  -5.605
  640   2HG1  VAL  87          12HG      VAL  87  -5.737  -0.189  -5.242
  641   3HG1  VAL  87          13HG      VAL  87  -6.308   0.857  -3.932
  642   1HG2  VAL  87          21HG      VAL  87  -8.599   0.678  -3.151
  643   2HG2  VAL  87          22HG      VAL  87  -9.644  -0.560  -3.854
  644   3HG2  VAL  87          23HG      VAL  87  -9.334   0.935  -4.751
  645    H    ARG  88           H        ARG  88  -6.167  -1.317  -7.565
  646    HA   ARG  88           HA       ARG  88  -5.536  -4.087  -6.898
  647   1HB   ARG  88          1HB       ARG  88  -4.492  -2.169  -8.948
  648   2HB   ARG  88          2HB       ARG  88  -3.797  -3.760  -8.668
  649   1HG   ARG  88          1HG       ARG  88  -5.702  -4.856  -9.374
  650   2HG   ARG  88          2HG       ARG  88  -6.700  -3.394  -9.292
  651   1HD   ARG  88          1HD       ARG  88  -6.143  -3.941 -11.571
  652   2HD   ARG  88          2HD       ARG  88  -5.412  -2.413 -11.051
  653    HE   ARG  88           HE       ARG  88  -3.868  -4.915 -11.078
  654   1HH1  ARG  88          11HH      ARG  88  -4.201  -1.520 -12.143
  655   2HH1  ARG  88          12HH      ARG  88  -2.694  -1.490 -12.902
  656   1HH2  ARG  88          21HH      ARG  88  -1.822  -4.823 -12.101
  657   2HH2  ARG  88          22HH      ARG  88  -1.312  -3.378 -12.893
  658    H    PHE  89           H        PHE  89  -4.659  -4.096  -4.958
  659    HA   PHE  89           HA       PHE  89  -2.461  -2.296  -4.335
  660   1HB   PHE  89          1HB       PHE  89  -3.734  -4.522  -2.750
  661   2HB   PHE  89          2HB       PHE  89  -2.431  -3.496  -2.187
  662    HD1  PHE  89           HD1      PHE  89  -5.939  -3.759  -2.912
  663    HD2  PHE  89           HD2      PHE  89  -2.830  -1.248  -1.558
  664    HE1  PHE  89           HE1      PHE  89  -7.601  -2.180  -1.988
  665    HE2  PHE  89           HE2      PHE  89  -4.467   0.333  -0.650
  666    HZ   PHE  89           HZ       PHE  89  -6.863  -0.145  -0.873
  667    H    VAL  90           H        VAL  90  -0.693  -2.961  -5.461
  668    HA   VAL  90           HA       VAL  90  -0.151  -5.797  -5.422
  669    HB   VAL  90           HB       VAL  90   1.490  -3.578  -6.651
  670   1HG1  VAL  90          11HG      VAL  90   1.577  -6.566  -7.069
  671   2HG1  VAL  90          12HG      VAL  90   2.786  -5.597  -6.228
  672   3HG1  VAL  90          13HG      VAL  90   2.544  -5.395  -7.962
  673   1HG2  VAL  90          21HG      VAL  90   0.547  -4.221  -8.819
  674   2HG2  VAL  90          22HG      VAL  90  -0.703  -3.656  -7.710
  675   3HG2  VAL  90          23HG      VAL  90  -0.507  -5.383  -8.014
  676    H    ILE  91           H        ILE  91   0.113  -5.933  -3.309
  677    HA   ILE  91           HA       ILE  91   2.190  -4.452  -1.946
  678    HB   ILE  91           HB       ILE  91  -0.195  -6.107  -1.178
  679   1HG1  ILE  91          11HG      ILE  91   0.602  -3.312  -0.537
  680   2HG1  ILE  91          12HG      ILE  91  -0.538  -3.769  -1.797
  681   1HG2  ILE  91          21HG      ILE  91   1.490  -6.815   0.409
  682   2HG2  ILE  91          22HG      ILE  91   0.273  -5.811   1.197
  683   3HG2  ILE  91          23HG      ILE  91   1.852  -5.133   0.799
  684   1HD1  ILE  91          11HD      ILE  91  -1.638  -2.975   0.090
  685   2HD1  ILE  91          12HD      ILE  91  -0.808  -4.175   1.120
  686   3HD1  ILE  91          13HD      ILE  91  -1.949  -4.708  -0.165
  687    H    GLY  92           H        GLY  92   3.619  -5.716  -0.609
  688   1HA   GLY  92          1HA       GLY  92   3.832  -8.426  -1.548
  689   2HA   GLY  92          2HA       GLY  92   5.276  -7.411  -1.474
  690    H    ARG  93           H        ARG  93   5.004  -9.740  -0.097
  691    HA   ARG  93           HA       ARG  93   5.160  -8.781   2.656
  692   1HB   ARG  93          1HB       ARG  93   3.043  -9.919   2.590
  693   2HB   ARG  93          2HB       ARG  93   3.719 -11.231   1.641
  694   1HG   ARG  93          1HG       ARG  93   3.281 -11.915   3.927
  695   2HG   ARG  93          2HG       ARG  93   4.998 -11.997   3.551
  696   1HD   ARG  93          1HD       ARG  93   4.742 -11.131   5.733
  697   2HD   ARG  93          2HD       ARG  93   5.263  -9.799   4.707
  698    HE   ARG  93           HE       ARG  93   2.707  -9.321   4.682
  699   1HH1  ARG  93          11HH      ARG  93   4.650 -10.463   7.430
  700   2HH1  ARG  93          12HH      ARG  93   3.599  -9.823   8.608
  701   1HH2  ARG  93          21HH      ARG  93   1.268  -8.480   6.311
  702   2HH2  ARG  93          22HH      ARG  93   1.635  -8.705   7.965
  703    H    GLU  94           H        GLU  94   6.888  -9.503   3.699
  704    HA   GLU  94           HA       GLU  94   8.810 -11.028   2.298
  705   1HB   GLU  94          1HB       GLU  94  10.096 -10.815   4.485
  706   2HB   GLU  94          2HB       GLU  94   9.714  -9.312   3.663
  707   1HG   GLU  94          1HG       GLU  94   7.916  -8.887   5.238
  708   2HG   GLU  94          2HG       GLU  94   8.207 -10.447   6.008
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1  14.411 -13.078  -5.570
    2   2H    GLY   1          2H        GLY   1  15.037 -14.647  -5.375
    3   3H    GLY   1          3H        GLY   1  15.927 -13.284  -4.869
    4   1HA   GLY   1          1HA       GLY   1  13.354 -14.147  -3.736
    5   2HA   GLY   1          2HA       GLY   1  14.933 -14.357  -2.989
    6    H    HIS   2           H        HIS   2  13.885 -13.126  -1.270
    7    HA   HIS   2           HA       HIS   2  13.679 -11.359  -0.010
    8   1HB   HIS   2          1HB       HIS   2  15.418 -10.076  -2.081
    9   2HB   HIS   2          2HB       HIS   2  14.704  -9.101  -0.801
   10    HD1  HIS   2           HD1      HIS   2  15.848  -9.149   1.443
   11    HD2  HIS   2           HD2      HIS   2  17.178 -12.126  -1.125
   12    HE1  HIS   2           HE1      HIS   2  17.822 -10.215   2.579
   13    H    MET   3           H        MET   3  11.701 -11.002   0.269
   14    HA   MET   3           HA       MET   3   9.746  -9.975   0.308
   15   1HB   MET   3          1HB       MET   3  11.154  -7.952   0.126
   16   2HB   MET   3          2HB       MET   3  10.946  -7.992  -1.613
   17   1HG   MET   3          1HG       MET   3   8.581  -7.622  -1.397
   18   2HG   MET   3          2HG       MET   3   8.683  -7.707   0.355
   19   1HE   MET   3          1HE       MET   3   7.242  -5.300  -0.958
   20   2HE   MET   3          2HE       MET   3   7.935  -3.933  -0.082
   21   3HE   MET   3          3HE       MET   3   7.535  -5.421   0.775
   22    H    GLU   4           H        GLU   4   8.084 -10.918  -0.463
   23    HA   GLU   4           HA       GLU   4   7.961 -11.691  -3.281
   24   1HB   GLU   4          1HB       GLU   4   7.456 -13.329  -1.481
   25   2HB   GLU   4          2HB       GLU   4   6.126 -12.292  -0.971
   26   1HG   GLU   4          1HG       GLU   4   5.101 -12.650  -3.212
   27   2HG   GLU   4          2HG       GLU   4   6.377 -13.818  -3.549
   28    H    LEU   5           H        LEU   5   7.192 -10.084  -4.553
   29    HA   LEU   5           HA       LEU   5   5.179  -8.277  -3.524
   30   1HB   LEU   5          1HB       LEU   5   6.425  -8.385  -6.279
   31   2HB   LEU   5          2HB       LEU   5   5.396  -7.115  -5.651
   32    HG   LEU   5           HG       LEU   5   7.503  -6.209  -5.591
   33   1HD1  LEU   5          11HD      LEU   5   6.304  -5.895  -3.511
   34   2HD1  LEU   5          12HD      LEU   5   8.063  -5.839  -3.324
   35   3HD1  LEU   5          13HD      LEU   5   7.177  -7.300  -2.872
   36   1HD2  LEU   5          21HD      LEU   5   8.844  -8.192  -6.012
   37   2HD2  LEU   5          22HD      LEU   5   8.595  -8.720  -4.347
   38   3HD2  LEU   5          23HD      LEU   5   9.514  -7.252  -4.680
   39    H    PHE   6           H        PHE   6   3.037  -8.506  -3.896
   40    HA   PHE   6           HA       PHE   6   2.190 -10.268  -6.018
   41   1HB   PHE   6          1HB       PHE   6   0.504 -11.185  -4.355
   42   2HB   PHE   6          2HB       PHE   6   2.129 -11.862  -4.290
   43    HD1  PHE   6           HD1      PHE   6   3.418 -11.464  -2.270
   44    HD2  PHE   6           HD2      PHE   6  -0.417  -9.764  -2.762
   45    HE1  PHE   6           HE1      PHE   6   3.383 -10.922   0.117
   46    HE2  PHE   6           HE2      PHE   6  -0.488  -9.194  -0.353
   47    HZ   PHE   6           HZ       PHE   6   1.425  -9.775   1.090
   48    HA   PRO   7           HA       PRO   7  -0.968  -7.177  -6.466
   49   1HB   PRO   7          1HB       PRO   7  -2.558  -8.454  -8.123
   50   2HB   PRO   7          2HB       PRO   7  -1.004  -7.810  -8.640
   51   1HG   PRO   7          1HG       PRO   7  -1.724 -10.648  -7.945
   52   2HG   PRO   7          2HG       PRO   7  -0.667 -10.065  -9.255
   53   1HD   PRO   7          1HD       PRO   7   0.178 -11.064  -6.831
   54   2HD   PRO   7          2HD       PRO   7   1.119  -9.933  -7.836
   55    H    VAL   8           H        VAL   8  -2.433  -6.728  -5.048
   56    HA   VAL   8           HA       VAL   8  -4.411  -8.742  -4.322
   57    HB   VAL   8           HB       VAL   8  -3.673  -6.242  -2.787
   58   1HG1  VAL   8          11HG      VAL   8  -5.401  -8.551  -1.945
   59   2HG1  VAL   8          12HG      VAL   8  -5.941  -6.924  -2.353
   60   3HG1  VAL   8          13HG      VAL   8  -4.938  -7.187  -0.930
   61   1HG2  VAL   8          21HG      VAL   8  -1.827  -7.746  -2.765
   62   2HG2  VAL   8          22HG      VAL   8  -2.881  -9.069  -2.210
   63   3HG2  VAL   8          23HG      VAL   8  -2.573  -7.677  -1.161
   64    H    GLU   9           H        GLU   9  -6.096  -8.261  -5.728
   65    HA   GLU   9           HA       GLU   9  -6.740  -5.471  -6.104
   66   1HB   GLU   9          1HB       GLU   9  -6.949  -6.983  -8.064
   67   2HB   GLU   9          2HB       GLU   9  -8.138  -7.941  -7.186
   68   1HG   GLU   9          1HG       GLU   9  -9.647  -6.032  -7.113
   69   2HG   GLU   9          2HG       GLU   9  -8.450  -5.047  -7.951
   70    H    LEU  10           H        LEU  10  -7.667  -4.609  -4.381
   71    HA   LEU  10           HA       LEU  10  -9.278  -6.284  -2.622
   72   1HB   LEU  10          1HB       LEU  10  -7.417  -4.592  -1.945
   73   2HB   LEU  10          2HB       LEU  10  -8.623  -3.386  -2.361
   74    HG   LEU  10           HG       LEU  10 -10.114  -4.408  -0.627
   75   1HD1  LEU  10          11HD      LEU  10  -9.092  -5.784   1.086
   76   2HD1  LEU  10          12HD      LEU  10  -7.610  -5.868   0.133
   77   3HD1  LEU  10          13HD      LEU  10  -9.097  -6.587  -0.482
   78   1HD2  LEU  10          21HD      LEU  10  -8.999  -3.342   1.235
   79   2HD2  LEU  10          22HD      LEU  10  -8.871  -2.366  -0.224
   80   3HD2  LEU  10          23HD      LEU  10  -7.484  -3.313   0.329
   81    H    GLU  11           H        GLU  11 -11.452  -5.579  -2.160
   82    HA   GLU  11           HA       GLU  11 -12.431  -3.595  -4.028
   83   1HB   GLU  11          1HB       GLU  11 -13.102  -5.901  -4.761
   84   2HB   GLU  11          2HB       GLU  11 -13.990  -6.067  -3.254
   85   1HG   GLU  11          1HG       GLU  11 -15.473  -4.283  -3.856
   86   2HG   GLU  11          2HG       GLU  11 -14.510  -3.905  -5.282
   87    H    LYS  12           H        LYS  12 -12.034  -2.209  -2.398
   88    HA   LYS  12           HA       LYS  12 -13.158  -2.360   0.099
   89   1HB   LYS  12          1HB       LYS  12 -11.308  -0.785  -1.320
   90   2HB   LYS  12          2HB       LYS  12 -12.511   0.308  -0.644
   91   1HG   LYS  12          1HG       LYS  12 -11.120  -1.824   0.826
   92   2HG   LYS  12          2HG       LYS  12 -10.541  -0.144   0.857
   93   1HD   LYS  12          1HD       LYS  12 -12.835   0.553   1.633
   94   2HD   LYS  12          2HD       LYS  12 -13.225  -1.167   1.825
   95   1HE   LYS  12          1HE       LYS  12 -11.852  -1.303   3.687
   96   2HE   LYS  12          2HE       LYS  12 -11.057   0.248   3.334
   97   1HZ   LYS  12          1HZ       LYS  12 -12.927   0.450   5.042
   98   2HZ   LYS  12          2HZ       LYS  12 -13.981  -0.009   3.795
   99   3HZ   LYS  12          3HZ       LYS  12 -13.119   1.368   3.658
  100    H    ASP  13           H        ASP  13 -14.176   0.146   0.489
  101    HA   ASP  13           HA       ASP  13 -16.920  -0.240  -0.363
  102   1HB   ASP  13          1HB       ASP  13 -15.723   1.566   1.768
  103   2HB   ASP  13          2HB       ASP  13 -17.434   1.266   1.527
  104    H    GLU  14           H        GLU  14 -18.065   2.079  -0.479
  105    HA   GLU  14           HA       GLU  14 -17.154   3.259  -2.882
  106   1HB   GLU  14          1HB       GLU  14 -18.982   4.860  -2.580
  107   2HB   GLU  14          2HB       GLU  14 -19.511   3.216  -2.243
  108   1HG   GLU  14          1HG       GLU  14 -19.279   3.639   0.148
  109   2HG   GLU  14          2HG       GLU  14 -18.764   5.282  -0.198
  110    H    ASP  15           H        ASP  15 -16.436   3.980   0.373
  111    HA   ASP  15           HA       ASP  15 -15.646   6.723   0.167
  112   1HB   ASP  15          1HB       ASP  15 -16.248   5.631   2.282
  113   2HB   ASP  15          2HB       ASP  15 -14.860   4.577   2.126
  114    H    GLY  16           H        GLY  16 -14.164   3.668  -0.319
  115   1HA   GLY  16          1HA       GLY  16 -12.168   3.442  -1.620
  116   2HA   GLY  16          2HA       GLY  16 -11.603   4.965  -0.914
  117    H    LEU  17           H        LEU  17  -9.823   4.243   0.169
  118    HA   LEU  17           HA       LEU  17 -10.152   1.950   1.951
  119   1HB   LEU  17          1HB       LEU  17  -7.730   3.703   1.899
  120   2HB   LEU  17          2HB       LEU  17  -7.879   2.021   2.353
  121    HG   LEU  17           HG       LEU  17  -7.971   3.180  -0.345
  122   1HD1  LEU  17          11HD      LEU  17  -5.978   1.461   1.084
  123   2HD1  LEU  17          12HD      LEU  17  -5.790   3.139   0.559
  124   3HD1  LEU  17          13HD      LEU  17  -5.899   1.849  -0.633
  125   1HD2  LEU  17          21HD      LEU  17  -9.495   1.304  -0.262
  126   2HD2  LEU  17          22HD      LEU  17  -8.259   0.289   0.485
  127   3HD2  LEU  17          23HD      LEU  17  -8.058   0.864  -1.175
  128    H    GLY  18           H        GLY  18  -8.993   5.266   2.184
  129   1HA   GLY  18          1HA       GLY  18  -9.090   6.791   3.858
  130   2HA   GLY  18          2HA       GLY  18 -10.342   5.810   4.625
  131    H    ILE  19           H        ILE  19  -7.171   4.630   3.704
  132    HA   ILE  19           HA       ILE  19  -6.703   4.055   6.539
  133    HB   ILE  19           HB       ILE  19  -5.021   2.468   5.866
  134   1HG1  ILE  19          11HG      ILE  19  -5.505   3.354   3.003
  135   2HG1  ILE  19          12HG      ILE  19  -4.094   3.752   3.984
  136   1HG2  ILE  19          21HG      ILE  19  -7.284   1.661   5.829
  137   2HG2  ILE  19          22HG      ILE  19  -6.409   0.925   4.476
  138   3HG2  ILE  19          23HG      ILE  19  -7.506   2.284   4.205
  139   1HD1  ILE  19          11HD      ILE  19  -4.900   0.974   3.140
  140   2HD1  ILE  19          12HD      ILE  19  -3.487   1.398   4.105
  141   3HD1  ILE  19          13HD      ILE  19  -3.603   1.936   2.430
  142    H    SER  20           H        SER  20  -4.204   3.961   6.976
  143    HA   SER  20           HA       SER  20  -3.082   6.614   6.347
  144   1HB   SER  20          1HB       SER  20  -2.956   5.054   8.931
  145   2HB   SER  20          2HB       SER  20  -2.281   6.652   8.640
  146    HG   SER  20           HG       SER  20  -5.005   6.235   8.174
  147    H    ILE  21           H        ILE  21  -0.869   6.686   6.200
  148    HA   ILE  21           HA       ILE  21   0.497   4.114   5.882
  149    HB   ILE  21           HB       ILE  21   1.742   5.135   4.005
  150   1HG1  ILE  21          11HG      ILE  21   0.360   7.152   2.893
  151   2HG1  ILE  21          12HG      ILE  21  -0.093   7.419   4.553
  152   1HG2  ILE  21          21HG      ILE  21  -1.233   4.972   3.582
  153   2HG2  ILE  21          22HG      ILE  21  -0.078   3.641   3.499
  154   3HG2  ILE  21          23HG      ILE  21  -0.021   4.932   2.301
  155   1HD1  ILE  21          11HD      ILE  21   1.808   8.815   3.898
  156   2HD1  ILE  21          12HD      ILE  21   2.741   7.387   3.528
  157   3HD1  ILE  21          13HD      ILE  21   2.240   7.698   5.182
  158    H    ILE  22           H        ILE  22   2.843   4.381   6.128
  159    HA   ILE  22           HA       ILE  22   3.505   6.851   7.440
  160    HB   ILE  22           HB       ILE  22   3.022   5.325   9.245
  161   1HG1  ILE  22          11HG      ILE  22   6.009   5.766   9.055
  162   2HG1  ILE  22          12HG      ILE  22   4.823   6.966   9.558
  163   1HG2  ILE  22          21HG      ILE  22   4.331   3.291   9.666
  164   2HG2  ILE  22          22HG      ILE  22   5.141   3.527   8.116
  165   3HG2  ILE  22          23HG      ILE  22   3.405   3.208   8.160
  166   1HD1  ILE  22          11HD      ILE  22   4.255   5.618  11.491
  167   2HD1  ILE  22          12HD      ILE  22   5.984   5.971  11.459
  168   3HD1  ILE  22          13HD      ILE  22   5.397   4.379  10.976
  169    H    GLY  23           H        GLY  23   5.317   7.721   6.744
  170   1HA   GLY  23          1HA       GLY  23   6.818   6.219   4.792
  171   2HA   GLY  23          2HA       GLY  23   7.001   7.955   5.097
  172    H    MET  24           H        MET  24   8.230   4.869   5.518
  173    HA   MET  24           HA       MET  24  10.156   5.857   7.519
  174   1HB   MET  24          1HB       MET  24   9.202   3.006   7.153
  175   2HB   MET  24          2HB       MET  24  10.440   3.523   8.277
  176   1HG   MET  24          1HG       MET  24   7.539   4.273   8.345
  177   2HG   MET  24          2HG       MET  24   8.308   3.090   9.389
  178   1HE   MET  24          1HE       MET  24  10.312   3.798  11.140
  179   2HE   MET  24          2HE       MET  24  10.780   5.470  11.452
  180   3HE   MET  24          3HE       MET  24  11.157   4.726   9.901
  181    H    GLY  25           H        GLY  25  11.511   6.593   6.024
  182   1HA   GLY  25          1HA       GLY  25  12.269   5.363   3.646
  183   2HA   GLY  25          2HA       GLY  25  13.245   6.526   4.524
  184    H    VAL  26           H        VAL  26  13.031   3.466   3.423
  185    HA   VAL  26           HA       VAL  26  15.053   2.452   5.280
  186    HB   VAL  26           HB       VAL  26  12.835   1.228   5.149
  187   1HG1  VAL  26          11HG      VAL  26  12.251   1.545   2.885
  188   2HG1  VAL  26          12HG      VAL  26  12.330  -0.182   3.228
  189   3HG1  VAL  26          13HG      VAL  26  13.635   0.600   2.338
  190   1HG2  VAL  26          21HG      VAL  26  15.251  -0.379   4.303
  191   2HG2  VAL  26          22HG      VAL  26  13.764  -1.060   4.959
  192   3HG2  VAL  26          23HG      VAL  26  14.759   0.004   5.954
  193    H    GLY  27           H        GLY  27  15.692   4.215   3.384
  194   1HA   GLY  27          1HA       GLY  27  16.490   3.251   0.857
  195   2HA   GLY  27          2HA       GLY  27  17.098   4.707   1.632
  196    H    ALA  28           H        ALA  28  18.143   2.184   0.201
  197    HA   ALA  28           HA       ALA  28  20.050   1.067  -0.020
  198   1HB   ALA  28          1HB       ALA  28  21.121   2.648   2.288
  199   2HB   ALA  28          2HB       ALA  28  21.144   3.142   0.583
  200   3HB   ALA  28          3HB       ALA  28  22.046   1.711   1.103
  201    H    ASP  29           H        ASP  29  19.161   1.294   3.324
  202    HA   ASP  29           HA       ASP  29  20.420  -1.159   3.989
  203   1HB   ASP  29          1HB       ASP  29  18.571   0.598   5.562
  204   2HB   ASP  29          2HB       ASP  29  19.133  -0.947   6.193
  205    H    ALA  30           H        ALA  30  17.878  -0.814   2.205
  206    HA   ALA  30           HA       ALA  30  16.497  -3.209   3.161
  207   1HB   ALA  30          1HB       ALA  30  14.901  -2.756   1.356
  208   2HB   ALA  30          2HB       ALA  30  15.889  -1.398   0.823
  209   3HB   ALA  30          3HB       ALA  30  15.099  -1.350   2.399
  210    H    GLY  31           H        GLY  31  19.065  -2.308   1.139
  211   1HA   GLY  31          1HA       GLY  31  20.432  -3.625  -0.171
  212   2HA   GLY  31          2HA       GLY  31  19.283  -4.943   0.000
  213    H    LEU  32           H        LEU  32  17.091  -4.096  -0.922
  214    HA   LEU  32           HA       LEU  32  17.418  -4.013  -3.782
  215   1HB   LEU  32          1HB       LEU  32  14.942  -3.962  -2.047
  216   2HB   LEU  32          2HB       LEU  32  14.888  -3.944  -3.789
  217    HG   LEU  32           HG       LEU  32  15.935  -6.221  -3.791
  218   1HD1  LEU  32          11HD      LEU  32  15.970  -7.541  -1.763
  219   2HD1  LEU  32          12HD      LEU  32  15.491  -6.129  -0.825
  220   3HD1  LEU  32          13HD      LEU  32  17.057  -6.157  -1.632
  221   1HD2  LEU  32          21HD      LEU  32  13.369  -5.939  -2.251
  222   2HD2  LEU  32          22HD      LEU  32  13.931  -7.404  -3.053
  223   3HD2  LEU  32          23HD      LEU  32  13.548  -5.971  -4.007
  224    H    GLU  33           H        GLU  33  16.922  -1.719  -1.282
  225    HA   GLU  33           HA       GLU  33  16.146   0.374  -1.080
  226   1HB   GLU  33          1HB       GLU  33  17.121   0.691  -3.894
  227   2HB   GLU  33          2HB       GLU  33  16.810   1.985  -2.757
  228   1HG   GLU  33          1HG       GLU  33  18.579   1.153  -1.330
  229   2HG   GLU  33          2HG       GLU  33  18.934  -0.119  -2.508
  230    H    LYS  34           H        LYS  34  13.986   0.138  -0.889
  231    HA   LYS  34           HA       LYS  34  12.532   0.916  -3.230
  232   1HB   LYS  34          1HB       LYS  34  10.784  -0.710  -3.013
  233   2HB   LYS  34          2HB       LYS  34  12.270  -1.629  -2.937
  234   1HG   LYS  34          1HG       LYS  34  10.639  -0.796  -0.551
  235   2HG   LYS  34          2HG       LYS  34  10.530  -2.363  -1.344
  236   1HD   LYS  34          1HD       LYS  34  12.687  -2.963  -0.677
  237   2HD   LYS  34          2HD       LYS  34  13.114  -1.295  -0.277
  238   1HE   LYS  34          1HE       LYS  34  12.721  -2.470   1.761
  239   2HE   LYS  34          2HE       LYS  34  11.448  -1.291   1.401
  240   1HZ   LYS  34          1HZ       LYS  34   9.901  -2.954   0.929
  241   2HZ   LYS  34          2HZ       LYS  34  10.727  -3.611   2.255
  242   3HZ   LYS  34          3HZ       LYS  34  11.089  -4.136   0.708
  243    H    LEU  35           H        LEU  35  10.143   1.204  -2.230
  244    HA   LEU  35           HA       LEU  35  10.272   3.531  -0.725
  245   1HB   LEU  35          1HB       LEU  35   7.921   3.344  -0.469
  246   2HB   LEU  35          2HB       LEU  35   8.347   2.794  -2.081
  247    HG   LEU  35           HG       LEU  35   8.108   0.737   0.049
  248   1HD1  LEU  35          11HD      LEU  35   5.700   0.609  -0.368
  249   2HD1  LEU  35          12HD      LEU  35   5.801   2.168  -1.204
  250   3HD1  LEU  35          13HD      LEU  35   6.235   2.028   0.508
  251   1HD2  LEU  35          21HD      LEU  35   7.286   0.804  -2.860
  252   2HD2  LEU  35          22HD      LEU  35   7.163  -0.580  -1.771
  253   3HD2  LEU  35          23HD      LEU  35   8.744   0.047  -2.201
  254    H    GLY  36           H        GLY  36   9.512   3.883   1.425
  255   1HA   GLY  36          1HA       GLY  36   9.640   1.537   3.181
  256   2HA   GLY  36          2HA       GLY  36  10.236   3.134   3.644
  257    H    ILE  37           H        ILE  37   7.382   2.771   1.740
  258    HA   ILE  37           HA       ILE  37   5.896   4.104   3.824
  259    HB   ILE  37           HB       ILE  37   4.866   3.275   1.091
  260   1HG1  ILE  37          11HG      ILE  37   6.862   4.866   1.161
  261   2HG1  ILE  37          12HG      ILE  37   5.447   5.458   0.256
  262   1HG2  ILE  37          21HG      ILE  37   3.126   4.954   1.534
  263   2HG2  ILE  37          22HG      ILE  37   3.808   5.205   3.145
  264   3HG2  ILE  37          23HG      ILE  37   3.119   3.646   2.721
  265   1HD1  ILE  37          11HD      ILE  37   6.452   6.196   2.984
  266   2HD1  ILE  37          12HD      ILE  37   4.910   6.748   2.322
  267   3HD1  ILE  37          13HD      ILE  37   6.419   7.221   1.541
  268    H    PHE  38           H        PHE  38   5.321   2.851   5.330
  269    HA   PHE  38           HA       PHE  38   4.245   0.192   4.763
  270   1HB   PHE  38          1HB       PHE  38   5.066   1.544   7.325
  271   2HB   PHE  38          2HB       PHE  38   4.263  -0.018   7.273
  272    HD1  PHE  38           HD1      PHE  38   5.392  -1.963   6.380
  273    HD2  PHE  38           HD2      PHE  38   7.428   1.770   6.733
  274    HE1  PHE  38           HE1      PHE  38   7.544  -3.105   6.154
  275    HE2  PHE  38           HE2      PHE  38   9.554   0.638   6.513
  276    HZ   PHE  38           HZ       PHE  38   9.630  -1.814   6.230
  277    H    VAL  39           H        VAL  39   2.260  -0.434   5.857
  278    HA   VAL  39           HA       VAL  39   0.324   1.665   5.659
  279    HB   VAL  39           HB       VAL  39  -0.060  -1.157   6.725
  280   1HG1  VAL  39          11HG      VAL  39  -2.032   0.885   5.714
  281   2HG1  VAL  39          12HG      VAL  39  -1.837   0.350   7.383
  282   3HG1  VAL  39          13HG      VAL  39  -2.427  -0.773   6.156
  283   1HG2  VAL  39          21HG      VAL  39  -0.488  -0.109   3.929
  284   2HG2  VAL  39          22HG      VAL  39  -0.927  -1.720   4.501
  285   3HG2  VAL  39          23HG      VAL  39   0.770  -1.237   4.435
  286    H    LYS  40           H        LYS  40  -0.212   2.927   7.254
  287    HA   LYS  40           HA       LYS  40   1.058   2.495   9.807
  288   1HB   LYS  40          1HB       LYS  40   1.208   4.716   8.898
  289   2HB   LYS  40          2HB       LYS  40  -0.535   4.811   8.737
  290   1HG   LYS  40          1HG       LYS  40  -0.861   4.800  11.017
  291   2HG   LYS  40          2HG       LYS  40   0.848   4.475  11.372
  292   1HD   LYS  40          1HD       LYS  40   1.360   6.705  10.417
  293   2HD   LYS  40          2HD       LYS  40  -0.380   6.968  10.186
  294   1HE   LYS  40          1HE       LYS  40  -0.737   6.548  12.543
  295   2HE   LYS  40          2HE       LYS  40   0.995   6.365  12.771
  296   1HZ   LYS  40          1HZ       LYS  40  -0.361   8.864  11.882
  297   2HZ   LYS  40          2HZ       LYS  40   1.297   8.670  12.054
  298   3HZ   LYS  40          3HZ       LYS  40   0.309   8.584  13.409
  299    H    THR  41           H        THR  41  -2.208   2.981   8.558
  300    HA   THR  41           HA       THR  41  -3.185   1.399  10.748
  301    HB   THR  41           HB       THR  41  -4.713   3.788  10.126
  302    HG1  THR  41           HG1      THR  41  -2.344   3.674  11.759
  303   1HG2  THR  41          21HG      THR  41  -5.266   3.657  12.557
  304   2HG2  THR  41          22HG      THR  41  -4.211   2.249  12.664
  305   3HG2  THR  41          23HG      THR  41  -5.648   2.203  11.635
  306    H    VAL  42           H        VAL  42  -5.390   0.707  10.161
  307    HA   VAL  42           HA       VAL  42  -6.200   1.357   7.437
  308    HB   VAL  42           HB       VAL  42  -6.461  -1.377   8.798
  309   1HG1  VAL  42          11HG      VAL  42  -7.364  -2.157   6.644
  310   2HG1  VAL  42          12HG      VAL  42  -7.257  -0.500   6.036
  311   3HG1  VAL  42          13HG      VAL  42  -8.352  -0.876   7.364
  312   1HG2  VAL  42          21HG      VAL  42  -4.784  -0.568   6.428
  313   2HG2  VAL  42          22HG      VAL  42  -4.967  -2.210   7.048
  314   3HG2  VAL  42          23HG      VAL  42  -4.181  -0.975   8.033
  315    H    THR  43           H        THR  43  -8.434   1.641   7.247
  316    HA   THR  43           HA       THR  43  -9.879   2.519   9.402
  317    HB   THR  43           HB       THR  43 -10.454   3.116   7.099
  318    HG1  THR  43           HG1      THR  43 -12.207   3.181   8.604
  319   1HG2  THR  43          21HG      THR  43 -11.492   1.504   5.602
  320   2HG2  THR  43          22HG      THR  43 -11.307   0.268   6.860
  321   3HG2  THR  43          23HG      THR  43  -9.875   0.961   6.095
  322    H    GLU  44           H        GLU  44 -11.640   1.608  10.407
  323    HA   GLU  44           HA       GLU  44 -11.116  -0.543  11.975
  324   1HB   GLU  44          1HB       GLU  44 -12.656   1.244  12.443
  325   2HB   GLU  44          2HB       GLU  44 -13.814   0.559  11.316
  326   1HG   GLU  44          1HG       GLU  44 -13.931  -1.447  12.741
  327   2HG   GLU  44          2HG       GLU  44 -12.850  -0.650  13.893
  328    H    GLY  45           H        GLY  45 -13.835  -0.720   9.669
  329   1HA   GLY  45          1HA       GLY  45 -13.107  -3.441   9.122
  330   2HA   GLY  45          2HA       GLY  45 -14.570  -3.259  10.102
  331    H    GLY  46           H        GLY  46 -13.245  -1.529   7.282
  332   1HA   GLY  46          1HA       GLY  46 -15.700  -2.127   5.946
  333   2HA   GLY  46          2HA       GLY  46 -14.407  -1.063   5.375
  334    H    ALA  47           H        ALA  47 -14.623  -2.255   3.532
  335    HA   ALA  47           HA       ALA  47 -14.066  -5.083   3.394
  336   1HB   ALA  47          1HB       ALA  47 -15.573  -4.188   1.833
  337   2HB   ALA  47          2HB       ALA  47 -14.153  -4.681   0.893
  338   3HB   ALA  47          3HB       ALA  47 -14.429  -2.983   1.307
  339    H    ALA  48           H        ALA  48 -11.970  -3.606   4.522
  340    HA   ALA  48           HA       ALA  48  -9.712  -4.357   2.782
  341   1HB   ALA  48          1HB       ALA  48  -8.336  -2.751   4.082
  342   2HB   ALA  48          2HB       ALA  48  -9.771  -2.263   4.981
  343   3HB   ALA  48          3HB       ALA  48  -9.664  -1.944   3.250
  344    H    GLN  49           H        GLN  49 -10.321  -3.758   6.282
  345    HA   GLN  49           HA       GLN  49  -8.824  -6.083   6.962
  346   1HB   GLN  49          1HB       GLN  49 -10.575  -4.335   8.693
  347   2HB   GLN  49          2HB       GLN  49  -9.648  -5.693   9.311
  348   1HG   GLN  49          1HG       GLN  49  -7.593  -4.579   8.413
  349   2HG   GLN  49          2HG       GLN  49  -8.600  -3.178   8.055
  350   1HE2  GLN  49          21HE      GLN  49  -9.402  -1.952   9.761
  351   2HE2  GLN  49          22HE      GLN  49  -8.802  -2.103  11.353
  352    H    ARG  50           H        ARG  50 -12.199  -5.480   6.342
  353    HA   ARG  50           HA       ARG  50 -13.103  -7.956   7.356
  354   1HB   ARG  50          1HB       ARG  50 -14.221  -6.070   5.309
  355   2HB   ARG  50          2HB       ARG  50 -14.972  -7.625   5.606
  356   1HG   ARG  50          1HG       ARG  50 -14.499  -5.568   7.738
  357   2HG   ARG  50          2HG       ARG  50 -15.992  -5.668   6.800
  358   1HD   ARG  50          1HD       ARG  50 -16.344  -6.809   8.885
  359   2HD   ARG  50          2HD       ARG  50 -16.237  -8.031   7.627
  360    HE   ARG  50           HE       ARG  50 -14.030  -7.346   9.448
  361   1HH1  ARG  50          11HH      ARG  50 -15.846  -9.824   7.637
  362   2HH1  ARG  50          12HH      ARG  50 -14.933 -11.103   8.286
  363   1HH2  ARG  50          21HH      ARG  50 -12.849  -9.116  10.305
  364   2HH2  ARG  50          22HH      ARG  50 -13.226 -10.714   9.869
  365    H    ASP  51           H        ASP  51 -11.467  -6.982   4.506
  366    HA   ASP  51           HA       ASP  51 -12.026  -9.359   3.010
  367   1HB   ASP  51          1HB       ASP  51 -11.295  -7.204   1.967
  368   2HB   ASP  51          2HB       ASP  51  -9.704  -7.459   2.677
  369    H    GLY  52           H        GLY  52  -9.089  -8.149   4.598
  370   1HA   GLY  52          1HA       GLY  52  -7.891  -9.400   6.217
  371   2HA   GLY  52          2HA       GLY  52  -8.651 -10.856   5.607
  372    H    ARG  53           H        ARG  53  -7.870  -9.867   2.750
  373    HA   ARG  53           HA       ARG  53  -5.432 -11.370   2.726
  374   1HB   ARG  53          1HB       ARG  53  -7.339 -11.041   0.841
  375   2HB   ARG  53          2HB       ARG  53  -6.276  -9.728   0.373
  376   1HG   ARG  53          1HG       ARG  53  -5.218 -12.511   0.664
  377   2HG   ARG  53          2HG       ARG  53  -6.020 -11.977  -0.806
  378   1HD   ARG  53          1HD       ARG  53  -4.391 -10.261  -1.142
  379   2HD   ARG  53          2HD       ARG  53  -3.684 -10.562   0.443
  380    HE   ARG  53           HE       ARG  53  -2.923 -12.651  -0.341
  381   1HH1  ARG  53          11HH      ARG  53  -4.234 -10.692  -2.978
  382   2HH1  ARG  53          12HH      ARG  53  -3.080 -11.147  -4.137
  383   1HH2  ARG  53          21HH      ARG  53  -1.324 -13.343  -1.936
  384   2HH2  ARG  53          22HH      ARG  53  -1.405 -12.750  -3.527
  385    H    ILE  54           H        ILE  54  -6.254  -8.109   3.030
  386    HA   ILE  54           HA       ILE  54  -3.488  -7.269   2.544
  387    HB   ILE  54           HB       ILE  54  -5.502  -6.094   1.383
  388   1HG1  ILE  54          11HG      ILE  54  -3.671  -4.338   3.027
  389   2HG1  ILE  54          12HG      ILE  54  -3.181  -5.164   1.553
  390   1HG2  ILE  54          21HG      ILE  54  -5.804  -5.054   4.187
  391   2HG2  ILE  54          22HG      ILE  54  -7.018  -5.934   3.253
  392   3HG2  ILE  54          23HG      ILE  54  -6.558  -4.290   2.784
  393   1HD1  ILE  54          11HD      ILE  54  -3.691  -2.924   0.993
  394   2HD1  ILE  54          12HD      ILE  54  -5.254  -3.009   1.835
  395   3HD1  ILE  54          13HD      ILE  54  -5.004  -3.927   0.366
  396    H    GLN  55           H        GLN  55  -2.416  -6.111   4.298
  397    HA   GLN  55           HA       GLN  55  -3.841  -6.335   6.833
  398   1HB   GLN  55          1HB       GLN  55  -0.964  -7.045   6.254
  399   2HB   GLN  55          2HB       GLN  55  -1.627  -6.916   7.870
  400   1HG   GLN  55          1HG       GLN  55  -2.695  -8.813   5.798
  401   2HG   GLN  55          2HG       GLN  55  -1.422  -9.237   6.942
  402   1HE2  GLN  55          21HE      GLN  55  -4.777  -8.402   6.587
  403   2HE2  GLN  55          22HE      GLN  55  -5.283  -9.004   8.119
  404    H    VAL  56           H        VAL  56  -2.848  -4.989   8.578
  405    HA   VAL  56           HA       VAL  56  -2.141  -2.330   7.646
  406    HB   VAL  56           HB       VAL  56  -3.686  -2.755   9.619
  407   1HG1  VAL  56          11HG      VAL  56  -2.559  -4.596  10.674
  408   2HG1  VAL  56          12HG      VAL  56  -2.699  -3.261  11.818
  409   3HG1  VAL  56          13HG      VAL  56  -1.159  -3.588  11.025
  410   1HG2  VAL  56          21HG      VAL  56  -1.246  -1.062  10.205
  411   2HG2  VAL  56          22HG      VAL  56  -2.771  -0.952  11.072
  412   3HG2  VAL  56          23HG      VAL  56  -2.702  -0.515   9.377
  413    H    ASN  57           H        ASN  57  -0.545  -5.114   8.229
  414    HA   ASN  57           HA       ASN  57   1.887  -3.858   9.271
  415   1HB   ASN  57          1HB       ASN  57   0.933  -5.783  10.511
  416   2HB   ASN  57          2HB       ASN  57   1.095  -6.780   9.081
  417   1HD2  ASN  57          21HD      ASN  57   2.819  -5.095  11.607
  418   2HD2  ASN  57          22HD      ASN  57   4.281  -6.006  11.462
  419    H    ASP  58           H        ASP  58   0.703  -3.928   6.479
  420    HA   ASP  58           HA       ASP  58   2.874  -5.276   5.075
  421   1HB   ASP  58          1HB       ASP  58   0.191  -4.316   4.071
  422   2HB   ASP  58          2HB       ASP  58   1.474  -4.922   3.035
  423    H    GLN  59           H        GLN  59   3.190  -4.060   2.848
  424    HA   GLN  59           HA       GLN  59   3.676  -1.229   3.396
  425   1HB   GLN  59          1HB       GLN  59   5.785  -2.428   3.672
  426   2HB   GLN  59          2HB       GLN  59   5.529  -3.265   2.148
  427   1HG   GLN  59          1HG       GLN  59   5.904  -1.271   0.907
  428   2HG   GLN  59          2HG       GLN  59   5.897  -0.288   2.370
  429   1HE2  GLN  59          21HE      GLN  59   7.687  -0.273   3.659
  430   2HE2  GLN  59          22HE      GLN  59   9.220  -0.900   3.174
  431    H    ILE  60           H        ILE  60   2.828   0.040   1.781
  432    HA   ILE  60           HA       ILE  60   1.420  -1.252  -0.374
  433    HB   ILE  60           HB       ILE  60   1.846   1.719   0.018
  434   1HG1  ILE  60          11HG      ILE  60   0.676   0.878   2.006
  435   2HG1  ILE  60          12HG      ILE  60  -0.409   1.767   0.926
  436   1HG2  ILE  60          21HG      ILE  60  -0.231   0.201  -1.504
  437   2HG2  ILE  60          22HG      ILE  60   1.190   0.944  -2.203
  438   3HG2  ILE  60          23HG      ILE  60  -0.063   1.964  -1.465
  439   1HD1  ILE  60          11HD      ILE  60  -1.347  -0.311   0.109
  440   2HD1  ILE  60          12HD      ILE  60  -1.497  -0.201   1.861
  441   3HD1  ILE  60          13HD      ILE  60  -0.253  -1.227   1.149
  442    H    VAL  61           H        VAL  61   2.855  -2.080  -1.828
  443    HA   VAL  61           HA       VAL  61   5.212  -0.614  -2.590
  444    HB   VAL  61           HB       VAL  61   4.099  -3.192  -3.702
  445   1HG1  VAL  61          11HG      VAL  61   6.865  -2.030  -3.975
  446   2HG1  VAL  61          12HG      VAL  61   5.641  -2.176  -5.247
  447   3HG1  VAL  61          13HG      VAL  61   6.327  -3.628  -4.517
  448   1HG2  VAL  61          21HG      VAL  61   6.193  -2.734  -1.590
  449   2HG2  VAL  61          22HG      VAL  61   5.720  -4.296  -2.266
  450   3HG2  VAL  61          23HG      VAL  61   4.559  -3.351  -1.341
  451    H    GLU  62           H        GLU  62   2.184  -1.487  -4.124
  452    HA   GLU  62           HA       GLU  62   2.481   0.723  -5.990
  453   1HB   GLU  62          1HB       GLU  62   3.511  -1.242  -7.118
  454   2HB   GLU  62          2HB       GLU  62   2.004  -2.108  -6.849
  455   1HG   GLU  62          1HG       GLU  62   0.819  -0.567  -8.282
  456   2HG   GLU  62          2HG       GLU  62   2.297   0.359  -8.527
  457    H    VAL  63           H        VAL  63   0.508   1.697  -6.092
  458    HA   VAL  63           HA       VAL  63  -1.782  -0.044  -5.788
  459    HB   VAL  63           HB       VAL  63  -1.323   2.672  -4.500
  460   1HG1  VAL  63          11HG      VAL  63  -3.739   2.950  -4.214
  461   2HG1  VAL  63          12HG      VAL  63  -4.035   1.561  -5.272
  462   3HG1  VAL  63          13HG      VAL  63  -3.278   3.028  -5.921
  463   1HG2  VAL  63          21HG      VAL  63  -2.790   0.198  -3.710
  464   2HG2  VAL  63          22HG      VAL  63  -2.418   1.596  -2.693
  465   3HG2  VAL  63          23HG      VAL  63  -1.118   0.574  -3.316
  466    H    ASP  64           H        ASP  64  -2.985  -0.154  -7.440
  467    HA   ASP  64           HA       ASP  64  -4.239   0.351  -9.251
  468   1HB   ASP  64          1HB       ASP  64  -4.813   2.415  -7.965
  469   2HB   ASP  64          2HB       ASP  64  -3.470   3.242  -8.734
  470    H    GLY  65           H        GLY  65  -1.163   0.324  -9.186
  471   1HA   GLY  65          1HA       GLY  65   0.356  -0.085 -10.933
  472   2HA   GLY  65          2HA       GLY  65  -0.819   0.598 -12.053
  473    H    ILE  66           H        ILE  66  -0.368   2.549  -9.316
  474    HA   ILE  66           HA       ILE  66   0.861   4.591 -10.898
  475    HB   ILE  66           HB       ILE  66  -0.886   4.812  -8.866
  476   1HG1  ILE  66          11HG      ILE  66   1.430   6.735  -9.178
  477   2HG1  ILE  66          12HG      ILE  66   0.064   6.638 -10.283
  478   1HG2  ILE  66          21HG      ILE  66   1.763   4.964  -7.452
  479   2HG2  ILE  66          22HG      ILE  66   0.514   3.743  -7.201
  480   3HG2  ILE  66          23HG      ILE  66   0.201   5.433  -6.774
  481   1HD1  ILE  66          11HD      ILE  66  -0.034   7.359  -7.380
  482   2HD1  ILE  66          12HD      ILE  66  -1.429   7.213  -8.443
  483   3HD1  ILE  66          13HD      ILE  66  -0.222   8.476  -8.737
  484    H    SER  67           H        SER  67   2.025   2.042  -9.106
  485    HA   SER  67           HA       SER  67   3.871   1.529  -7.866
  486   1HB   SER  67          1HB       SER  67   5.025   2.720 -10.316
  487   2HB   SER  67          2HB       SER  67   5.778   1.405  -9.365
  488    HG   SER  67           HG       SER  67   4.111   0.024 -10.121
  489    H    LEU  68           H        LEU  68   3.693   2.930  -6.160
  490    HA   LEU  68           HA       LEU  68   5.079   5.421  -6.321
  491   1HB   LEU  68          1HB       LEU  68   3.999   5.939  -4.208
  492   2HB   LEU  68          2HB       LEU  68   2.868   5.438  -5.425
  493    HG   LEU  68           HG       LEU  68   2.001   4.586  -3.546
  494   1HD1  LEU  68          11HD      LEU  68   1.895   2.888  -5.093
  495   2HD1  LEU  68          12HD      LEU  68   1.952   2.311  -3.441
  496   3HD1  LEU  68          13HD      LEU  68   3.385   2.164  -4.441
  497   1HD2  LEU  68          21HD      LEU  68   3.150   3.389  -1.717
  498   2HD2  LEU  68          22HD      LEU  68   3.701   5.053  -1.938
  499   3HD2  LEU  68          23HD      LEU  68   4.687   3.716  -2.526
  500    H    VAL  69           H        VAL  69   6.611   3.091  -6.470
  501    HA   VAL  69           HA       VAL  69   7.931   2.551  -4.014
  502    HB   VAL  69           HB       VAL  69   8.956   2.120  -6.835
  503   1HG1  VAL  69          11HG      VAL  69   9.776   0.840  -4.233
  504   2HG1  VAL  69          12HG      VAL  69  10.726   1.984  -5.182
  505   3HG1  VAL  69          13HG      VAL  69  10.377   0.382  -5.826
  506   1HG2  VAL  69          21HG      VAL  69   7.409   0.225  -5.063
  507   2HG2  VAL  69          22HG      VAL  69   8.127  -0.187  -6.620
  508   3HG2  VAL  69          23HG      VAL  69   6.818   0.990  -6.537
  509    H    GLY  70           H        GLY  70   8.861   4.258  -3.027
  510   1HA   GLY  70          1HA       GLY  70  10.969   5.393  -2.788
  511   2HA   GLY  70          2HA       GLY  70  10.976   5.638  -4.528
  512    H    VAL  71           H        VAL  71   7.944   6.189  -3.051
  513    HA   VAL  71           HA       VAL  71   8.390   9.047  -3.386
  514    HB   VAL  71           HB       VAL  71   6.000   9.349  -3.361
  515   1HG1  VAL  71          11HG      VAL  71   6.755   7.015  -5.092
  516   2HG1  VAL  71          12HG      VAL  71   6.959   8.725  -5.482
  517   3HG1  VAL  71          13HG      VAL  71   5.341   8.044  -5.318
  518   1HG2  VAL  71          21HG      VAL  71   4.424   7.511  -3.065
  519   2HG2  VAL  71          22HG      VAL  71   5.443   7.688  -1.640
  520   3HG2  VAL  71          23HG      VAL  71   5.760   6.389  -2.791
  521    H    THR  72           H        THR  72   6.967  10.379  -1.794
  522    HA   THR  72           HA       THR  72   7.865   9.716   0.879
  523    HB   THR  72           HB       THR  72   6.855  12.007   1.296
  524    HG1  THR  72           HG1      THR  72   7.190  12.491  -1.438
  525   1HG2  THR  72          21HG      THR  72   9.260  11.700   1.167
  526   2HG2  THR  72          22HG      THR  72   8.830  13.185   0.317
  527   3HG2  THR  72          23HG      THR  72   9.210  11.722  -0.593
  528    H    GLN  73           H        GLN  73   6.328  10.382   2.575
  529    HA   GLN  73           HA       GLN  73   4.142   8.664   2.522
  530   1HB   GLN  73          1HB       GLN  73   3.703   9.317   4.749
  531   2HB   GLN  73          2HB       GLN  73   5.416   9.625   4.570
  532   1HG   GLN  73          1HG       GLN  73   3.259  11.674   4.336
  533   2HG   GLN  73          2HG       GLN  73   4.202  11.387   5.797
  534   1HE2  GLN  73          21HE      GLN  73   6.702  10.965   4.426
  535   2HE2  GLN  73          22HE      GLN  73   7.178  12.500   3.823
  536    H    ASN  74           H        ASN  74   4.399  12.060   1.706
  537    HA   ASN  74           HA       ASN  74   1.591  12.486   1.785
  538   1HB   ASN  74          1HB       ASN  74   2.025  14.684   0.775
  539   2HB   ASN  74          2HB       ASN  74   3.077  14.387   2.153
  540   1HD2  ASN  74          21HD      ASN  74   5.266  14.328   1.828
  541   2HD2  ASN  74          22HD      ASN  74   5.975  14.660   0.286
  542    H    PHE  75           H        PHE  75   3.833  11.542  -0.734
  543    HA   PHE  75           HA       PHE  75   1.932  11.836  -2.821
  544   1HB   PHE  75          1HB       PHE  75   4.409  11.539  -3.236
  545   2HB   PHE  75          2HB       PHE  75   4.218   9.873  -2.699
  546    HD1  PHE  75           HD1      PHE  75   2.786   8.278  -4.068
  547    HD2  PHE  75           HD2      PHE  75   3.840  12.166  -5.461
  548    HE1  PHE  75           HE1      PHE  75   2.197   7.604  -6.320
  549    HE2  PHE  75           HE2      PHE  75   3.244  11.487  -7.755
  550    HZ   PHE  75           HZ       PHE  75   2.427   9.209  -8.194
  551    H    ALA  76           H        ALA  76   3.056   9.129  -0.829
  552    HA   ALA  76           HA       ALA  76   1.385   7.178  -1.876
  553   1HB   ALA  76          1HB       ALA  76   2.435   7.377   0.936
  554   2HB   ALA  76          2HB       ALA  76   3.306   6.726  -0.458
  555   3HB   ALA  76          3HB       ALA  76   1.845   5.921   0.125
  556    H    ALA  77           H        ALA  77   0.835   9.281   0.968
  557    HA   ALA  77           HA       ALA  77  -1.649   8.284   1.704
  558   1HB   ALA  77          1HB       ALA  77  -0.699  11.142   1.906
  559   2HB   ALA  77          2HB       ALA  77  -0.359   9.865   3.073
  560   3HB   ALA  77          3HB       ALA  77  -2.015  10.422   2.833
  561    H    THR  78           H        THR  78  -0.818  10.640  -0.749
  562    HA   THR  78           HA       THR  78  -3.412  11.446  -1.432
  563    HB   THR  78           HB       THR  78  -0.857  11.338  -3.048
  564    HG1  THR  78           HG1      THR  78  -0.485  12.803  -1.586
  565   1HG2  THR  78          21HG      THR  78  -1.927  12.980  -4.564
  566   2HG2  THR  78          22HG      THR  78  -3.444  12.801  -3.671
  567   3HG2  THR  78          23HG      THR  78  -2.771  11.429  -4.558
  568    H    VAL  79           H        VAL  79  -1.377   8.838  -2.733
  569    HA   VAL  79           HA       VAL  79  -3.217   7.946  -4.675
  570    HB   VAL  79           HB       VAL  79  -1.152   6.191  -3.290
  571   1HG1  VAL  79          11HG      VAL  79  -2.441   5.980  -5.996
  572   2HG1  VAL  79          12HG      VAL  79  -2.860   5.045  -4.575
  573   3HG1  VAL  79          13HG      VAL  79  -1.257   4.865  -5.296
  574   1HG2  VAL  79          21HG      VAL  79  -0.103   8.207  -4.132
  575   2HG2  VAL  79          22HG      VAL  79  -0.902   7.988  -5.683
  576   3HG2  VAL  79          23HG      VAL  79   0.320   6.822  -5.144
  577    H    LEU  80           H        LEU  80  -2.526   6.759  -1.404
  578    HA   LEU  80           HA       LEU  80  -4.566   4.788  -1.386
  579   1HB   LEU  80          1HB       LEU  80  -2.968   6.018   0.863
  580   2HB   LEU  80          2HB       LEU  80  -4.189   4.806   1.159
  581    HG   LEU  80           HG       LEU  80  -2.041   3.754   1.232
  582   1HD1  LEU  80          11HD      LEU  80  -2.198   2.056  -0.478
  583   2HD1  LEU  80          12HD      LEU  80  -3.380   3.042  -1.340
  584   3HD1  LEU  80          13HD      LEU  80  -3.755   2.416   0.267
  585   1HD2  LEU  80          21HD      LEU  80  -0.466   3.713  -0.623
  586   2HD2  LEU  80          22HD      LEU  80  -0.755   5.365  -0.070
  587   3HD2  LEU  80          23HD      LEU  80  -1.527   4.783  -1.542
  588    H    ARG  81           H        ARG  81  -4.806   8.040  -1.232
  589    HA   ARG  81           HA       ARG  81  -7.275   8.278   0.340
  590   1HB   ARG  81          1HB       ARG  81  -5.649  10.094   0.381
  591   2HB   ARG  81          2HB       ARG  81  -5.684  10.195  -1.366
  592   1HG   ARG  81          1HG       ARG  81  -8.147  10.811  -1.109
  593   2HG   ARG  81          2HG       ARG  81  -7.770  11.066   0.601
  594   1HD   ARG  81          1HD       ARG  81  -5.925  12.592  -0.091
  595   2HD   ARG  81          2HD       ARG  81  -6.450  12.346  -1.761
  596    HE   ARG  81           HE       ARG  81  -8.624  13.241  -0.240
  597   1HH1  ARG  81          11HH      ARG  81  -5.576  14.519  -1.564
  598   2HH1  ARG  81          12HH      ARG  81  -6.167  16.108  -1.712
  599   1HH2  ARG  81          21HH      ARG  81  -9.376  15.442  -0.411
  600   2HH2  ARG  81          22HH      ARG  81  -8.337  16.650  -1.016
  601    H    ASN  82           H        ASN  82  -6.073   8.538  -2.938
  602    HA   ASN  82           HA       ASN  82  -8.587   9.209  -4.099
  603   1HB   ASN  82          1HB       ASN  82  -5.819   8.934  -5.059
  604   2HB   ASN  82          2HB       ASN  82  -7.089   8.760  -6.258
  605   1HD2  ASN  82          21HD      ASN  82  -5.571  10.893  -3.980
  606   2HD2  ASN  82          22HD      ASN  82  -6.340  12.333  -4.575
  607    H    THR  83           H        THR  83  -7.608   6.426  -3.006
  608    HA   THR  83           HA       THR  83  -8.100   4.479  -4.943
  609    HB   THR  83           HB       THR  83  -8.664   3.096  -2.895
  610    HG1  THR  83           HG1      THR  83  -9.068   5.422  -1.892
  611   1HG2  THR  83          21HG      THR  83  -6.412   3.206  -3.881
  612   2HG2  THR  83          22HG      THR  83  -6.316   3.153  -2.122
  613   3HG2  THR  83          23HG      THR  83  -6.084   4.680  -2.971
  614    H    LYS  84           H        LYS  84  -9.863   3.168  -5.266
  615    HA   LYS  84           HA       LYS  84 -12.497   4.190  -4.501
  616   1HB   LYS  84          1HB       LYS  84 -11.501   2.995  -7.096
  617   2HB   LYS  84          2HB       LYS  84 -13.207   3.080  -6.706
  618   1HG   LYS  84          1HG       LYS  84 -11.365   5.446  -6.890
  619   2HG   LYS  84          2HG       LYS  84 -12.483   4.911  -8.153
  620   1HD   LYS  84          1HD       LYS  84 -14.350   5.183  -6.598
  621   2HD   LYS  84          2HD       LYS  84 -13.243   5.763  -5.360
  622   1HE   LYS  84          1HE       LYS  84 -12.642   7.642  -6.736
  623   2HE   LYS  84          2HE       LYS  84 -13.696   7.057  -8.028
  624   1HZ   LYS  84          1HZ       LYS  84 -15.566   7.251  -6.476
  625   2HZ   LYS  84          2HZ       LYS  84 -14.847   8.733  -6.799
  626   3HZ   LYS  84          3HZ       LYS  84 -14.550   7.946  -5.326
  627    H    GLY  85           H        GLY  85 -13.893   1.995  -5.449
  628   1HA   GLY  85          1HA       GLY  85 -13.692   0.128  -3.390
  629   2HA   GLY  85          2HA       GLY  85 -14.529  -0.147  -4.913
  630    H    ASN  86           H        ASN  86 -12.954  -0.583  -6.785
  631    HA   ASN  86           HA       ASN  86 -11.310  -2.776  -5.861
  632   1HB   ASN  86          1HB       ASN  86 -12.032  -1.938  -8.675
  633   2HB   ASN  86          2HB       ASN  86 -10.968  -3.297  -8.304
  634   1HD2  ASN  86          21HD      ASN  86 -11.872  -5.178  -7.362
  635   2HD2  ASN  86          22HD      ASN  86 -13.584  -5.420  -7.322
  636    H    VAL  87           H        VAL  87  -9.330  -2.663  -5.430
  637    HA   VAL  87           HA       VAL  87  -7.655  -0.551  -6.651
  638    HB   VAL  87           HB       VAL  87  -7.227  -1.534  -3.881
  639   1HG1  VAL  87          11HG      VAL  87  -6.432   0.991  -5.270
  640   2HG1  VAL  87          12HG      VAL  87  -5.428  -0.413  -4.880
  641   3HG1  VAL  87          13HG      VAL  87  -6.085   0.586  -3.581
  642   1HG2  VAL  87          21HG      VAL  87  -8.419   0.458  -3.014
  643   2HG2  VAL  87          22HG      VAL  87  -9.413  -0.790  -3.763
  644   3HG2  VAL  87          23HG      VAL  87  -9.077   0.705  -4.647
  645    H    ARG  88           H        ARG  88  -5.871  -1.412  -7.514
  646    HA   ARG  88           HA       ARG  88  -5.076  -4.118  -6.757
  647   1HB   ARG  88          1HB       ARG  88  -4.288  -2.314  -9.009
  648   2HB   ARG  88          2HB       ARG  88  -3.448  -3.821  -8.651
  649   1HG   ARG  88          1HG       ARG  88  -5.412  -5.088  -8.992
  650   2HG   ARG  88          2HG       ARG  88  -6.397  -3.628  -9.164
  651   1HD   ARG  88          1HD       ARG  88  -5.897  -4.651 -11.293
  652   2HD   ARG  88          2HD       ARG  88  -5.198  -3.031 -11.134
  653    HE   ARG  88           HE       ARG  88  -3.060  -4.134 -10.677
  654   1HH1  ARG  88          11HH      ARG  88  -5.541  -6.069 -12.371
  655   2HH1  ARG  88          12HH      ARG  88  -4.433  -6.980 -13.260
  656   1HH2  ARG  88          21HH      ARG  88  -1.524  -5.465 -11.890
  657   2HH2  ARG  88          22HH      ARG  88  -2.099  -6.660 -12.945
  658    H    PHE  89           H        PHE  89  -4.096  -4.058  -4.929
  659    HA   PHE  89           HA       PHE  89  -1.887  -2.207  -4.436
  660   1HB   PHE  89          1HB       PHE  89  -3.026  -4.429  -2.717
  661   2HB   PHE  89          2HB       PHE  89  -1.812  -3.272  -2.240
  662    HD1  PHE  89           HD1      PHE  89  -5.332  -3.860  -2.791
  663    HD2  PHE  89           HD2      PHE  89  -2.377  -1.038  -1.691
  664    HE1  PHE  89           HE1      PHE  89  -7.062  -2.413  -1.799
  665    HE2  PHE  89           HE2      PHE  89  -4.102   0.414  -0.732
  666    HZ   PHE  89           HZ       PHE  89  -6.455  -0.307  -0.777
  667    H    VAL  90           H        VAL  90  -0.012  -2.945  -5.333
  668    HA   VAL  90           HA       VAL  90   0.279  -5.854  -5.421
  669    HB   VAL  90           HB       VAL  90   2.142  -3.946  -6.881
  670   1HG1  VAL  90          11HG      VAL  90   1.572  -6.867  -7.272
  671   2HG1  VAL  90          12HG      VAL  90   3.019  -6.168  -6.549
  672   3HG1  VAL  90          13HG      VAL  90   2.662  -5.886  -8.253
  673   1HG2  VAL  90          21HG      VAL  90  -0.150  -3.550  -7.656
  674   2HG2  VAL  90          22HG      VAL  90  -0.337  -5.283  -7.965
  675   3HG2  VAL  90          23HG      VAL  90   0.820  -4.338  -8.904
  676    H    ILE  91           H        ILE  91   0.433  -5.527  -3.215
  677    HA   ILE  91           HA       ILE  91   2.671  -4.320  -1.930
  678    HB   ILE  91           HB       ILE  91   0.329  -6.001  -1.056
  679   1HG1  ILE  91          11HG      ILE  91   1.061  -3.158  -0.460
  680   2HG1  ILE  91          12HG      ILE  91  -0.076  -3.643  -1.705
  681   1HG2  ILE  91          21HG      ILE  91   2.161  -6.579   0.456
  682   2HG2  ILE  91          22HG      ILE  91   0.887  -5.675   1.266
  683   3HG2  ILE  91          23HG      ILE  91   2.394  -4.866   0.826
  684   1HD1  ILE  91          11HD      ILE  91  -1.489  -4.610  -0.003
  685   2HD1  ILE  91          12HD      ILE  91  -1.205  -2.875   0.214
  686   3HD1  ILE  91          13HD      ILE  91  -0.357  -4.049   1.245
  687    H    GLY  92           H        GLY  92   4.179  -5.490  -0.720
  688   1HA   GLY  92          1HA       GLY  92   4.394  -8.262  -1.500
  689   2HA   GLY  92          2HA       GLY  92   5.804  -7.200  -1.586
  690    H    ARG  93           H        ARG  93   5.423  -9.514   0.063
  691    HA   ARG  93           HA       ARG  93   5.484  -8.243   2.709
  692   1HB   ARG  93          1HB       ARG  93   3.821 -10.211   1.963
  693   2HB   ARG  93          2HB       ARG  93   5.208 -11.208   2.371
  694   1HG   ARG  93          1HG       ARG  93   3.762  -9.303   4.212
  695   2HG   ARG  93          2HG       ARG  93   3.613 -11.054   4.207
  696   1HD   ARG  93          1HD       ARG  93   5.984 -11.233   4.826
  697   2HD   ARG  93          2HD       ARG  93   6.103  -9.474   4.835
  698    HE   ARG  93           HE       ARG  93   4.021 -10.100   6.487
  699   1HH1  ARG  93          11HH      ARG  93   7.587 -10.539   6.485
  700   2HH1  ARG  93          12HH      ARG  93   7.649 -10.853   8.136
  701   1HH2  ARG  93          21HH      ARG  93   4.189 -10.504   8.760
  702   2HH2  ARG  93          22HH      ARG  93   5.697 -10.816   9.490
  703    H    GLU  94           H        GLU  94   7.398  -8.352   3.778
  704    HA   GLU  94           HA       GLU  94   9.597  -9.706   2.464
  705   1HB   GLU  94          1HB       GLU  94   9.602  -7.763   4.791
  706   2HB   GLU  94          2HB       GLU  94  11.029  -8.426   4.013
  707   1HG   GLU  94          1HG       GLU  94  10.232  -7.354   1.884
  708   2HG   GLU  94          2HG       GLU  94   9.011  -6.536   2.850
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1  15.969  -6.623  -2.352
    2   2H    GLY   1          2H        GLY   1  16.763  -6.693  -3.823
    3   3H    GLY   1          3H        GLY   1  17.656  -6.559  -2.396
    4   1HA   GLY   1          1HA       GLY   1  17.697  -8.837  -3.268
    5   2HA   GLY   1          2HA       GLY   1  16.861  -8.742  -1.714
    6    H    HIS   2           H        HIS   2  15.613 -10.614  -2.220
    7    HA   HIS   2           HA       HIS   2  13.762 -10.237  -4.422
    8   1HB   HIS   2          1HB       HIS   2  13.015 -12.522  -4.106
    9   2HB   HIS   2          2HB       HIS   2  14.765 -12.525  -4.081
   10    HD1  HIS   2           HD1      HIS   2  11.886 -13.782  -2.246
   11    HD2  HIS   2           HD2      HIS   2  15.797 -12.721  -1.329
   12    HE1  HIS   2           HE1      HIS   2  12.390 -14.842  -0.042
   13    H    MET   3           H        MET   3  11.461 -10.552  -4.012
   14    HA   MET   3           HA       MET   3  10.387 -10.328  -1.374
   15   1HB   MET   3          1HB       MET   3  11.225  -7.976  -1.922
   16   2HB   MET   3          2HB       MET   3  10.114  -7.977  -3.275
   17   1HG   MET   3          1HG       MET   3   8.246  -8.026  -1.853
   18   2HG   MET   3          2HG       MET   3   9.237  -8.287  -0.398
   19   1HE   MET   3          1HE       MET   3   7.183  -6.047  -0.108
   20   2HE   MET   3          2HE       MET   3   8.148  -4.659   0.393
   21   3HE   MET   3          3HE       MET   3   8.496  -6.259   1.050
   22    H    GLU   4           H        GLU   4   8.278 -11.074  -1.510
   23    HA   GLU   4           HA       GLU   4   7.507 -11.822  -4.202
   24   1HB   GLU   4          1HB       GLU   4   7.362 -13.554  -2.442
   25   2HB   GLU   4          2HB       GLU   4   6.282 -12.484  -1.541
   26   1HG   GLU   4          1HG       GLU   4   4.525 -12.768  -3.051
   27   2HG   GLU   4          2HG       GLU   4   5.580 -13.427  -4.293
   28    H    LEU   5           H        LEU   5   6.667 -10.146  -5.260
   29    HA   LEU   5           HA       LEU   5   4.904  -8.352  -3.872
   30   1HB   LEU   5          1HB       LEU   5   5.789  -8.346  -6.762
   31   2HB   LEU   5          2HB       LEU   5   4.886  -7.081  -5.964
   32    HG   LEU   5           HG       LEU   5   7.010  -6.208  -6.057
   33   1HD1  LEU   5          11HD      LEU   5   6.992  -7.486  -3.416
   34   2HD1  LEU   5          12HD      LEU   5   6.119  -6.016  -3.867
   35   3HD1  LEU   5          13HD      LEU   5   7.889  -6.038  -3.871
   36   1HD2  LEU   5          21HD      LEU   5   9.094  -7.366  -5.555
   37   2HD2  LEU   5          22HD      LEU   5   8.217  -8.181  -6.852
   38   3HD2  LEU   5          23HD      LEU   5   8.195  -8.842  -5.219
   39    H    PHE   6           H        PHE   6   2.787  -8.487  -3.920
   40    HA   PHE   6           HA       PHE   6   1.571 -10.207  -5.902
   41   1HB   PHE   6          1HB       PHE   6   0.028 -10.944  -4.023
   42   2HB   PHE   6          2HB       PHE   6   1.621 -11.682  -4.099
   43    HD1  PHE   6           HD1      PHE   6   3.134 -11.351  -2.268
   44    HD2  PHE   6           HD2      PHE   6  -0.530  -9.272  -2.438
   45    HE1  PHE   6           HE1      PHE   6   3.477 -10.638   0.052
   46    HE2  PHE   6           HE2      PHE   6  -0.225  -8.518  -0.078
   47    HZ   PHE   6           HZ       PHE   6   1.794  -9.211   1.161
   48    HA   PRO   7           HA       PRO   7  -1.388  -6.892  -6.005
   49   1HB   PRO   7          1HB       PRO   7  -3.092  -7.976  -7.640
   50   2HB   PRO   7          2HB       PRO   7  -1.503  -7.456  -8.197
   51   1HG   PRO   7          1HG       PRO   7  -2.409 -10.259  -7.513
   52   2HG   PRO   7          2HG       PRO   7  -1.417  -9.731  -8.902
   53   1HD   PRO   7          1HD       PRO   7  -0.479 -10.802  -6.533
   54   2HD   PRO   7          2HD       PRO   7   0.470  -9.745  -7.618
   55    H    VAL   8           H        VAL   8  -2.736  -6.550  -4.424
   56    HA   VAL   8           HA       VAL   8  -4.639  -8.646  -3.763
   57    HB   VAL   8           HB       VAL   8  -4.098  -6.118  -2.179
   58   1HG1  VAL   8          11HG      VAL   8  -5.591  -8.613  -1.418
   59   2HG1  VAL   8          12HG      VAL   8  -6.288  -7.033  -1.774
   60   3HG1  VAL   8          13HG      VAL   8  -5.269  -7.246  -0.350
   61   1HG2  VAL   8          21HG      VAL   8  -2.101  -7.462  -2.204
   62   2HG2  VAL   8          22HG      VAL   8  -3.014  -8.888  -1.705
   63   3HG2  VAL   8          23HG      VAL   8  -2.835  -7.514  -0.597
   64    H    GLU   9           H        GLU   9  -6.430  -8.380  -4.896
   65    HA   GLU   9           HA       GLU   9  -7.178  -5.718  -5.745
   66   1HB   GLU   9          1HB       GLU   9  -7.150  -7.474  -7.495
   67   2HB   GLU   9          2HB       GLU   9  -8.285  -8.424  -6.549
   68   1HG   GLU   9          1HG       GLU   9  -9.983  -6.696  -6.810
   69   2HG   GLU   9          2HG       GLU   9  -8.847  -5.707  -7.721
   70    H    LEU  10           H        LEU  10  -8.218  -4.744  -4.243
   71    HA   LEU  10           HA       LEU  10  -9.926  -6.350  -2.515
   72   1HB   LEU  10          1HB       LEU  10  -7.948  -4.522  -1.958
   73   2HB   LEU  10          2HB       LEU  10  -9.405  -3.565  -1.840
   74    HG   LEU  10           HG       LEU  10  -8.743  -6.020  -0.195
   75   1HD1  LEU  10          11HD      LEU  10  -9.022  -3.176   0.532
   76   2HD1  LEU  10          12HD      LEU  10  -7.504  -4.079   0.325
   77   3HD1  LEU  10          13HD      LEU  10  -8.634  -4.526   1.620
   78   1HD2  LEU  10          21HD      LEU  10 -11.075  -6.046  -0.516
   79   2HD2  LEU  10          22HD      LEU  10 -11.200  -4.302  -0.281
   80   3HD2  LEU  10          23HD      LEU  10 -10.799  -5.346   1.084
   81    H    GLU  11           H        GLU  11 -11.940  -5.481  -2.073
   82    HA   GLU  11           HA       GLU  11 -12.915  -3.536  -4.000
   83   1HB   GLU  11          1HB       GLU  11 -13.731  -5.814  -4.569
   84   2HB   GLU  11          2HB       GLU  11 -14.401  -5.948  -2.948
   85   1HG   GLU  11          1HG       GLU  11 -15.873  -4.031  -3.422
   86   2HG   GLU  11          2HG       GLU  11 -15.238  -3.977  -5.066
   87    H    LYS  12           H        LYS  12 -12.894  -1.896  -2.752
   88    HA   LYS  12           HA       LYS  12 -14.067  -2.009  -0.123
   89   1HB   LYS  12          1HB       LYS  12 -12.489   0.072  -1.609
   90   2HB   LYS  12          2HB       LYS  12 -13.294   0.492  -0.108
   91   1HG   LYS  12          1HG       LYS  12 -11.272  -1.705  -0.520
   92   2HG   LYS  12          2HG       LYS  12 -10.892  -0.101   0.156
   93   1HD   LYS  12          1HD       LYS  12 -13.040  -1.580   1.400
   94   2HD   LYS  12          2HD       LYS  12 -11.469  -2.390   1.580
   95   1HE   LYS  12          1HE       LYS  12 -11.833  -1.120   3.512
   96   2HE   LYS  12          2HE       LYS  12 -10.724  -0.153   2.588
   97   1HZ   LYS  12          1HZ       LYS  12 -12.468   1.268   3.440
   98   2HZ   LYS  12          2HZ       LYS  12 -13.672   0.324   2.782
   99   3HZ   LYS  12          3HZ       LYS  12 -12.649   1.203   1.782
  100    H    ASP  13           H        ASP  13 -15.369   0.255   0.241
  101    HA   ASP  13           HA       ASP  13 -17.549  -0.022  -1.681
  102   1HB   ASP  13          1HB       ASP  13 -18.035  -0.692   0.640
  103   2HB   ASP  13          2HB       ASP  13 -17.574   0.881   1.238
  104    H    GLU  14           H        GLU  14 -18.740   2.458  -0.750
  105    HA   GLU  14           HA       GLU  14 -17.470   3.991  -2.827
  106   1HB   GLU  14          1HB       GLU  14 -19.342   5.594  -2.503
  107   2HB   GLU  14          2HB       GLU  14 -19.834   3.944  -2.859
  108   1HG   GLU  14          1HG       GLU  14 -20.259   3.593  -0.463
  109   2HG   GLU  14          2HG       GLU  14 -19.847   5.284  -0.174
  110    H    ASP  15           H        ASP  15 -17.076   3.916   0.494
  111    HA   ASP  15           HA       ASP  15 -16.381   6.675   0.890
  112   1HB   ASP  15          1HB       ASP  15 -16.897   5.354   2.844
  113   2HB   ASP  15          2HB       ASP  15 -15.616   4.218   2.463
  114    H    GLY  16           H        GLY  16 -14.567   3.767   0.180
  115   1HA   GLY  16          1HA       GLY  16 -12.698   4.162  -1.420
  116   2HA   GLY  16          2HA       GLY  16 -12.208   5.458  -0.319
  117    H    LEU  17           H        LEU  17 -10.456   4.761   0.733
  118    HA   LEU  17           HA       LEU  17 -10.501   1.949   1.614
  119   1HB   LEU  17          1HB       LEU  17  -8.153   3.769   1.932
  120   2HB   LEU  17          2HB       LEU  17  -8.209   2.026   1.973
  121    HG   LEU  17           HG       LEU  17  -8.391   3.827  -0.346
  122   1HD1  LEU  17          11HD      LEU  17  -6.463   1.683   0.462
  123   2HD1  LEU  17          12HD      LEU  17  -6.196   3.430   0.435
  124   3HD1  LEU  17          13HD      LEU  17  -6.415   2.547  -1.076
  125   1HD2  LEU  17          21HD      LEU  17 -10.011   2.055  -0.725
  126   2HD2  LEU  17          22HD      LEU  17  -8.805   0.833  -0.332
  127   3HD2  LEU  17          23HD      LEU  17  -8.616   1.837  -1.777
  128    H    GLY  18           H        GLY  18  -9.507   5.101   2.804
  129   1HA   GLY  18          1HA       GLY  18  -9.789   6.019   4.862
  130   2HA   GLY  18          2HA       GLY  18 -10.724   4.603   5.341
  131    H    ILE  19           H        ILE  19  -7.531   4.371   3.902
  132    HA   ILE  19           HA       ILE  19  -6.655   3.298   6.496
  133    HB   ILE  19           HB       ILE  19  -4.999   1.939   5.410
  134   1HG1  ILE  19          11HG      ILE  19  -5.847   3.160   2.782
  135   2HG1  ILE  19          12HG      ILE  19  -4.377   3.577   3.662
  136   1HG2  ILE  19          21HG      ILE  19  -7.215   0.994   5.445
  137   2HG2  ILE  19          22HG      ILE  19  -6.399   0.510   3.956
  138   3HG2  ILE  19          23HG      ILE  19  -7.612   1.791   3.927
  139   1HD1  ILE  19          11HD      ILE  19  -5.044   0.863   2.529
  140   2HD1  ILE  19          12HD      ILE  19  -3.591   1.269   3.440
  141   3HD1  ILE  19          13HD      ILE  19  -3.877   2.010   1.869
  142    H    SER  20           H        SER  20  -4.076   3.393   6.610
  143    HA   SER  20           HA       SER  20  -3.223   6.140   6.024
  144   1HB   SER  20          1HB       SER  20  -3.012   4.748   8.710
  145   2HB   SER  20          2HB       SER  20  -2.474   6.383   8.342
  146    HG   SER  20           HG       SER  20  -4.576   6.995   8.030
  147    H    ILE  21           H        ILE  21  -0.972   6.383   5.952
  148    HA   ILE  21           HA       ILE  21   0.546   3.876   5.590
  149    HB   ILE  21           HB       ILE  21   1.803   5.013   3.836
  150   1HG1  ILE  21          11HG      ILE  21   0.413   7.183   2.886
  151   2HG1  ILE  21          12HG      ILE  21   0.083   7.322   4.583
  152   1HG2  ILE  21          21HG      ILE  21  -1.167   4.968   3.326
  153   2HG2  ILE  21          22HG      ILE  21  -0.049   3.612   3.169
  154   3HG2  ILE  21          23HG      ILE  21   0.077   4.991   2.078
  155   1HD1  ILE  21          11HD      ILE  21   2.436   7.459   5.097
  156   2HD1  ILE  21          12HD      ILE  21   1.975   8.670   3.915
  157   3HD1  ILE  21          13HD      ILE  21   2.846   7.255   3.404
  158    H    ILE  22           H        ILE  22   2.900   4.198   5.844
  159    HA   ILE  22           HA       ILE  22   3.607   6.581   7.275
  160    HB   ILE  22           HB       ILE  22   3.101   5.009   9.012
  161   1HG1  ILE  22          11HG      ILE  22   6.076   5.435   8.722
  162   2HG1  ILE  22          12HG      ILE  22   4.919   6.560   9.416
  163   1HG2  ILE  22          21HG      ILE  22   5.139   3.195   7.781
  164   2HG2  ILE  22          22HG      ILE  22   3.396   2.918   7.841
  165   3HG2  ILE  22          23HG      ILE  22   4.349   2.911   9.334
  166   1HD1  ILE  22          11HD      ILE  22   4.490   5.006  11.228
  167   2HD1  ILE  22          12HD      ILE  22   6.203   5.428  11.118
  168   3HD1  ILE  22          13HD      ILE  22   5.637   3.867  10.522
  169    H    GLY  23           H        GLY  23   5.471   7.370   6.603
  170   1HA   GLY  23          1HA       GLY  23   6.879   5.840   4.567
  171   2HA   GLY  23          2HA       GLY  23   7.004   7.587   4.825
  172    H    MET  24           H        MET  24   8.387   4.643   5.223
  173    HA   MET  24           HA       MET  24  10.327   5.757   7.155
  174   1HB   MET  24          1HB       MET  24   9.513   2.839   6.965
  175   2HB   MET  24          2HB       MET  24  10.671   3.514   8.094
  176   1HG   MET  24          1HG       MET  24   7.723   4.082   8.010
  177   2HG   MET  24          2HG       MET  24   8.523   3.046   9.178
  178   1HE   MET  24          1HE       MET  24  10.250   4.007  11.022
  179   2HE   MET  24          2HE       MET  24  10.653   5.713  11.194
  180   3HE   MET  24          3HE       MET  24  11.202   4.820   9.777
  181    H    GLY  25           H        GLY  25  11.752   6.393   5.634
  182   1HA   GLY  25          1HA       GLY  25  12.343   5.163   3.223
  183   2HA   GLY  25          2HA       GLY  25  13.388   6.294   4.058
  184    H    VAL  26           H        VAL  26  12.770   3.029   3.277
  185    HA   VAL  26           HA       VAL  26  15.028   2.030   4.800
  186    HB   VAL  26           HB       VAL  26  12.875   0.741   4.648
  187   1HG1  VAL  26          11HG      VAL  26  12.297  -0.521   2.637
  188   2HG1  VAL  26          12HG      VAL  26  13.556   0.344   1.759
  189   3HG1  VAL  26          13HG      VAL  26  12.180   1.226   2.420
  190   1HG2  VAL  26          21HG      VAL  26  15.272  -0.723   3.534
  191   2HG2  VAL  26          22HG      VAL  26  13.846  -1.498   4.221
  192   3HG2  VAL  26          23HG      VAL  26  14.878  -0.489   5.237
  193    H    GLY  27           H        GLY  27  15.717   3.911   3.082
  194   1HA   GLY  27          1HA       GLY  27  16.695   2.776   0.592
  195   2HA   GLY  27          2HA       GLY  27  16.860   4.453   1.106
  196    H    ALA  28           H        ALA  28  18.315   1.454   0.870
  197    HA   ALA  28           HA       ALA  28  20.330   0.631   1.210
  198   1HB   ALA  28          1HB       ALA  28  21.225   3.402   2.015
  199   2HB   ALA  28          2HB       ALA  28  21.162   2.785   0.363
  200   3HB   ALA  28          3HB       ALA  28  22.268   2.050   1.533
  201    H    ASP  29           H        ASP  29  19.053  -0.359   2.774
  202    HA   ASP  29           HA       ASP  29  20.123   0.180   5.464
  203   1HB   ASP  29          1HB       ASP  29  17.838   1.179   5.175
  204   2HB   ASP  29          2HB       ASP  29  17.228  -0.455   4.942
  205    H    ALA  30           H        ALA  30  17.928  -2.076   3.828
  206    HA   ALA  30           HA       ALA  30  19.348  -4.240   5.236
  207   1HB   ALA  30          1HB       ALA  30  17.199  -5.315   5.659
  208   2HB   ALA  30          2HB       ALA  30  16.380  -3.946   4.897
  209   3HB   ALA  30          3HB       ALA  30  17.293  -3.709   6.379
  210    H    GLY  31           H        GLY  31  18.968  -3.163   2.194
  211   1HA   GLY  31          1HA       GLY  31  19.706  -4.584   0.424
  212   2HA   GLY  31          2HA       GLY  31  18.887  -5.920   1.224
  213    H    LEU  32           H        LEU  32  16.775  -3.649   1.603
  214    HA   LEU  32           HA       LEU  32  15.166  -4.563  -0.598
  215   1HB   LEU  32          1HB       LEU  32  14.548  -2.730   1.717
  216   2HB   LEU  32          2HB       LEU  32  13.407  -3.009   0.421
  217    HG   LEU  32           HG       LEU  32  13.391  -5.440   1.033
  218   1HD1  LEU  32          11HD      LEU  32  14.244  -6.151   3.195
  219   2HD1  LEU  32          12HD      LEU  32  14.951  -4.557   3.448
  220   3HD1  LEU  32          13HD      LEU  32  15.555  -5.589   2.154
  221   1HD2  LEU  32          21HD      LEU  32  12.611  -3.508   3.207
  222   2HD2  LEU  32          22HD      LEU  32  12.014  -5.159   3.040
  223   3HD2  LEU  32          23HD      LEU  32  11.640  -3.957   1.804
  224    H    GLU  33           H        GLU  33  16.524  -1.486   0.514
  225    HA   GLU  33           HA       GLU  33  16.604   0.539  -0.380
  226   1HB   GLU  33          1HB       GLU  33  17.894  -1.286  -2.342
  227   2HB   GLU  33          2HB       GLU  33  17.903   0.452  -2.598
  228   1HG   GLU  33          1HG       GLU  33  19.926  -0.298  -1.512
  229   2HG   GLU  33          2HG       GLU  33  19.030   0.799  -0.495
  230    H    LYS  34           H        LYS  34  14.309   0.808  -0.501
  231    HA   LYS  34           HA       LYS  34  13.397   1.529  -3.113
  232   1HB   LYS  34          1HB       LYS  34  11.492  -0.007  -3.084
  233   2HB   LYS  34          2HB       LYS  34  13.024  -0.878  -3.093
  234   1HG   LYS  34          1HG       LYS  34  12.765  -1.136  -0.590
  235   2HG   LYS  34          2HG       LYS  34  11.118  -0.541  -0.786
  236   1HD   LYS  34          1HD       LYS  34  12.287  -2.988  -2.127
  237   2HD   LYS  34          2HD       LYS  34  11.197  -2.990  -0.746
  238   1HE   LYS  34          1HE       LYS  34   9.418  -2.076  -2.071
  239   2HE   LYS  34          2HE       LYS  34  10.503  -1.822  -3.437
  240   1HZ   LYS  34          1HZ       LYS  34  10.816  -4.189  -3.586
  241   2HZ   LYS  34          2HZ       LYS  34   9.196  -3.811  -3.766
  242   3HZ   LYS  34          3HZ       LYS  34   9.767  -4.470  -2.305
  243    H    LEU  35           H        LEU  35  10.772   1.688  -2.540
  244    HA   LEU  35           HA       LEU  35  10.346   3.894  -0.936
  245   1HB   LEU  35          1HB       LEU  35   8.016   3.373  -1.203
  246   2HB   LEU  35          2HB       LEU  35   8.856   2.972  -2.690
  247    HG   LEU  35           HG       LEU  35   8.896   0.597  -1.343
  248   1HD1  LEU  35          11HD      LEU  35   6.552   0.193  -0.686
  249   2HD1  LEU  35          12HD      LEU  35   6.286   1.933  -0.721
  250   3HD1  LEU  35          13HD      LEU  35   7.475   1.225   0.381
  251   1HD2  LEU  35          21HD      LEU  35   8.449   0.896  -3.683
  252   2HD2  LEU  35          22HD      LEU  35   6.829   1.525  -3.319
  253   3HD2  LEU  35          23HD      LEU  35   7.248  -0.146  -2.936
  254    H    GLY  36           H        GLY  36   9.501   4.050   1.202
  255   1HA   GLY  36          1HA       GLY  36   9.710   1.573   2.758
  256   2HA   GLY  36          2HA       GLY  36  10.243   3.141   3.362
  257    H    ILE  37           H        ILE  37   7.423   2.712   1.438
  258    HA   ILE  37           HA       ILE  37   5.886   3.893   3.531
  259    HB   ILE  37           HB       ILE  37   4.959   2.977   0.802
  260   1HG1  ILE  37          11HG      ILE  37   6.733   4.795   0.932
  261   2HG1  ILE  37          12HG      ILE  37   5.253   5.258   0.050
  262   1HG2  ILE  37          21HG      ILE  37   3.001   4.447   1.267
  263   2HG2  ILE  37          22HG      ILE  37   3.638   4.714   2.897
  264   3HG2  ILE  37          23HG      ILE  37   3.129   3.108   2.414
  265   1HD1  ILE  37          11HD      ILE  37   6.169   5.992   2.815
  266   2HD1  ILE  37          12HD      ILE  37   4.579   6.380   2.170
  267   3HD1  ILE  37          13HD      ILE  37   6.024   7.059   1.413
  268    H    PHE  38           H        PHE  38   5.395   2.670   5.069
  269    HA   PHE  38           HA       PHE  38   4.379  -0.022   4.565
  270   1HB   PHE  38          1HB       PHE  38   5.344   1.332   7.085
  271   2HB   PHE  38          2HB       PHE  38   4.608  -0.260   7.093
  272    HD1  PHE  38           HD1      PHE  38   5.785  -2.159   6.017
  273    HD2  PHE  38           HD2      PHE  38   7.616   1.659   6.455
  274    HE1  PHE  38           HE1      PHE  38   7.990  -3.175   5.632
  275    HE2  PHE  38           HE2      PHE  38   9.825   0.646   6.068
  276    HZ   PHE  38           HZ       PHE  38  10.014  -1.770   5.656
  277    H    VAL  39           H        VAL  39   2.503  -0.607   5.873
  278    HA   VAL  39           HA       VAL  39   0.572   1.498   5.615
  279    HB   VAL  39           HB       VAL  39   0.197  -1.346   6.625
  280   1HG1  VAL  39          11HG      VAL  39  -2.161  -1.005   6.035
  281   2HG1  VAL  39          12HG      VAL  39  -1.804   0.663   5.591
  282   3HG1  VAL  39          13HG      VAL  39  -1.625   0.140   7.265
  283   1HG2  VAL  39          21HG      VAL  39  -0.176  -0.246   3.836
  284   2HG2  VAL  39          22HG      VAL  39  -0.561  -1.891   4.345
  285   3HG2  VAL  39          23HG      VAL  39   1.110  -1.322   4.349
  286    H    LYS  40           H        LYS  40  -0.210   2.654   7.252
  287    HA   LYS  40           HA       LYS  40   1.106   2.283   9.803
  288   1HB   LYS  40          1HB       LYS  40   1.187   4.533   8.920
  289   2HB   LYS  40          2HB       LYS  40  -0.544   4.561   8.716
  290   1HG   LYS  40          1HG       LYS  40  -0.068   5.956  10.561
  291   2HG   LYS  40          2HG       LYS  40  -0.761   4.492  11.226
  292   1HD   LYS  40          1HD       LYS  40   2.210   5.126  11.167
  293   2HD   LYS  40          2HD       LYS  40   1.159   5.439  12.539
  294   1HE   LYS  40          1HE       LYS  40   0.649   2.948  12.532
  295   2HE   LYS  40          2HE       LYS  40   1.944   2.811  11.347
  296   1HZ   LYS  40          1HZ       LYS  40   3.514   3.699  12.955
  297   2HZ   LYS  40          2HZ       LYS  40   2.747   2.327  13.527
  298   3HZ   LYS  40          3HZ       LYS  40   2.288   3.825  14.110
  299    H    THR  41           H        THR  41  -2.123   2.524   8.419
  300    HA   THR  41           HA       THR  41  -3.219   0.977  10.598
  301    HB   THR  41           HB       THR  41  -4.574   3.451   9.835
  302    HG1  THR  41           HG1      THR  41  -2.447   3.188  11.764
  303   1HG2  THR  41          21HG      THR  41  -4.520   1.865  12.398
  304   2HG2  THR  41          22HG      THR  41  -5.818   1.940  11.196
  305   3HG2  THR  41          23HG      THR  41  -5.447   3.349  12.187
  306    H    VAL  42           H        VAL  42  -5.490   0.442   9.942
  307    HA   VAL  42           HA       VAL  42  -5.974   0.839   7.112
  308    HB   VAL  42           HB       VAL  42  -6.583  -1.735   8.634
  309   1HG1  VAL  42          11HG      VAL  42  -8.021  -1.300   6.753
  310   2HG1  VAL  42          12HG      VAL  42  -6.964  -2.672   6.395
  311   3HG1  VAL  42          13HG      VAL  42  -6.618  -1.067   5.719
  312   1HG2  VAL  42          21HG      VAL  42  -4.159  -1.518   8.439
  313   2HG2  VAL  42          22HG      VAL  42  -4.319  -1.261   6.702
  314   3HG2  VAL  42          23HG      VAL  42  -4.765  -2.817   7.410
  315    H    THR  43           H        THR  43  -8.382   0.602   6.762
  316    HA   THR  43           HA       THR  43  -9.718   2.114   8.730
  317    HB   THR  43           HB       THR  43 -10.195   2.362   6.302
  318    HG1  THR  43           HG1      THR  43 -12.174   2.952   6.868
  319   1HG2  THR  43          21HG      THR  43 -11.550   0.640   5.193
  320   2HG2  THR  43          22HG      THR  43 -11.433  -0.325   6.686
  321   3HG2  THR  43          23HG      THR  43  -9.977   0.024   5.750
  322    H    GLU  44           H        GLU  44 -11.331   1.541   9.973
  323    HA   GLU  44           HA       GLU  44 -11.768  -1.295  10.584
  324   1HB   GLU  44          1HB       GLU  44 -10.975   0.150  12.406
  325   2HB   GLU  44          2HB       GLU  44 -12.319   1.248  12.134
  326   1HG   GLU  44          1HG       GLU  44 -13.839  -0.430  12.704
  327   2HG   GLU  44          2HG       GLU  44 -12.543  -1.596  12.981
  328    H    GLY  45           H        GLY  45 -12.825   1.019   8.855
  329   1HA   GLY  45          1HA       GLY  45 -15.639   1.275   9.230
  330   2HA   GLY  45          2HA       GLY  45 -14.735   1.790   7.815
  331    H    GLY  46           H        GLY  46 -13.745  -0.997   7.245
  332   1HA   GLY  46          1HA       GLY  46 -15.352  -3.001   6.980
  333   2HA   GLY  46          2HA       GLY  46 -16.238  -1.832   6.024
  334    H    ALA  47           H        ALA  47 -14.976  -4.301   5.436
  335    HA   ALA  47           HA       ALA  47 -14.352  -5.326   3.559
  336   1HB   ALA  47          1HB       ALA  47 -13.981  -4.033   1.448
  337   2HB   ALA  47          2HB       ALA  47 -14.228  -2.566   2.412
  338   3HB   ALA  47          3HB       ALA  47 -15.516  -3.743   2.264
  339    H    ALA  48           H        ALA  48 -12.134  -2.907   4.656
  340    HA   ALA  48           HA       ALA  48  -9.909  -4.113   3.120
  341   1HB   ALA  48          1HB       ALA  48  -8.435  -2.507   4.216
  342   2HB   ALA  48          2HB       ALA  48  -9.778  -1.959   5.222
  343   3HB   ALA  48          3HB       ALA  48  -9.817  -1.715   3.474
  344    H    GLN  49           H        GLN  49 -10.484  -3.599   6.584
  345    HA   GLN  49           HA       GLN  49  -8.567  -5.604   7.194
  346   1HB   GLN  49          1HB       GLN  49 -10.512  -4.024   8.761
  347   2HB   GLN  49          2HB       GLN  49  -9.637  -5.352   9.566
  348   1HG   GLN  49          1HG       GLN  49  -7.536  -4.215   8.820
  349   2HG   GLN  49          2HG       GLN  49  -8.559  -2.906   8.222
  350   1HE2  GLN  49          21HE      GLN  49 -10.387  -2.956  10.449
  351   2HE2  GLN  49          22HE      GLN  49  -9.571  -2.297  11.802
  352    H    ARG  50           H        ARG  50 -11.801  -5.617   6.336
  353    HA   ARG  50           HA       ARG  50 -12.268  -8.228   7.378
  354   1HB   ARG  50          1HB       ARG  50 -13.898  -6.490   5.566
  355   2HB   ARG  50          2HB       ARG  50 -14.361  -8.139   5.964
  356   1HG   ARG  50          1HG       ARG  50 -13.882  -5.967   7.968
  357   2HG   ARG  50          2HG       ARG  50 -15.491  -6.420   7.377
  358   1HD   ARG  50          1HD       ARG  50 -15.266  -7.536   9.439
  359   2HD   ARG  50          2HD       ARG  50 -14.889  -8.771   8.250
  360    HE   ARG  50           HE       ARG  50 -12.784  -7.254   9.635
  361   1HH1  ARG  50          11HH      ARG  50 -14.085 -10.370   8.608
  362   2HH1  ARG  50          12HH      ARG  50 -12.913 -11.303   9.410
  363   1HH2  ARG  50          21HH      ARG  50 -11.124  -8.515  10.703
  364   2HH2  ARG  50          22HH      ARG  50 -11.152 -10.203  10.625
  365    H    ASP  51           H        ASP  51 -10.822  -6.892   4.550
  366    HA   ASP  51           HA       ASP  51 -11.110  -9.043   2.765
  367   1HB   ASP  51          1HB       ASP  51 -10.154  -7.047   1.905
  368   2HB   ASP  51          2HB       ASP  51  -8.898  -7.018   3.140
  369    H    GLY  52           H        GLY  52  -8.301  -8.359   4.812
  370   1HA   GLY  52          1HA       GLY  52  -7.416  -9.885   6.396
  371   2HA   GLY  52          2HA       GLY  52  -8.319 -11.160   5.594
  372    H    ARG  53           H        ARG  53  -6.968  -9.795   3.027
  373    HA   ARG  53           HA       ARG  53  -4.724 -11.653   3.129
  374   1HB   ARG  53          1HB       ARG  53  -6.422 -11.250   1.138
  375   2HB   ARG  53          2HB       ARG  53  -5.418  -9.854   0.808
  376   1HG   ARG  53          1HG       ARG  53  -4.521 -12.735   0.811
  377   2HG   ARG  53          2HG       ARG  53  -4.835 -11.746  -0.604
  378   1HD   ARG  53          1HD       ARG  53  -2.970 -10.299  -0.010
  379   2HD   ARG  53          2HD       ARG  53  -2.695 -11.239   1.457
  380    HE   ARG  53           HE       ARG  53  -2.616 -12.651  -1.077
  381   1HH1  ARG  53          11HH      ARG  53  -0.763 -11.275   1.641
  382   2HH1  ARG  53          12HH      ARG  53   0.655 -12.103   1.258
  383   1HH2  ARG  53          21HH      ARG  53  -0.643 -13.751  -1.600
  384   2HH2  ARG  53          22HH      ARG  53   0.744 -13.519  -0.640
  385    H    ILE  54           H        ILE  54  -5.546  -8.292   2.617
  386    HA   ILE  54           HA       ILE  54  -2.839  -7.346   2.696
  387    HB   ILE  54           HB       ILE  54  -4.789  -6.135   1.556
  388   1HG1  ILE  54          11HG      ILE  54  -3.346  -4.467   3.634
  389   2HG1  ILE  54          12HG      ILE  54  -2.603  -5.023   2.142
  390   1HG2  ILE  54          21HG      ILE  54  -5.481  -5.518   4.421
  391   2HG2  ILE  54          22HG      ILE  54  -6.484  -6.412   3.276
  392   3HG2  ILE  54          23HG      ILE  54  -6.194  -4.680   3.037
  393   1HD1  ILE  54          11HD      ILE  54  -4.194  -3.739   0.849
  394   2HD1  ILE  54          12HD      ILE  54  -3.340  -2.705   1.984
  395   3HD1  ILE  54          13HD      ILE  54  -5.009  -3.213   2.323
  396    H    GLN  55           H        GLN  55  -1.870  -6.167   4.503
  397    HA   GLN  55           HA       GLN  55  -3.300  -6.524   7.004
  398   1HB   GLN  55          1HB       GLN  55  -0.326  -6.995   6.748
  399   2HB   GLN  55          2HB       GLN  55  -1.325  -7.273   8.158
  400   1HG   GLN  55          1HG       GLN  55  -2.427  -9.121   6.994
  401   2HG   GLN  55          2HG       GLN  55  -1.403  -8.828   5.588
  402   1HE2  GLN  55          21HE      GLN  55   0.861  -9.110   5.823
  403   2HE2  GLN  55          22HE      GLN  55   1.486 -10.230   6.976
  404    H    VAL  56           H        VAL  56  -2.485  -5.064   8.671
  405    HA   VAL  56           HA       VAL  56  -1.765  -2.467   7.719
  406    HB   VAL  56           HB       VAL  56  -3.195  -2.960   9.756
  407   1HG1  VAL  56          11HG      VAL  56  -1.922  -4.737  10.759
  408   2HG1  VAL  56          12HG      VAL  56  -2.099  -3.408  11.903
  409   3HG1  VAL  56          13HG      VAL  56  -0.572  -3.646  11.052
  410   1HG2  VAL  56          21HG      VAL  56  -2.317  -1.117  11.137
  411   2HG2  VAL  56          22HG      VAL  56  -2.328  -0.710   9.427
  412   3HG2  VAL  56          23HG      VAL  56  -0.817  -1.161  10.217
  413    H    ASN  57           H        ASN  57  -0.025  -5.206   8.482
  414    HA   ASN  57           HA       ASN  57   2.295  -3.801   9.480
  415   1HB   ASN  57          1HB       ASN  57   1.574  -5.842  10.606
  416   2HB   ASN  57          2HB       ASN  57   1.770  -6.752   9.121
  417   1HD2  ASN  57          21HD      ASN  57   3.419  -5.097  11.700
  418   2HD2  ASN  57          22HD      ASN  57   4.954  -5.861  11.470
  419    H    ASP  58           H        ASP  58   1.175  -4.482   6.438
  420    HA   ASP  58           HA       ASP  58   3.793  -5.245   5.449
  421   1HB   ASP  58          1HB       ASP  58   1.099  -5.390   4.114
  422   2HB   ASP  58          2HB       ASP  58   2.614  -5.722   3.282
  423    H    GLN  59           H        GLN  59   3.855  -4.400   2.909
  424    HA   GLN  59           HA       GLN  59   4.147  -1.502   3.285
  425   1HB   GLN  59          1HB       GLN  59   6.309  -2.531   3.339
  426   2HB   GLN  59          2HB       GLN  59   5.926  -3.505   1.925
  427   1HG   GLN  59          1HG       GLN  59   5.979  -1.604   0.508
  428   2HG   GLN  59          2HG       GLN  59   6.116  -0.513   1.884
  429   1HE2  GLN  59          21HE      GLN  59   8.040  -0.282   2.880
  430   2HE2  GLN  59          22HE      GLN  59   9.535  -0.822   2.189
  431    H    ILE  60           H        ILE  60   3.189  -0.220   1.826
  432    HA   ILE  60           HA       ILE  60   1.643  -1.313  -0.342
  433    HB   ILE  60           HB       ILE  60   2.360   1.589   0.199
  434   1HG1  ILE  60          11HG      ILE  60   1.066   0.674   2.101
  435   2HG1  ILE  60          12HG      ILE  60   0.119   1.820   1.147
  436   1HG2  ILE  60          21HG      ILE  60   0.587   2.158  -1.322
  437   2HG2  ILE  60          22HG      ILE  60   0.103   0.471  -1.394
  438   3HG2  ILE  60          23HG      ILE  60   1.628   0.950  -2.119
  439   1HD1  ILE  60          11HD      ILE  60  -1.237  -0.073   1.820
  440   2HD1  ILE  60          12HD      ILE  60  -0.101  -1.170   1.042
  441   3HD1  ILE  60          13HD      ILE  60  -1.037  -0.038   0.064
  442    H    VAL  61           H        VAL  61   2.823  -2.067  -2.071
  443    HA   VAL  61           HA       VAL  61   5.331  -0.750  -2.697
  444    HB   VAL  61           HB       VAL  61   4.093  -3.294  -3.781
  445   1HG1  VAL  61          11HG      VAL  61   6.215  -3.784  -4.781
  446   2HG1  VAL  61          12HG      VAL  61   6.841  -2.193  -4.307
  447   3HG1  VAL  61          13HG      VAL  61   5.508  -2.324  -5.471
  448   1HG2  VAL  61          21HG      VAL  61   6.376  -2.865  -1.861
  449   2HG2  VAL  61          22HG      VAL  61   5.839  -4.422  -2.497
  450   3HG2  VAL  61          23HG      VAL  61   4.766  -3.474  -1.474
  451    H    GLU  62           H        GLU  62   2.345  -1.589  -4.322
  452    HA   GLU  62           HA       GLU  62   2.589   0.732  -6.018
  453   1HB   GLU  62          1HB       GLU  62   3.856  -0.812  -7.344
  454   2HB   GLU  62          2HB       GLU  62   2.654  -2.070  -7.193
  455   1HG   GLU  62          1HG       GLU  62   1.082  -0.710  -8.487
  456   2HG   GLU  62          2HG       GLU  62   2.302   0.553  -8.599
  457    H    VAL  63           H        VAL  63   0.696   1.549  -5.423
  458    HA   VAL  63           HA       VAL  63  -1.581  -0.210  -5.447
  459    HB   VAL  63           HB       VAL  63  -1.158   2.488  -4.196
  460   1HG1  VAL  63          11HG      VAL  63  -3.156   2.773  -5.626
  461   2HG1  VAL  63          12HG      VAL  63  -3.564   2.757  -3.903
  462   3HG1  VAL  63          13HG      VAL  63  -3.870   1.329  -4.902
  463   1HG2  VAL  63          21HG      VAL  63  -0.926   0.323  -3.044
  464   2HG2  VAL  63          22HG      VAL  63  -2.636   0.023  -3.382
  465   3HG2  VAL  63          23HG      VAL  63  -2.166   1.384  -2.368
  466    H    ASP  64           H        ASP  64  -2.776  -0.492  -6.921
  467    HA   ASP  64           HA       ASP  64  -4.054  -0.401  -8.663
  468   1HB   ASP  64          1HB       ASP  64  -4.916   1.681  -7.558
  469   2HB   ASP  64          2HB       ASP  64  -3.884   2.611  -8.644
  470    H    GLY  65           H        GLY  65  -1.033   0.136  -8.833
  471   1HA   GLY  65          1HA       GLY  65   0.371  -0.278 -10.684
  472   2HA   GLY  65          2HA       GLY  65  -0.963   0.190 -11.737
  473    H    ILE  66           H        ILE  66  -0.570   2.408  -9.173
  474    HA   ILE  66           HA       ILE  66   0.280   4.464 -10.969
  475    HB   ILE  66           HB       ILE  66  -1.233   4.652  -8.789
  476   1HG1  ILE  66          11HG      ILE  66   0.916   6.703  -9.357
  477   2HG1  ILE  66          12HG      ILE  66  -0.538   6.495 -10.332
  478   1HG2  ILE  66          21HG      ILE  66   0.029   5.399  -6.823
  479   2HG2  ILE  66          22HG      ILE  66   1.537   4.988  -7.649
  480   3HG2  ILE  66          23HG      ILE  66   0.386   3.719  -7.241
  481   1HD1  ILE  66          11HD      ILE  66  -0.775   8.353  -8.809
  482   2HD1  ILE  66          12HD      ILE  66  -0.395   7.274  -7.457
  483   3HD1  ILE  66          13HD      ILE  66  -1.883   7.038  -8.378
  484    H    SER  67           H        SER  67   1.886   2.189  -9.172
  485    HA   SER  67           HA       SER  67   3.912   1.868  -8.308
  486   1HB   SER  67          1HB       SER  67   5.814   2.437  -9.958
  487   2HB   SER  67          2HB       SER  67   4.549   1.323 -10.470
  488    HG   SER  67           HG       SER  67   4.038   3.977 -10.978
  489    H    LEU  68           H        LEU  68   3.815   2.986  -6.500
  490    HA   LEU  68           HA       LEU  68   4.800   5.708  -6.456
  491   1HB   LEU  68          1HB       LEU  68   3.997   5.682  -4.148
  492   2HB   LEU  68          2HB       LEU  68   2.750   5.223  -5.282
  493    HG   LEU  68           HG       LEU  68   3.866   2.821  -4.511
  494   1HD1  LEU  68          11HD      LEU  68   3.586   4.586  -2.095
  495   2HD1  LEU  68          12HD      LEU  68   5.081   3.924  -2.736
  496   3HD1  LEU  68          13HD      LEU  68   3.849   2.837  -2.081
  497   1HD2  LEU  68          21HD      LEU  68   1.424   4.243  -3.492
  498   2HD2  LEU  68          22HD      LEU  68   1.738   2.498  -3.401
  499   3HD2  LEU  68          23HD      LEU  68   1.577   3.288  -4.971
  500    H    VAL  69           H        VAL  69   6.188   3.049  -6.744
  501    HA   VAL  69           HA       VAL  69   8.011   2.616  -4.695
  502    HB   VAL  69           HB       VAL  69   8.537   2.318  -7.660
  503   1HG1  VAL  69          11HG      VAL  69   9.856   0.964  -5.311
  504   2HG1  VAL  69          12HG      VAL  69  10.564   2.224  -6.321
  505   3HG1  VAL  69          13HG      VAL  69  10.184   0.651  -7.017
  506   1HG2  VAL  69          21HG      VAL  69   7.839  -0.032  -7.357
  507   2HG2  VAL  69          22HG      VAL  69   6.530   1.103  -7.034
  508   3HG2  VAL  69          23HG      VAL  69   7.377   0.337  -5.694
  509    H    GLY  70           H        GLY  70   8.943   4.365  -3.781
  510   1HA   GLY  70          1HA       GLY  70  11.144   5.406  -3.810
  511   2HA   GLY  70          2HA       GLY  70  10.805   5.901  -5.464
  512    H    VAL  71           H        VAL  71   7.949   6.241  -3.942
  513    HA   VAL  71           HA       VAL  71   8.329   9.108  -3.864
  514    HB   VAL  71           HB       VAL  71   5.959   9.350  -3.698
  515   1HG1  VAL  71          11HG      VAL  71   6.770   8.803  -5.899
  516   2HG1  VAL  71          12HG      VAL  71   5.161   8.112  -5.630
  517   3HG1  VAL  71          13HG      VAL  71   6.585   7.080  -5.550
  518   1HG2  VAL  71          21HG      VAL  71   4.419   7.472  -3.345
  519   2HG2  VAL  71          22HG      VAL  71   5.528   7.631  -1.980
  520   3HG2  VAL  71          23HG      VAL  71   5.787   6.371  -3.173
  521    H    THR  72           H        THR  72   6.918  10.227  -2.089
  522    HA   THR  72           HA       THR  72   7.880   9.265   0.472
  523    HB   THR  72           HB       THR  72   7.076  11.630   1.134
  524    HG1  THR  72           HG1      THR  72   7.668  12.149  -1.578
  525   1HG2  THR  72          21HG      THR  72   9.259  12.587   0.440
  526   2HG2  THR  72          22HG      THR  72   9.491  11.236  -0.668
  527   3HG2  THR  72          23HG      THR  72   9.443  10.951   1.072
  528    H    GLN  73           H        GLN  73   6.461   9.846   2.229
  529    HA   GLN  73           HA       GLN  73   4.135   8.408   2.159
  530   1HB   GLN  73          1HB       GLN  73   3.829   9.075   4.440
  531   2HB   GLN  73          2HB       GLN  73   5.538   9.001   4.118
  532   1HG   GLN  73          1HG       GLN  73   3.842  11.393   4.283
  533   2HG   GLN  73          2HG       GLN  73   4.956  10.863   5.545
  534   1HE2  GLN  73          21HE      GLN  73   7.277  10.690   4.843
  535   2HE2  GLN  73          22HE      GLN  73   7.854  11.877   3.763
  536    H    ASN  74           H        ASN  74   4.591  11.800   1.539
  537    HA   ASN  74           HA       ASN  74   1.829  12.389   1.724
  538   1HB   ASN  74          1HB       ASN  74   2.372  14.631   0.877
  539   2HB   ASN  74          2HB       ASN  74   3.496  14.151   2.138
  540   1HD2  ASN  74          21HD      ASN  74   5.629  13.795   1.592
  541   2HD2  ASN  74          22HD      ASN  74   6.288  14.260   0.067
  542    H    PHE  75           H        PHE  75   3.795  11.155  -0.808
  543    HA   PHE  75           HA       PHE  75   1.884  11.762  -2.888
  544   1HB   PHE  75          1HB       PHE  75   4.318  11.391  -3.396
  545   2HB   PHE  75          2HB       PHE  75   4.121   9.727  -2.868
  546    HD1  PHE  75           HD1      PHE  75   3.717  12.063  -5.583
  547    HD2  PHE  75           HD2      PHE  75   2.661   8.157  -4.241
  548    HE1  PHE  75           HE1      PHE  75   3.133  11.414  -7.885
  549    HE2  PHE  75           HE2      PHE  75   2.080   7.517  -6.538
  550    HZ   PHE  75           HZ       PHE  75   2.314   9.145  -8.361
  551    H    ALA  76           H        ALA  76   3.003   8.992  -1.053
  552    HA   ALA  76           HA       ALA  76   1.231   7.092  -2.020
  553   1HB   ALA  76          1HB       ALA  76   2.449   7.193   0.730
  554   2HB   ALA  76          2HB       ALA  76   3.218   6.563  -0.731
  555   3HB   ALA  76          3HB       ALA  76   1.785   5.767  -0.080
  556    H    ALA  77           H        ALA  77   0.848   9.159   0.889
  557    HA   ALA  77           HA       ALA  77  -1.611   8.168   1.744
  558   1HB   ALA  77          1HB       ALA  77  -1.901  10.301   2.911
  559   2HB   ALA  77          2HB       ALA  77  -0.622  11.019   1.930
  560   3HB   ALA  77          3HB       ALA  77  -0.241   9.729   3.067
  561    H    THR  78           H        THR  78  -0.844  10.437  -0.775
  562    HA   THR  78           HA       THR  78  -3.480  11.285  -1.317
  563    HB   THR  78           HB       THR  78  -0.943  11.314  -2.955
  564    HG1  THR  78           HG1      THR  78  -0.641  12.811  -1.501
  565   1HG2  THR  78          21HG      THR  78  -2.828  11.333  -4.505
  566   2HG2  THR  78          22HG      THR  78  -2.139  12.960  -4.434
  567   3HG2  THR  78          23HG      THR  78  -3.629  12.577  -3.563
  568    H    VAL  79           H        VAL  79  -1.413   8.752  -2.761
  569    HA   VAL  79           HA       VAL  79  -3.199   7.901  -4.754
  570    HB   VAL  79           HB       VAL  79  -1.262   6.142  -3.227
  571   1HG1  VAL  79          11HG      VAL  79  -2.867   4.899  -4.623
  572   2HG1  VAL  79          12HG      VAL  79  -1.245   4.751  -5.251
  573   3HG1  VAL  79          13HG      VAL  79  -2.389   5.842  -6.028
  574   1HG2  VAL  79          21HG      VAL  79  -0.825   7.875  -5.639
  575   2HG2  VAL  79          22HG      VAL  79   0.325   6.673  -5.046
  576   3HG2  VAL  79          23HG      VAL  79  -0.093   8.067  -4.050
  577    H    LEU  80           H        LEU  80  -2.707   6.688  -1.476
  578    HA   LEU  80           HA       LEU  80  -4.797   4.781  -1.594
  579   1HB   LEU  80          1HB       LEU  80  -3.302   5.993   0.728
  580   2HB   LEU  80          2HB       LEU  80  -4.584   4.838   0.971
  581    HG   LEU  80           HG       LEU  80  -2.541   3.656   1.187
  582   1HD1  LEU  80          11HD      LEU  80  -2.640   1.973  -0.469
  583   2HD1  LEU  80          12HD      LEU  80  -3.500   3.051  -1.569
  584   3HD1  LEU  80          13HD      LEU  80  -4.276   2.516  -0.077
  585   1HD2  LEU  80          21HD      LEU  80  -1.668   4.727  -1.488
  586   2HD2  LEU  80          22HD      LEU  80  -0.792   3.558  -0.497
  587   3HD2  LEU  80          23HD      LEU  80  -1.023   5.207   0.080
  588    H    ARG  81           H        ARG  81  -4.933   8.120  -1.332
  589    HA   ARG  81           HA       ARG  81  -7.579   8.096  -0.105
  590   1HB   ARG  81          1HB       ARG  81  -6.146   9.775   0.825
  591   2HB   ARG  81          2HB       ARG  81  -5.631  10.314  -0.752
  592   1HG   ARG  81          1HG       ARG  81  -8.498  10.647  -0.030
  593   2HG   ARG  81          2HG       ARG  81  -7.318  11.708   0.741
  594   1HD   ARG  81          1HD       ARG  81  -6.490  12.383  -1.466
  595   2HD   ARG  81          2HD       ARG  81  -7.651  11.312  -2.235
  596    HE   ARG  81           HE       ARG  81  -9.381  12.754  -1.117
  597   1HH1  ARG  81          11HH      ARG  81  -6.170  14.107  -1.925
  598   2HH1  ARG  81          12HH      ARG  81  -6.783  15.646  -2.275
  599   1HH2  ARG  81          21HH      ARG  81 -10.178  14.922  -1.643
  600   2HH2  ARG  81          22HH      ARG  81  -9.061  16.127  -2.103
  601    H    ASN  82           H        ASN  82  -6.054   8.292  -3.149
  602    HA   ASN  82           HA       ASN  82  -8.323   9.435  -4.552
  603   1HB   ASN  82          1HB       ASN  82  -5.654   8.381  -5.446
  604   2HB   ASN  82          2HB       ASN  82  -6.924   8.669  -6.616
  605   1HD2  ASN  82          21HD      ASN  82  -6.277  10.680  -3.784
  606   2HD2  ASN  82          22HD      ASN  82  -5.800  12.070  -4.702
  607    H    THR  83           H        THR  83  -7.175   6.334  -3.666
  608    HA   THR  83           HA       THR  83  -8.309   4.786  -5.662
  609    HB   THR  83           HB       THR  83  -8.146   3.009  -3.816
  610    HG1  THR  83           HG1      THR  83  -8.131   4.830  -2.208
  611   1HG2  THR  83          21HG      THR  83  -5.706   2.963  -4.039
  612   2HG2  THR  83          22HG      THR  83  -5.720   4.622  -4.610
  613   3HG2  THR  83          23HG      THR  83  -6.461   3.346  -5.587
  614    H    LYS  84           H        LYS  84 -10.007   3.288  -5.476
  615    HA   LYS  84           HA       LYS  84 -12.383   4.230  -4.027
  616   1HB   LYS  84          1HB       LYS  84 -13.752   3.797  -5.982
  617   2HB   LYS  84          2HB       LYS  84 -12.507   4.953  -6.413
  618   1HG   LYS  84          1HG       LYS  84 -12.758   2.067  -7.128
  619   2HG   LYS  84          2HG       LYS  84 -12.928   3.440  -8.234
  620   1HD   LYS  84          1HD       LYS  84 -10.444   3.879  -7.462
  621   2HD   LYS  84          2HD       LYS  84 -10.611   2.190  -6.964
  622   1HE   LYS  84          1HE       LYS  84 -11.061   3.151  -9.803
  623   2HE   LYS  84          2HE       LYS  84  -9.540   2.480  -9.240
  624   1HZ   LYS  84          1HZ       LYS  84 -10.702   0.404  -8.737
  625   2HZ   LYS  84          2HZ       LYS  84 -10.841   0.828 -10.353
  626   3HZ   LYS  84          3HZ       LYS  84 -12.147   1.060  -9.342
  627    H    GLY  85           H        GLY  85 -13.746   2.072  -5.439
  628   1HA   GLY  85          1HA       GLY  85 -13.626   0.185  -3.329
  629   2HA   GLY  85          2HA       GLY  85 -14.568  -0.002  -4.788
  630    H    ASN  86           H        ASN  86 -13.121  -0.453  -6.781
  631    HA   ASN  86           HA       ASN  86 -11.592  -2.809  -6.057
  632   1HB   ASN  86          1HB       ASN  86 -12.276  -1.619  -8.734
  633   2HB   ASN  86          2HB       ASN  86 -11.039  -2.849  -8.596
  634   1HD2  ASN  86          21HD      ASN  86 -13.961  -2.807  -6.635
  635   2HD2  ASN  86          22HD      ASN  86 -14.667  -4.188  -7.386
  636    H    VAL  87           H        VAL  87  -9.677  -2.637  -5.313
  637    HA   VAL  87           HA       VAL  87  -7.853  -0.621  -6.486
  638    HB   VAL  87           HB       VAL  87  -7.424  -1.707  -3.776
  639   1HG1  VAL  87          11HG      VAL  87  -5.683  -0.435  -4.737
  640   2HG1  VAL  87          12HG      VAL  87  -6.365   0.449  -3.370
  641   3HG1  VAL  87          13HG      VAL  87  -6.762   0.933  -5.024
  642   1HG2  VAL  87          21HG      VAL  87  -9.309   0.582  -4.292
  643   2HG2  VAL  87          22HG      VAL  87  -8.697   0.054  -2.709
  644   3HG2  VAL  87          23HG      VAL  87  -9.695  -1.029  -3.681
  645    H    ARG  88           H        ARG  88  -5.840  -1.363  -6.934
  646    HA   ARG  88           HA       ARG  88  -5.306  -4.177  -6.340
  647   1HB   ARG  88          1HB       ARG  88  -4.531  -2.436  -8.586
  648   2HB   ARG  88          2HB       ARG  88  -3.443  -3.757  -8.124
  649   1HG   ARG  88          1HG       ARG  88  -4.750  -4.623  -9.771
  650   2HG   ARG  88          2HG       ARG  88  -5.479  -5.193  -8.304
  651   1HD   ARG  88          1HD       ARG  88  -7.234  -4.397  -9.885
  652   2HD   ARG  88          2HD       ARG  88  -7.191  -3.568  -8.325
  653    HE   ARG  88           HE       ARG  88  -6.199  -1.652  -9.428
  654   1HH1  ARG  88          11HH      ARG  88  -7.438  -4.056 -11.695
  655   2HH1  ARG  88          12HH      ARG  88  -7.891  -2.901 -12.857
  656   1HH2  ARG  88          21HH      ARG  88  -6.821  -0.119 -10.934
  657   2HH2  ARG  88          22HH      ARG  88  -7.538  -0.587 -12.431
  658    H    PHE  89           H        PHE  89  -4.433  -4.102  -4.468
  659    HA   PHE  89           HA       PHE  89  -2.304  -2.178  -3.936
  660   1HB   PHE  89          1HB       PHE  89  -3.359  -4.369  -2.123
  661   2HB   PHE  89          2HB       PHE  89  -2.199  -3.117  -1.721
  662    HD1  PHE  89           HD1      PHE  89  -2.895  -0.901  -1.211
  663    HD2  PHE  89           HD2      PHE  89  -5.725  -3.844  -2.361
  664    HE1  PHE  89           HE1      PHE  89  -4.703   0.543  -0.420
  665    HE2  PHE  89           HE2      PHE  89  -7.550  -2.394  -1.578
  666    HZ   PHE  89           HZ       PHE  89  -7.041  -0.192  -0.605
  667    H    VAL  90           H        VAL  90  -0.583  -2.827  -5.117
  668    HA   VAL  90           HA       VAL  90   0.064  -5.628  -5.044
  669    HB   VAL  90           HB       VAL  90   1.484  -3.355  -6.455
  670   1HG1  VAL  90          11HG      VAL  90   1.885  -6.348  -6.705
  671   2HG1  VAL  90          12HG      VAL  90   3.007  -5.212  -5.959
  672   3HG1  VAL  90          13HG      VAL  90   2.689  -5.126  -7.692
  673   1HG2  VAL  90          21HG      VAL  90   0.540  -4.281  -8.518
  674   2HG2  VAL  90          22HG      VAL  90  -0.719  -3.744  -7.403
  675   3HG2  VAL  90          23HG      VAL  90  -0.364  -5.464  -7.572
  676    H    ILE  91           H        ILE  91   0.557  -5.837  -3.027
  677    HA   ILE  91           HA       ILE  91   2.733  -4.325  -1.839
  678    HB   ILE  91           HB       ILE  91   0.465  -6.021  -0.816
  679   1HG1  ILE  91          11HG      ILE  91   1.201  -3.161  -0.331
  680   2HG1  ILE  91          12HG      ILE  91  -0.020  -3.701  -1.476
  681   1HG2  ILE  91          21HG      ILE  91   2.682  -4.885   0.888
  682   2HG2  ILE  91          22HG      ILE  91   2.373  -6.594   0.590
  683   3HG2  ILE  91          23HG      ILE  91   1.199  -5.631   1.485
  684   1HD1  ILE  91          11HD      ILE  91  -0.042  -4.029   1.466
  685   2HD1  ILE  91          12HD      ILE  91  -1.235  -4.656   0.284
  686   3HD1  ILE  91          13HD      ILE  91  -0.986  -2.897   0.463
  687    H    GLY  92           H        GLY  92   4.318  -5.628  -0.743
  688   1HA   GLY  92          1HA       GLY  92   4.382  -8.355  -1.705
  689   2HA   GLY  92          2HA       GLY  92   5.800  -7.351  -1.938
  690    H    ARG  93           H        ARG  93   5.991  -9.603  -0.512
  691    HA   ARG  93           HA       ARG  93   6.714  -8.508   2.075
  692   1HB   ARG  93          1HB       ARG  93   4.302  -9.737   1.852
  693   2HB   ARG  93          2HB       ARG  93   5.321 -11.143   2.095
  694   1HG   ARG  93          1HG       ARG  93   5.162  -8.769   3.937
  695   2HG   ARG  93          2HG       ARG  93   4.301 -10.288   4.167
  696   1HD   ARG  93          1HD       ARG  93   6.385 -11.459   4.439
  697   2HD   ARG  93          2HD       ARG  93   7.301 -10.006   4.045
  698    HE   ARG  93           HE       ARG  93   5.494  -9.680   6.234
  699   1HH1  ARG  93          11HH      ARG  93   8.836 -10.700   5.376
  700   2HH1  ARG  93          12HH      ARG  93   9.419 -10.422   6.924
  701   1HH2  ARG  93          21HH      ARG  93   6.377  -9.282   8.355
  702   2HH2  ARG  93          22HH      ARG  93   8.005  -9.646   8.683
  703    H    GLU  94           H        GLU  94   8.738  -9.321   2.512
  704    HA   GLU  94           HA       GLU  94   9.481 -11.602   0.990
  705   1HB   GLU  94          1HB       GLU  94  11.879 -10.967   1.627
  706   2HB   GLU  94          2HB       GLU  94  10.974  -9.923   0.551
  707   1HG   GLU  94          1HG       GLU  94  12.277  -8.528   1.938
  708   2HG   GLU  94          2HG       GLU  94  10.606  -8.353   2.429
  Start of MODEL   11
    1   1H    GLY   1          1H        GLY   1  12.494 -15.681   1.828
    2   2H    GLY   1          2H        GLY   1  11.542 -15.858   0.438
    3   3H    GLY   1          3H        GLY   1  11.583 -14.375   1.238
    4   1HA   GLY   1          1HA       GLY   1  13.902 -14.103   0.663
    5   2HA   GLY   1          2HA       GLY   1  13.848 -15.658  -0.169
    6    H    HIS   2           H        HIS   2  14.092 -12.621  -0.869
    7    HA   HIS   2           HA       HIS   2  13.635 -11.245  -2.567
    8   1HB   HIS   2          1HB       HIS   2  13.968 -13.177  -4.080
    9   2HB   HIS   2          2HB       HIS   2  12.299 -13.670  -3.848
   10    HD1  HIS   2           HD1      HIS   2  14.433 -11.399  -5.905
   11    HD2  HIS   2           HD2      HIS   2  10.391 -12.041  -5.180
   12    HE1  HIS   2           HE1      HIS   2  13.196 -10.152  -7.690
   13    H    MET   3           H        MET   3  12.067  -9.684  -2.996
   14    HA   MET   3           HA       MET   3   9.703 -10.116  -1.415
   15   1HB   MET   3          1HB       MET   3  10.997  -7.966  -1.270
   16   2HB   MET   3          2HB       MET   3  10.484  -7.619  -2.918
   17   1HG   MET   3          1HG       MET   3   8.206  -7.534  -2.274
   18   2HG   MET   3          2HG       MET   3   8.577  -8.092  -0.640
   19   1HE   MET   3          1HE       MET   3   7.388  -6.115   0.602
   20   2HE   MET   3          2HE       MET   3   6.786  -5.575  -0.967
   21   3HE   MET   3          3HE       MET   3   7.545  -4.420   0.131
   22    H    GLU   4           H        GLU   4   8.270 -11.210  -2.293
   23    HA   GLU   4           HA       GLU   4   7.729 -11.314  -5.133
   24   1HB   GLU   4          1HB       GLU   4   7.578 -13.347  -3.801
   25   2HB   GLU   4          2HB       GLU   4   6.416 -12.585  -2.729
   26   1HG   GLU   4          1HG       GLU   4   4.837 -12.441  -4.648
   27   2HG   GLU   4          2HG       GLU   4   5.997 -13.349  -5.610
   28    H    LEU   5           H        LEU   5   6.813  -9.492  -5.878
   29    HA   LEU   5           HA       LEU   5   4.827  -8.134  -4.324
   30   1HB   LEU   5          1HB       LEU   5   5.649  -7.656  -7.194
   31   2HB   LEU   5          2HB       LEU   5   4.634  -6.612  -6.231
   32    HG   LEU   5           HG       LEU   5   6.635  -5.504  -6.201
   33   1HD1  LEU   5          11HD      LEU   5   5.816  -5.768  -3.980
   34   2HD1  LEU   5          12HD      LEU   5   7.578  -5.615  -4.020
   35   3HD1  LEU   5          13HD      LEU   5   6.831  -7.199  -3.778
   36   1HD2  LEU   5          21HD      LEU   5   8.112  -8.094  -5.809
   37   2HD2  LEU   5          22HD      LEU   5   8.844  -6.496  -5.949
   38   3HD2  LEU   5          23HD      LEU   5   7.987  -7.201  -7.324
   39    H    PHE   6           H        PHE   6   2.711  -8.376  -4.472
   40    HA   PHE   6           HA       PHE   6   1.666  -9.820  -6.728
   41   1HB   PHE   6          1HB       PHE   6   0.155 -11.024  -5.055
   42   2HB   PHE   6          2HB       PHE   6   1.784 -11.648  -5.273
   43    HD1  PHE   6           HD1      PHE   6  -0.481  -9.715  -3.152
   44    HD2  PHE   6           HD2      PHE   6   3.237 -11.711  -3.388
   45    HE1  PHE   6           HE1      PHE   6  -0.256  -9.560  -0.684
   46    HE2  PHE   6           HE2      PHE   6   3.493 -11.576  -0.959
   47    HZ   PHE   6           HZ       PHE   6   1.743 -10.498   0.410
   48    HA   PRO   7           HA       PRO   7  -1.389  -6.691  -6.444
   49   1HB   PRO   7          1HB       PRO   7  -3.205  -7.697  -8.054
   50   2HB   PRO   7          2HB       PRO   7  -1.686  -7.061  -8.670
   51   1HG   PRO   7          1HG       PRO   7  -2.466  -9.933  -8.202
   52   2HG   PRO   7          2HG       PRO   7  -1.550  -9.246  -9.567
   53   1HD   PRO   7          1HD       PRO   7  -0.448 -10.530  -7.396
   54   2HD   PRO   7          2HD       PRO   7   0.409  -9.306  -8.366
   55    H    VAL   8           H        VAL   8  -2.736  -6.384  -4.856
   56    HA   VAL   8           HA       VAL   8  -4.641  -8.497  -4.201
   57    HB   VAL   8           HB       VAL   8  -3.855  -6.192  -2.421
   58   1HG1  VAL   8          11HG      VAL   8  -5.297  -8.746  -1.796
   59   2HG1  VAL   8          12HG      VAL   8  -5.973  -7.117  -1.884
   60   3HG1  VAL   8          13HG      VAL   8  -4.814  -7.523  -0.614
   61   1HG2  VAL   8          21HG      VAL   8  -2.454  -7.764  -1.121
   62   2HG2  VAL   8          22HG      VAL   8  -1.860  -7.459  -2.754
   63   3HG2  VAL   8          23HG      VAL   8  -2.690  -8.970  -2.397
   64    H    GLU   9           H        GLU   9  -6.265  -7.818  -5.649
   65    HA   GLU   9           HA       GLU   9  -7.016  -5.054  -5.648
   66   1HB   GLU   9          1HB       GLU   9  -7.344  -6.470  -7.686
   67   2HB   GLU   9          2HB       GLU   9  -8.493  -7.437  -6.769
   68   1HG   GLU   9          1HG       GLU   9  -9.944  -5.492  -6.506
   69   2HG   GLU   9          2HG       GLU   9  -8.804  -4.517  -7.431
   70    H    LEU  10           H        LEU  10  -7.956  -4.245  -3.998
   71    HA   LEU  10           HA       LEU  10  -9.587  -5.992  -2.325
   72   1HB   LEU  10          1HB       LEU  10  -7.762  -4.075  -1.708
   73   2HB   LEU  10          2HB       LEU  10  -9.280  -3.164  -1.669
   74    HG   LEU  10           HG       LEU  10  -8.775  -3.823   0.549
   75   1HD1  LEU  10          11HD      LEU  10 -10.880  -5.643  -0.565
   76   2HD1  LEU  10          12HD      LEU  10 -11.112  -4.008   0.039
   77   3HD1  LEU  10          13HD      LEU  10 -10.649  -5.303   1.142
   78   1HD2  LEU  10          21HD      LEU  10  -8.369  -6.142   1.196
   79   2HD2  LEU  10          22HD      LEU  10  -7.154  -5.549   0.063
   80   3HD2  LEU  10          23HD      LEU  10  -8.435  -6.625  -0.498
   81    H    GLU  11           H        GLU  11 -11.679  -5.903  -2.678
   82    HA   GLU  11           HA       GLU  11 -12.650  -3.733  -4.330
   83   1HB   GLU  11          1HB       GLU  11 -13.147  -6.059  -5.036
   84   2HB   GLU  11          2HB       GLU  11 -14.065  -6.288  -3.558
   85   1HG   GLU  11          1HG       GLU  11 -15.737  -4.776  -4.247
   86   2HG   GLU  11          2HG       GLU  11 -14.733  -4.157  -5.559
   87    H    LYS  12           H        LYS  12 -12.732  -2.121  -3.003
   88    HA   LYS  12           HA       LYS  12 -14.214  -2.328  -0.542
   89   1HB   LYS  12          1HB       LYS  12 -12.271  -0.279  -1.599
   90   2HB   LYS  12          2HB       LYS  12 -13.362   0.146  -0.289
   91   1HG   LYS  12          1HG       LYS  12 -11.354  -2.085  -0.304
   92   2HG   LYS  12          2HG       LYS  12 -11.168  -0.519   0.486
   93   1HD   LYS  12          1HD       LYS  12 -13.637  -1.766   1.234
   94   2HD   LYS  12          2HD       LYS  12 -12.269  -2.837   1.624
   95   1HE   LYS  12          1HE       LYS  12 -12.722  -1.563   3.539
   96   2HE   LYS  12          2HE       LYS  12 -11.314  -0.849   2.854
   97   1HZ   LYS  12          1HZ       LYS  12 -14.070   0.280   2.427
   98   2HZ   LYS  12          2HZ       LYS  12 -12.682   0.980   1.871
   99   3HZ   LYS  12          3HZ       LYS  12 -12.970   0.871   3.518
  100    H    ASP  13           H        ASP  13 -15.140   0.005  -0.154
  101    HA   ASP  13           HA       ASP  13 -17.554   0.151  -1.695
  102   1HB   ASP  13          1HB       ASP  13 -18.077   1.727   0.209
  103   2HB   ASP  13          2HB       ASP  13 -17.714   0.057   0.664
  104    H    GLU  14           H        GLU  14 -18.366   2.591  -1.473
  105    HA   GLU  14           HA       GLU  14 -16.928   4.130  -3.415
  106   1HB   GLU  14          1HB       GLU  14 -18.810   5.707  -3.234
  107   2HB   GLU  14          2HB       GLU  14 -19.364   4.057  -3.480
  108   1HG   GLU  14          1HG       GLU  14 -19.879   3.878  -1.091
  109   2HG   GLU  14          2HG       GLU  14 -19.307   5.525  -0.844
  110    H    ASP  15           H        ASP  15 -16.992   4.040  -0.007
  111    HA   ASP  15           HA       ASP  15 -16.279   6.779   0.464
  112   1HB   ASP  15          1HB       ASP  15 -17.433   5.486   2.190
  113   2HB   ASP  15          2HB       ASP  15 -16.148   4.304   2.206
  114    H    GLY  16           H        GLY  16 -14.681   3.697   0.139
  115   1HA   GLY  16          1HA       GLY  16 -12.659   3.871  -1.315
  116   2HA   GLY  16          2HA       GLY  16 -12.170   5.210  -0.286
  117    H    LEU  17           H        LEU  17 -10.581   4.634   0.953
  118    HA   LEU  17           HA       LEU  17 -10.610   1.903   2.093
  119   1HB   LEU  17          1HB       LEU  17  -8.231   3.742   2.021
  120   2HB   LEU  17          2HB       LEU  17  -8.281   2.026   2.354
  121    HG   LEU  17           HG       LEU  17  -8.726   3.348  -0.238
  122   1HD1  LEU  17          11HD      LEU  17  -6.443   1.698   0.818
  123   2HD1  LEU  17          12HD      LEU  17  -6.426   3.418   0.425
  124   3HD1  LEU  17          13HD      LEU  17  -6.600   2.221  -0.857
  125   1HD2  LEU  17          21HD      LEU  17  -8.739   0.415   0.482
  126   2HD2  LEU  17          22HD      LEU  17  -8.667   1.018  -1.167
  127   3HD2  LEU  17          23HD      LEU  17 -10.081   1.359  -0.167
  128    H    GLY  18           H        GLY  18  -9.690   5.242   2.680
  129   1HA   GLY  18          1HA       GLY  18  -9.651   6.499   4.560
  130   2HA   GLY  18          2HA       GLY  18 -10.687   5.298   5.328
  131    H    ILE  19           H        ILE  19  -7.634   4.455   3.872
  132    HA   ILE  19           HA       ILE  19  -6.778   3.713   6.568
  133    HB   ILE  19           HB       ILE  19  -5.140   2.233   5.633
  134   1HG1  ILE  19          11HG      ILE  19  -5.935   3.225   2.894
  135   2HG1  ILE  19          12HG      ILE  19  -4.464   3.705   3.740
  136   1HG2  ILE  19          21HG      ILE  19  -7.397   1.373   5.730
  137   2HG2  ILE  19          22HG      ILE  19  -6.597   0.725   4.294
  138   3HG2  ILE  19          23HG      ILE  19  -7.748   2.061   4.161
  139   1HD1  ILE  19          11HD      ILE  19  -3.969   1.973   2.112
  140   2HD1  ILE  19          12HD      ILE  19  -5.165   0.910   2.853
  141   3HD1  ILE  19          13HD      ILE  19  -3.715   1.369   3.748
  142    H    SER  20           H        SER  20  -4.238   3.739   6.754
  143    HA   SER  20           HA       SER  20  -3.306   6.391   5.953
  144   1HB   SER  20          1HB       SER  20  -3.186   5.178   8.720
  145   2HB   SER  20          2HB       SER  20  -2.451   6.705   8.250
  146    HG   SER  20           HG       SER  20  -4.984   6.771   7.504
  147    H    ILE  21           H        ILE  21  -1.078   6.573   5.834
  148    HA   ILE  21           HA       ILE  21   0.392   4.015   5.714
  149    HB   ILE  21           HB       ILE  21   1.697   4.972   3.881
  150   1HG1  ILE  21          11HG      ILE  21   0.336   7.037   2.750
  151   2HG1  ILE  21          12HG      ILE  21   0.051   7.374   4.433
  152   1HG2  ILE  21          21HG      ILE  21   0.010   4.850   2.112
  153   2HG2  ILE  21          22HG      ILE  21  -1.257   4.961   3.334
  154   3HG2  ILE  21          23HG      ILE  21  -0.169   3.572   3.313
  155   1HD1  ILE  21          11HD      ILE  21   2.475   7.472   4.863
  156   2HD1  ILE  21          12HD      ILE  21   2.020   8.630   3.633
  157   3HD1  ILE  21          13HD      ILE  21   2.802   7.142   3.172
  158    H    ILE  22           H        ILE  22   2.680   4.238   6.137
  159    HA   ILE  22           HA       ILE  22   3.232   6.706   7.496
  160    HB   ILE  22           HB       ILE  22   2.952   5.035   9.207
  161   1HG1  ILE  22          11HG      ILE  22   5.882   5.735   8.917
  162   2HG1  ILE  22          12HG      ILE  22   4.641   6.788   9.580
  163   1HG2  ILE  22          21HG      ILE  22   3.417   3.035   7.993
  164   2HG2  ILE  22          22HG      ILE  22   4.460   3.102   9.419
  165   3HG2  ILE  22          23HG      ILE  22   5.116   3.488   7.824
  166   1HD1  ILE  22          11HD      ILE  22   5.550   4.169  10.745
  167   2HD1  ILE  22          12HD      ILE  22   4.291   5.206  11.410
  168   3HD1  ILE  22          13HD      ILE  22   5.958   5.778  11.341
  169    H    GLY  23           H        GLY  23   5.080   7.705   7.049
  170   1HA   GLY  23          1HA       GLY  23   6.494   6.644   4.766
  171   2HA   GLY  23          2HA       GLY  23   6.577   8.297   5.359
  172    H    MET  24           H        MET  24   7.816   5.107   5.553
  173    HA   MET  24           HA       MET  24   9.976   5.998   7.395
  174   1HB   MET  24          1HB       MET  24   9.135   3.174   6.679
  175   2HB   MET  24          2HB       MET  24  10.362   3.632   7.844
  176   1HG   MET  24          1HG       MET  24   7.397   4.109   8.092
  177   2HG   MET  24          2HG       MET  24   8.334   2.892   8.949
  178   1HE   MET  24          1HE       MET  24  10.548   5.092  11.324
  179   2HE   MET  24          2HE       MET  24  10.991   4.518   9.719
  180   3HE   MET  24          3HE       MET  24  10.123   3.453  10.827
  181    H    GLY  25           H        GLY  25  11.945   4.558   6.835
  182   1HA   GLY  25          1HA       GLY  25  12.257   4.695   3.911
  183   2HA   GLY  25          2HA       GLY  25  13.441   5.438   4.979
  184    H    VAL  26           H        VAL  26  12.187   2.450   3.741
  185    HA   VAL  26           HA       VAL  26  14.445   1.168   5.006
  186    HB   VAL  26           HB       VAL  26  12.335  -0.046   5.349
  187   1HG1  VAL  26          11HG      VAL  26  11.161  -1.215   3.577
  188   2HG1  VAL  26          12HG      VAL  26  12.228  -0.476   2.385
  189   3HG1  VAL  26          13HG      VAL  26  11.144   0.535   3.336
  190   1HG2  VAL  26          21HG      VAL  26  14.277  -1.569   3.622
  191   2HG2  VAL  26          22HG      VAL  26  13.049  -2.301   4.653
  192   3HG2  VAL  26          23HG      VAL  26  14.355  -1.360   5.374
  193    H    GLY  27           H        GLY  27  15.885   2.267   3.816
  194   1HA   GLY  27          1HA       GLY  27  16.698   0.901   1.465
  195   2HA   GLY  27          2HA       GLY  27  16.188   2.573   1.190
  196    H    ALA  28           H        ALA  28  18.417   2.790   0.530
  197    HA   ALA  28           HA       ALA  28  20.485   3.544   0.737
  198   1HB   ALA  28          1HB       ALA  28  19.387   5.305   1.977
  199   2HB   ALA  28          2HB       ALA  28  21.012   5.002   2.637
  200   3HB   ALA  28          3HB       ALA  28  19.564   4.371   3.456
  201    H    ASP  29           H        ASP  29  20.289   2.681   4.118
  202    HA   ASP  29           HA       ASP  29  22.610   0.968   3.681
  203   1HB   ASP  29          1HB       ASP  29  22.706   2.624   5.539
  204   2HB   ASP  29          2HB       ASP  29  21.344   1.816   6.299
  205    H    ALA  30           H        ALA  30  19.328   0.774   3.945
  206    HA   ALA  30           HA       ALA  30  19.293  -1.977   4.774
  207   1HB   ALA  30          1HB       ALA  30  17.068   0.001   4.179
  208   2HB   ALA  30          2HB       ALA  30  17.563  -0.554   5.779
  209   3HB   ALA  30          3HB       ALA  30  16.820  -1.684   4.645
  210    H    GLY  31           H        GLY  31  20.018  -2.897   3.285
  211   1HA   GLY  31          1HA       GLY  31  20.567  -2.620   0.597
  212   2HA   GLY  31          2HA       GLY  31  20.275  -4.164   1.361
  213    H    LEU  32           H        LEU  32  17.552  -2.216   1.145
  214    HA   LEU  32           HA       LEU  32  16.601  -3.869  -1.068
  215   1HB   LEU  32          1HB       LEU  32  15.008  -2.251   0.897
  216   2HB   LEU  32          2HB       LEU  32  14.363  -3.381  -0.274
  217    HG   LEU  32           HG       LEU  32  15.829  -3.914   2.287
  218   1HD1  LEU  32          11HD      LEU  32  13.932  -5.345   2.789
  219   2HD1  LEU  32          12HD      LEU  32  13.204  -4.901   1.247
  220   3HD1  LEU  32          13HD      LEU  32  13.468  -3.671   2.486
  221   1HD2  LEU  32          21HD      LEU  32  16.949  -5.354   0.743
  222   2HD2  LEU  32          22HD      LEU  32  15.421  -5.919   0.054
  223   3HD2  LEU  32          23HD      LEU  32  15.858  -6.347   1.712
  224    H    GLU  33           H        GLU  33  16.963  -0.608   0.230
  225    HA   GLU  33           HA       GLU  33  16.607   1.393  -0.524
  226   1HB   GLU  33          1HB       GLU  33  17.842   0.186  -2.974
  227   2HB   GLU  33          2HB       GLU  33  17.655   1.917  -2.718
  228   1HG   GLU  33          1HG       GLU  33  18.986   1.664  -0.621
  229   2HG   GLU  33          2HG       GLU  33  19.286  -0.004  -1.092
  230    H    LYS  34           H        LYS  34  14.327   1.225  -0.307
  231    HA   LYS  34           HA       LYS  34  13.075   1.983  -2.725
  232   1HB   LYS  34          1HB       LYS  34  11.315   0.294  -2.561
  233   2HB   LYS  34          2HB       LYS  34  12.892  -0.438  -2.824
  234   1HG   LYS  34          1HG       LYS  34  12.953  -0.857  -0.308
  235   2HG   LYS  34          2HG       LYS  34  11.241  -0.429  -0.308
  236   1HD   LYS  34          1HD       LYS  34  12.530  -2.673  -1.880
  237   2HD   LYS  34          2HD       LYS  34  11.515  -2.846  -0.453
  238   1HE   LYS  34          1HE       LYS  34   9.600  -2.006  -1.660
  239   2HE   LYS  34          2HE       LYS  34  10.598  -1.630  -3.061
  240   1HZ   LYS  34          1HZ       LYS  34  10.083  -4.356  -1.993
  241   2HZ   LYS  34          2HZ       LYS  34  11.072  -3.994  -3.294
  242   3HZ   LYS  34          3HZ       LYS  34   9.425  -3.697  -3.404
  243    H    LEU  35           H        LEU  35  10.587   1.997  -1.901
  244    HA   LEU  35           HA       LEU  35  10.397   4.180  -0.155
  245   1HB   LEU  35          1HB       LEU  35   8.008   3.806  -0.349
  246   2HB   LEU  35          2HB       LEU  35   8.786   3.677  -1.912
  247    HG   LEU  35           HG       LEU  35   8.790   1.086  -1.094
  248   1HD1  LEU  35          11HD      LEU  35   7.520   1.362   0.841
  249   2HD1  LEU  35          12HD      LEU  35   6.504   0.557  -0.350
  250   3HD1  LEU  35          13HD      LEU  35   6.275   2.266  -0.016
  251   1HD2  LEU  35          21HD      LEU  35   8.254   1.769  -3.199
  252   2HD2  LEU  35          22HD      LEU  35   6.718   2.523  -2.701
  253   3HD2  LEU  35          23HD      LEU  35   6.919   0.756  -2.641
  254    H    GLY  36           H        GLY  36   9.575   4.241   1.953
  255   1HA   GLY  36          1HA       GLY  36   9.545   1.664   3.360
  256   2HA   GLY  36          2HA       GLY  36  10.061   3.190   4.098
  257    H    ILE  37           H        ILE  37   7.424   2.877   1.908
  258    HA   ILE  37           HA       ILE  37   5.713   4.004   3.890
  259    HB   ILE  37           HB       ILE  37   4.903   3.072   1.130
  260   1HG1  ILE  37          11HG      ILE  37   6.741   4.770   1.142
  261   2HG1  ILE  37          12HG      ILE  37   5.265   5.352   0.334
  262   1HG2  ILE  37          21HG      ILE  37   3.618   4.958   3.088
  263   2HG2  ILE  37          22HG      ILE  37   3.062   3.341   2.690
  264   3HG2  ILE  37          23HG      ILE  37   3.016   4.615   1.463
  265   1HD1  ILE  37          11HD      ILE  37   4.795   6.532   2.519
  266   2HD1  ILE  37          12HD      ILE  37   6.192   7.100   1.615
  267   3HD1  ILE  37          13HD      ILE  37   6.423   6.034   3.007
  268    H    PHE  38           H        PHE  38   5.130   2.740   5.368
  269    HA   PHE  38           HA       PHE  38   4.139   0.065   4.714
  270   1HB   PHE  38          1HB       PHE  38   4.879   1.350   7.324
  271   2HB   PHE  38          2HB       PHE  38   4.207  -0.280   7.180
  272    HD1  PHE  38           HD1      PHE  38   7.199   1.741   6.936
  273    HD2  PHE  38           HD2      PHE  38   5.518  -2.054   6.023
  274    HE1  PHE  38           HE1      PHE  38   9.460   0.830   6.592
  275    HE2  PHE  38           HE2      PHE  38   7.779  -2.974   5.679
  276    HZ   PHE  38           HZ       PHE  38   9.750  -1.531   5.960
  277    H    VAL  39           H        VAL  39   2.148  -0.563   5.700
  278    HA   VAL  39           HA       VAL  39   0.216   1.523   5.591
  279    HB   VAL  39           HB       VAL  39  -0.130  -1.324   6.603
  280   1HG1  VAL  39          11HG      VAL  39  -2.489  -1.002   6.018
  281   2HG1  VAL  39          12HG      VAL  39  -2.147   0.665   5.557
  282   3HG1  VAL  39          13HG      VAL  39  -1.960   0.159   7.236
  283   1HG2  VAL  39          21HG      VAL  39  -0.870  -1.872   4.315
  284   2HG2  VAL  39          22HG      VAL  39   0.799  -1.287   4.324
  285   3HG2  VAL  39          23HG      VAL  39  -0.490  -0.225   3.810
  286    H    LYS  40           H        LYS  40  -0.379   2.748   7.214
  287    HA   LYS  40           HA       LYS  40   0.922   2.330   9.776
  288   1HB   LYS  40          1HB       LYS  40   1.120   4.541   8.835
  289   2HB   LYS  40          2HB       LYS  40  -0.614   4.658   8.638
  290   1HG   LYS  40          1HG       LYS  40   0.215   5.992  10.498
  291   2HG   LYS  40          2HG       LYS  40  -0.928   4.748  11.006
  292   1HD   LYS  40          1HD       LYS  40   0.967   3.328  11.690
  293   2HD   LYS  40          2HD       LYS  40   2.077   4.633  11.249
  294   1HE   LYS  40          1HE       LYS  40   1.029   6.088  12.825
  295   2HE   LYS  40          2HE       LYS  40  -0.152   4.849  13.235
  296   1HZ   LYS  40          1HZ       LYS  40   2.777   4.574  13.647
  297   2HZ   LYS  40          2HZ       LYS  40   1.601   3.490  14.169
  298   3HZ   LYS  40          3HZ       LYS  40   1.695   5.050  14.837
  299    H    THR  41           H        THR  41  -2.309   2.837   8.462
  300    HA   THR  41           HA       THR  41  -3.457   1.395  10.701
  301    HB   THR  41           HB       THR  41  -4.798   3.846   9.890
  302    HG1  THR  41           HG1      THR  41  -3.171   4.372  12.072
  303   1HG2  THR  41          21HG      THR  41  -4.405   2.516  12.572
  304   2HG2  THR  41          22HG      THR  41  -5.819   2.398  11.519
  305   3HG2  THR  41          23HG      THR  41  -5.421   3.933  12.293
  306    H    VAL  42           H        VAL  42  -5.641   0.851  10.115
  307    HA   VAL  42           HA       VAL  42  -6.267   1.273   7.307
  308    HB   VAL  42           HB       VAL  42  -7.046  -1.190   8.958
  309   1HG1  VAL  42          11HG      VAL  42  -7.575  -2.203   6.734
  310   2HG1  VAL  42          12HG      VAL  42  -7.313  -0.607   6.022
  311   3HG1  VAL  42          13HG      VAL  42  -8.604  -0.853   7.200
  312   1HG2  VAL  42          21HG      VAL  42  -5.417  -2.466   7.652
  313   2HG2  VAL  42          22HG      VAL  42  -4.649  -1.213   8.627
  314   3HG2  VAL  42          23HG      VAL  42  -4.866  -0.972   6.892
  315    H    THR  43           H        THR  43  -8.821   0.986   7.178
  316    HA   THR  43           HA       THR  43 -10.153   2.762   8.893
  317    HB   THR  43           HB       THR  43 -11.114   2.342   6.680
  318    HG1  THR  43           HG1      THR  43 -13.003   2.581   7.447
  319   1HG2  THR  43          21HG      THR  43 -11.333  -0.541   7.502
  320   2HG2  THR  43          22HG      THR  43 -10.215   0.126   6.306
  321   3HG2  THR  43          23HG      THR  43 -11.946   0.149   5.999
  322    H    GLU  44           H        GLU  44 -12.283   1.877  10.052
  323    HA   GLU  44           HA       GLU  44 -11.671   0.426  12.345
  324   1HB   GLU  44          1HB       GLU  44 -14.142   0.313  12.567
  325   2HB   GLU  44          2HB       GLU  44 -13.558   1.937  12.226
  326   1HG   GLU  44          1HG       GLU  44 -14.102   1.622   9.875
  327   2HG   GLU  44          2HG       GLU  44 -14.682   0.007  10.240
  328    H    GLY  45           H        GLY  45 -12.752  -0.561   9.244
  329   1HA   GLY  45          1HA       GLY  45 -11.936  -3.234   9.680
  330   2HA   GLY  45          2HA       GLY  45 -13.687  -3.078   9.679
  331    H    GLY  46           H        GLY  46 -14.590  -1.785   7.821
  332   1HA   GLY  46          1HA       GLY  46 -15.146  -1.909   5.779
  333   2HA   GLY  46          2HA       GLY  46 -13.446  -1.584   5.460
  334    H    ALA  47           H        ALA  47 -14.559  -2.823   3.818
  335    HA   ALA  47           HA       ALA  47 -14.355  -5.667   3.894
  336   1HB   ALA  47          1HB       ALA  47 -15.589  -4.540   2.089
  337   2HB   ALA  47          2HB       ALA  47 -14.364  -5.634   1.447
  338   3HB   ALA  47          3HB       ALA  47 -14.074  -3.896   1.456
  339    H    ALA  48           H        ALA  48 -12.029  -3.394   4.266
  340    HA   ALA  48           HA       ALA  48  -9.792  -4.633   2.858
  341   1HB   ALA  48          1HB       ALA  48  -9.830  -2.393   4.889
  342   2HB   ALA  48          2HB       ALA  48  -9.806  -2.210   3.130
  343   3HB   ALA  48          3HB       ALA  48  -8.429  -2.922   3.960
  344    H    GLN  49           H        GLN  49 -10.454  -3.957   6.372
  345    HA   GLN  49           HA       GLN  49  -8.536  -5.899   7.078
  346   1HB   GLN  49          1HB       GLN  49 -10.584  -4.370   8.653
  347   2HB   GLN  49          2HB       GLN  49  -9.582  -5.598   9.435
  348   1HG   GLN  49          1HG       GLN  49  -7.589  -4.334   8.545
  349   2HG   GLN  49          2HG       GLN  49  -8.736  -3.101   8.035
  350   1HE2  GLN  49          21HE      GLN  49 -10.422  -3.212  10.396
  351   2HE2  GLN  49          22HE      GLN  49  -9.473  -2.592  11.668
  352    H    ARG  50           H        ARG  50 -11.931  -6.005   6.435
  353    HA   ARG  50           HA       ARG  50 -12.123  -8.622   7.510
  354   1HB   ARG  50          1HB       ARG  50 -14.061  -7.048   5.837
  355   2HB   ARG  50          2HB       ARG  50 -14.393  -8.684   6.404
  356   1HG   ARG  50          1HG       ARG  50 -13.714  -6.375   8.189
  357   2HG   ARG  50          2HG       ARG  50 -15.374  -6.931   7.878
  358   1HD   ARG  50          1HD       ARG  50 -14.851  -9.066   8.888
  359   2HD   ARG  50          2HD       ARG  50 -13.158  -8.639   9.065
  360    HE   ARG  50           HE       ARG  50 -14.853  -6.815  10.406
  361   1HH1  ARG  50          11HH      ARG  50 -13.391 -10.047  10.671
  362   2HH1  ARG  50          12HH      ARG  50 -13.446 -10.041  12.378
  363   1HH2  ARG  50          21HH      ARG  50 -14.866  -6.866  12.752
  364   2HH2  ARG  50          22HH      ARG  50 -14.248  -8.237  13.567
  365    H    ASP  51           H        ASP  51 -11.091  -7.341   4.494
  366    HA   ASP  51           HA       ASP  51 -11.313  -9.738   2.968
  367   1HB   ASP  51          1HB       ASP  51 -10.732  -7.596   1.900
  368   2HB   ASP  51          2HB       ASP  51  -9.235  -7.522   2.814
  369    H    GLY  52           H        GLY  52  -8.420  -8.370   4.466
  370   1HA   GLY  52          1HA       GLY  52  -7.143  -9.469   6.138
  371   2HA   GLY  52          2HA       GLY  52  -7.906 -10.973   5.671
  372    H    ARG  53           H        ARG  53  -7.063  -9.913   2.732
  373    HA   ARG  53           HA       ARG  53  -4.649 -11.493   2.805
  374   1HB   ARG  53          1HB       ARG  53  -6.528 -11.351   0.958
  375   2HB   ARG  53          2HB       ARG  53  -5.656  -9.934   0.419
  376   1HG   ARG  53          1HG       ARG  53  -4.381 -12.656   0.641
  377   2HG   ARG  53          2HG       ARG  53  -5.215 -12.106  -0.803
  378   1HD   ARG  53          1HD       ARG  53  -3.635 -10.207  -0.935
  379   2HD   ARG  53          2HD       ARG  53  -2.779 -10.866   0.457
  380    HE   ARG  53           HE       ARG  53  -2.056 -12.680  -0.833
  381   1HH1  ARG  53          11HH      ARG  53  -3.936 -10.418  -2.808
  382   2HH1  ARG  53          12HH      ARG  53  -3.349 -10.960  -4.297
  383   1HH2  ARG  53          21HH      ARG  53  -1.230 -13.439  -2.855
  384   2HH2  ARG  53          22HH      ARG  53  -1.749 -12.757  -4.324
  385    H    ILE  54           H        ILE  54  -5.582  -8.254   2.982
  386    HA   ILE  54           HA       ILE  54  -2.831  -7.238   2.748
  387    HB   ILE  54           HB       ILE  54  -4.761  -6.124   1.447
  388   1HG1  ILE  54          11HG      ILE  54  -3.415  -4.308   3.464
  389   2HG1  ILE  54          12HG      ILE  54  -2.601  -4.965   2.049
  390   1HG2  ILE  54          21HG      ILE  54  -6.235  -4.606   2.784
  391   2HG2  ILE  54          22HG      ILE  54  -5.576  -5.362   4.250
  392   3HG2  ILE  54          23HG      ILE  54  -6.501  -6.325   3.110
  393   1HD1  ILE  54          11HD      ILE  54  -5.036  -3.197   1.981
  394   2HD1  ILE  54          12HD      ILE  54  -4.104  -3.800   0.594
  395   3HD1  ILE  54          13HD      ILE  54  -3.366  -2.670   1.711
  396    H    GLN  55           H        GLN  55  -2.309  -5.543   4.659
  397    HA   GLN  55           HA       GLN  55  -3.723  -6.346   7.061
  398   1HB   GLN  55          1HB       GLN  55  -0.704  -6.310   6.832
  399   2HB   GLN  55          2HB       GLN  55  -1.623  -6.718   8.264
  400   1HG   GLN  55          1HG       GLN  55  -2.522  -8.677   7.059
  401   2HG   GLN  55          2HG       GLN  55  -1.429  -8.296   5.728
  402   1HE2  GLN  55          21HE      GLN  55  -0.248 -10.154   5.939
  403   2HE2  GLN  55          22HE      GLN  55   0.787 -10.457   7.291
  404    H    VAL  56           H        VAL  56  -1.930  -5.032   8.778
  405    HA   VAL  56           HA       VAL  56  -2.040  -2.247   7.905
  406    HB   VAL  56           HB       VAL  56  -3.673  -2.853   9.726
  407   1HG1  VAL  56          11HG      VAL  56  -2.468  -4.562  10.882
  408   2HG1  VAL  56          12HG      VAL  56  -2.842  -3.262  12.020
  409   3HG1  VAL  56          13HG      VAL  56  -1.212  -3.420  11.358
  410   1HG2  VAL  56          21HG      VAL  56  -1.523  -0.898  10.551
  411   2HG2  VAL  56          22HG      VAL  56  -3.152  -0.941  11.221
  412   3HG2  VAL  56          23HG      VAL  56  -2.903  -0.529   9.531
  413    H    ASN  57           H        ASN  57  -0.024  -4.470   7.829
  414    HA   ASN  57           HA       ASN  57   2.164  -3.151   9.320
  415   1HB   ASN  57          1HB       ASN  57   1.335  -5.102  10.627
  416   2HB   ASN  57          2HB       ASN  57   1.728  -6.149   9.274
  417   1HD2  ASN  57          21HD      ASN  57   2.991  -4.169  11.807
  418   2HD2  ASN  57          22HD      ASN  57   4.596  -4.805  11.816
  419    H    ASP  58           H        ASP  58   1.041  -4.303   6.430
  420    HA   ASP  58           HA       ASP  58   3.472  -5.264   5.309
  421   1HB   ASP  58          1HB       ASP  58   1.978  -5.409   3.270
  422   2HB   ASP  58          2HB       ASP  58   1.427  -6.378   4.631
  423    H    GLN  59           H        GLN  59   3.657  -4.319   2.918
  424    HA   GLN  59           HA       GLN  59   4.011  -1.434   3.253
  425   1HB   GLN  59          1HB       GLN  59   6.141  -2.490   3.412
  426   2HB   GLN  59          2HB       GLN  59   5.788  -3.476   1.991
  427   1HG   GLN  59          1HG       GLN  59   5.953  -1.612   0.546
  428   2HG   GLN  59          2HG       GLN  59   5.969  -0.484   1.892
  429   1HE2  GLN  59          21HE      GLN  59   7.798  -0.184   3.016
  430   2HE2  GLN  59          22HE      GLN  59   9.350  -0.704   2.447
  431    H    ILE  60           H        ILE  60   3.089  -0.220   1.783
  432    HA   ILE  60           HA       ILE  60   1.643  -1.291  -0.459
  433    HB   ILE  60           HB       ILE  60   2.346   1.586   0.188
  434   1HG1  ILE  60          11HG      ILE  60   1.015   0.628   2.022
  435   2HG1  ILE  60          12HG      ILE  60   0.073   1.786   1.087
  436   1HG2  ILE  60          21HG      ILE  60   0.143   0.522  -1.536
  437   2HG2  ILE  60          22HG      ILE  60   1.712   0.998  -2.138
  438   3HG2  ILE  60          23HG      ILE  60   0.660   2.215  -1.394
  439   1HD1  ILE  60          11HD      ILE  60  -1.046  -0.058  -0.064
  440   2HD1  ILE  60          12HD      ILE  60  -1.273  -0.133   1.682
  441   3HD1  ILE  60          13HD      ILE  60  -0.114  -1.207   0.899
  442    H    VAL  61           H        VAL  61   2.739  -1.874  -2.272
  443    HA   VAL  61           HA       VAL  61   5.299  -0.569  -2.894
  444    HB   VAL  61           HB       VAL  61   4.019  -3.083  -3.980
  445   1HG1  VAL  61          11HG      VAL  61   5.467  -2.099  -5.637
  446   2HG1  VAL  61          12HG      VAL  61   6.111  -3.601  -4.971
  447   3HG1  VAL  61          13HG      VAL  61   6.795  -2.047  -4.457
  448   1HG2  VAL  61          21HG      VAL  61   5.743  -4.261  -2.690
  449   2HG2  VAL  61          22HG      VAL  61   4.648  -3.331  -1.678
  450   3HG2  VAL  61          23HG      VAL  61   6.268  -2.717  -2.016
  451    H    GLU  62           H        GLU  62   2.284  -1.442  -4.470
  452    HA   GLU  62           HA       GLU  62   2.455   0.892  -6.194
  453   1HB   GLU  62          1HB       GLU  62   3.619  -0.635  -7.538
  454   2HB   GLU  62          2HB       GLU  62   2.542  -1.961  -7.211
  455   1HG   GLU  62          1HG       GLU  62   0.765  -0.724  -8.443
  456   2HG   GLU  62          2HG       GLU  62   1.960   0.509  -8.831
  457    H    VAL  63           H        VAL  63   0.455   1.797  -5.853
  458    HA   VAL  63           HA       VAL  63  -1.734  -0.090  -5.622
  459    HB   VAL  63           HB       VAL  63  -1.162   2.515  -4.251
  460   1HG1  VAL  63          11HG      VAL  63  -3.921   1.394  -4.747
  461   2HG1  VAL  63          12HG      VAL  63  -3.263   2.882  -5.448
  462   3HG1  VAL  63          13HG      VAL  63  -3.504   2.763  -3.702
  463   1HG2  VAL  63          21HG      VAL  63  -0.825   0.309  -3.229
  464   2HG2  VAL  63          22HG      VAL  63  -2.557   0.006  -3.427
  465   3HG2  VAL  63          23HG      VAL  63  -2.009   1.321  -2.392
  466    H    ASP  64           H        ASP  64  -3.129  -0.174  -7.063
  467    HA   ASP  64           HA       ASP  64  -4.577   0.276  -8.729
  468   1HB   ASP  64          1HB       ASP  64  -5.138   2.379  -7.562
  469   2HB   ASP  64          2HB       ASP  64  -3.800   3.190  -8.356
  470    H    GLY  65           H        GLY  65  -1.474   0.645  -8.950
  471   1HA   GLY  65          1HA       GLY  65  -0.182   0.083 -10.886
  472   2HA   GLY  65          2HA       GLY  65  -1.492   0.734 -11.874
  473    H    ILE  66           H        ILE  66  -0.825   2.687  -9.193
  474    HA   ILE  66           HA       ILE  66   0.179   4.773 -10.840
  475    HB   ILE  66           HB       ILE  66  -1.250   4.867  -8.510
  476   1HG1  ILE  66          11HG      ILE  66   0.851   6.927  -9.217
  477   2HG1  ILE  66          12HG      ILE  66  -0.687   6.748 -10.061
  478   1HG2  ILE  66          21HG      ILE  66   1.596   5.124  -7.613
  479   2HG2  ILE  66          22HG      ILE  66   0.437   3.894  -7.104
  480   3HG2  ILE  66          23HG      ILE  66   0.186   5.588  -6.664
  481   1HD1  ILE  66          11HD      ILE  66  -0.299   7.481  -7.179
  482   2HD1  ILE  66          12HD      ILE  66  -1.855   7.237  -7.972
  483   3HD1  ILE  66          13HD      ILE  66  -0.800   8.565  -8.481
  484    H    SER  67           H        SER  67   1.561   2.197  -9.267
  485    HA   SER  67           HA       SER  67   3.565   1.551  -8.419
  486   1HB   SER  67          1HB       SER  67   4.323   3.137 -10.770
  487   2HB   SER  67          2HB       SER  67   5.330   1.826 -10.082
  488    HG   SER  67           HG       SER  67   3.620   0.372 -10.711
  489    H    LEU  68           H        LEU  68   3.635   2.685  -6.484
  490    HA   LEU  68           HA       LEU  68   4.816   5.348  -6.504
  491   1HB   LEU  68          1HB       LEU  68   4.182   5.392  -4.147
  492   2HB   LEU  68          2HB       LEU  68   2.823   5.077  -5.207
  493    HG   LEU  68           HG       LEU  68   4.021   2.621  -4.311
  494   1HD1  LEU  68          11HD      LEU  68   3.024   4.526  -2.202
  495   2HD1  LEU  68          12HD      LEU  68   4.683   3.962  -2.440
  496   3HD1  LEU  68          13HD      LEU  68   3.426   2.811  -1.968
  497   1HD2  LEU  68          21HD      LEU  68   1.864   2.925  -5.325
  498   2HD2  LEU  68          22HD      LEU  68   1.305   3.851  -3.916
  499   3HD2  LEU  68          23HD      LEU  68   1.736   2.140  -3.759
  500    H    VAL  69           H        VAL  69   6.110   2.755  -6.905
  501    HA   VAL  69           HA       VAL  69   7.835   2.028  -4.930
  502    HB   VAL  69           HB       VAL  69   8.488   2.083  -7.884
  503   1HG1  VAL  69          11HG      VAL  69   9.753   0.490  -5.655
  504   2HG1  VAL  69          12HG      VAL  69  10.510   1.810  -6.543
  505   3HG1  VAL  69          13HG      VAL  69  10.103   0.308  -7.375
  506   1HG2  VAL  69          21HG      VAL  69   7.289  -0.070  -6.141
  507   2HG2  VAL  69          22HG      VAL  69   7.767  -0.269  -7.829
  508   3HG2  VAL  69          23HG      VAL  69   6.461   0.837  -7.407
  509    H    GLY  70           H        GLY  70   8.741   3.575  -3.714
  510   1HA   GLY  70          1HA       GLY  70  10.798   4.610  -3.190
  511   2HA   GLY  70          2HA       GLY  70  11.030   4.959  -4.893
  512    H    VAL  71           H        VAL  71   7.933   5.716  -3.490
  513    HA   VAL  71           HA       VAL  71   8.534   8.549  -3.841
  514    HB   VAL  71           HB       VAL  71   6.141   8.949  -3.699
  515   1HG1  VAL  71          11HG      VAL  71   7.005   8.250  -5.849
  516   2HG1  VAL  71          12HG      VAL  71   5.356   7.681  -5.599
  517   3HG1  VAL  71          13HG      VAL  71   6.707   6.563  -5.426
  518   1HG2  VAL  71          21HG      VAL  71   5.622   7.342  -1.923
  519   2HG2  VAL  71          22HG      VAL  71   5.859   6.009  -3.052
  520   3HG2  VAL  71          23HG      VAL  71   4.537   7.158  -3.296
  521    H    THR  72           H        THR  72   7.089   9.935  -2.158
  522    HA   THR  72           HA       THR  72   8.070   9.219   0.517
  523    HB   THR  72           HB       THR  72   7.387  11.566   1.055
  524    HG1  THR  72           HG1      THR  72   7.326  12.209  -1.661
  525   1HG2  THR  72          21HG      THR  72   9.298  12.640  -0.081
  526   2HG2  THR  72          22HG      THR  72   9.425  11.232  -1.152
  527   3HG2  THR  72          23HG      THR  72   9.691  11.058   0.588
  528    H    GLN  73           H        GLN  73   6.590  10.194   2.216
  529    HA   GLN  73           HA       GLN  73   4.251   8.638   2.125
  530   1HB   GLN  73          1HB       GLN  73   4.135   8.950   4.382
  531   2HB   GLN  73          2HB       GLN  73   5.700   9.698   4.167
  532   1HG   GLN  73          1HG       GLN  73   3.116  11.229   4.208
  533   2HG   GLN  73          2HG       GLN  73   4.100  10.939   5.632
  534   1HE2  GLN  73          21HE      GLN  73   6.629  11.269   4.213
  535   2HE2  GLN  73          22HE      GLN  73   6.739  12.949   3.882
  536    H    ASN  74           H        ASN  74   4.914  11.865   1.195
  537    HA   ASN  74           HA       ASN  74   2.313  12.982   1.268
  538   1HB   ASN  74          1HB       ASN  74   4.392  13.546  -0.861
  539   2HB   ASN  74          2HB       ASN  74   3.046  14.576  -0.420
  540   1HD2  ASN  74          21HD      ASN  74   6.186  13.555   0.229
  541   2HD2  ASN  74          22HD      ASN  74   6.547  14.659   1.521
  542    H    PHE  75           H        PHE  75   4.127  11.269  -1.184
  543    HA   PHE  75           HA       PHE  75   2.133  11.499  -3.107
  544   1HB   PHE  75          1HB       PHE  75   4.527  11.100  -3.640
  545   2HB   PHE  75          2HB       PHE  75   4.347   9.468  -3.001
  546    HD1  PHE  75           HD1      PHE  75   3.909  11.615  -5.855
  547    HD2  PHE  75           HD2      PHE  75   2.814   7.856  -4.191
  548    HE1  PHE  75           HE1      PHE  75   3.217  10.827  -8.078
  549    HE2  PHE  75           HE2      PHE  75   2.129   7.063  -6.381
  550    HZ   PHE  75           HZ       PHE  75   2.324   8.547  -8.351
  551    H    ALA  76           H        ALA  76   3.183   8.872  -0.963
  552    HA   ALA  76           HA       ALA  76   1.337   6.962  -1.830
  553   1HB   ALA  76          1HB       ALA  76   2.639   7.173   0.875
  554   2HB   ALA  76          2HB       ALA  76   3.330   6.415  -0.565
  555   3HB   ALA  76          3HB       ALA  76   1.877   5.743   0.175
  556    H    ALA  77           H        ALA  77   1.072   9.385   0.778
  557    HA   ALA  77           HA       ALA  77  -1.438   8.471   1.726
  558   1HB   ALA  77          1HB       ALA  77  -0.234  11.231   1.926
  559   2HB   ALA  77          2HB       ALA  77   0.061   9.908   3.056
  560   3HB   ALA  77          3HB       ALA  77  -1.554  10.603   2.914
  561    H    THR  78           H        THR  78  -0.490  10.222  -1.001
  562    HA   THR  78           HA       THR  78  -3.069  11.384  -1.451
  563    HB   THR  78           HB       THR  78  -0.564  11.276  -3.143
  564    HG1  THR  78           HG1      THR  78  -0.275  12.621  -1.454
  565   1HG2  THR  78          21HG      THR  78  -3.133  12.801  -3.635
  566   2HG2  THR  78          22HG      THR  78  -2.556  11.417  -4.565
  567   3HG2  THR  78          23HG      THR  78  -1.649  12.932  -4.587
  568    H    VAL  79           H        VAL  79  -1.114   8.744  -2.948
  569    HA   VAL  79           HA       VAL  79  -3.161   8.001  -4.639
  570    HB   VAL  79           HB       VAL  79  -0.983   7.198  -5.250
  571   1HG1  VAL  79          11HG      VAL  79  -1.068   5.730  -2.756
  572   2HG1  VAL  79          12HG      VAL  79  -0.177   7.205  -3.163
  573   3HG1  VAL  79          13HG      VAL  79   0.233   5.657  -3.993
  574   1HG2  VAL  79          21HG      VAL  79  -1.372   4.836  -5.588
  575   2HG2  VAL  79          22HG      VAL  79  -2.828   5.790  -5.925
  576   3HG2  VAL  79          23HG      VAL  79  -2.683   4.892  -4.409
  577    H    LEU  80           H        LEU  80  -2.407   6.663  -1.429
  578    HA   LEU  80           HA       LEU  80  -4.535   4.764  -1.476
  579   1HB   LEU  80          1HB       LEU  80  -2.933   5.917   0.797
  580   2HB   LEU  80          2HB       LEU  80  -4.282   4.849   1.099
  581    HG   LEU  80           HG       LEU  80  -2.267   3.579   1.259
  582   1HD1  LEU  80          11HD      LEU  80  -4.183   2.514   0.185
  583   2HD1  LEU  80          12HD      LEU  80  -2.633   1.846  -0.318
  584   3HD1  LEU  80          13HD      LEU  80  -3.511   2.933  -1.392
  585   1HD2  LEU  80          21HD      LEU  80  -0.834   5.072  -0.112
  586   2HD2  LEU  80          22HD      LEU  80  -1.605   4.371  -1.551
  587   3HD2  LEU  80          23HD      LEU  80  -0.649   3.355  -0.472
  588    H    ARG  81           H        ARG  81  -4.587   8.040  -1.151
  589    HA   ARG  81           HA       ARG  81  -7.058   8.302   0.339
  590   1HB   ARG  81          1HB       ARG  81  -5.336  10.031   0.358
  591   2HB   ARG  81          2HB       ARG  81  -5.480  10.200  -1.380
  592   1HG   ARG  81          1HG       ARG  81  -7.882  10.857  -0.971
  593   2HG   ARG  81          2HG       ARG  81  -7.437  10.994   0.736
  594   1HD   ARG  81          1HD       ARG  81  -5.572  12.517   0.037
  595   2HD   ARG  81          2HD       ARG  81  -6.248  12.427  -1.598
  596    HE   ARG  81           HE       ARG  81  -8.353  13.162  -0.106
  597   1HH1  ARG  81          11HH      ARG  81  -5.141  14.594  -0.547
  598   2HH1  ARG  81          12HH      ARG  81  -5.685  16.167  -0.172
  599   1HH2  ARG  81          21HH      ARG  81  -9.032  15.267   0.400
  600   2HH2  ARG  81          22HH      ARG  81  -7.926  16.567   0.380
  601    H    ASN  82           H        ASN  82  -5.891   8.469  -2.955
  602    HA   ASN  82           HA       ASN  82  -8.381   9.376  -4.014
  603   1HB   ASN  82          1HB       ASN  82  -5.662   9.011  -5.078
  604   2HB   ASN  82          2HB       ASN  82  -6.980   9.002  -6.236
  605   1HD2  ASN  82          21HD      ASN  82  -5.288  10.855  -3.864
  606   2HD2  ASN  82          22HD      ASN  82  -5.968  12.377  -4.321
  607    H    THR  83           H        THR  83  -7.155   6.324  -3.386
  608    HA   THR  83           HA       THR  83  -8.073   4.923  -5.616
  609    HB   THR  83           HB       THR  83  -7.979   3.010  -3.998
  610    HG1  THR  83           HG1      THR  83  -8.189   4.522  -2.150
  611   1HG2  THR  83          21HG      THR  83  -5.531   3.054  -4.003
  612   2HG2  THR  83          22HG      THR  83  -5.571   4.769  -4.399
  613   3HG2  THR  83          23HG      THR  83  -6.193   3.579  -5.549
  614    H    LYS  84           H        LYS  84  -9.880   3.790  -5.979
  615    HA   LYS  84           HA       LYS  84 -12.101   4.052  -4.099
  616   1HB   LYS  84          1HB       LYS  84 -12.172   4.939  -6.969
  617   2HB   LYS  84          2HB       LYS  84 -13.617   4.535  -6.051
  618   1HG   LYS  84          1HG       LYS  84 -11.639   6.686  -5.363
  619   2HG   LYS  84          2HG       LYS  84 -13.236   6.928  -6.090
  620   1HD   LYS  84          1HD       LYS  84 -14.237   5.812  -4.154
  621   2HD   LYS  84          2HD       LYS  84 -12.659   5.682  -3.421
  622   1HE   LYS  84          1HE       LYS  84 -12.376   8.115  -3.479
  623   2HE   LYS  84          2HE       LYS  84 -13.987   8.295  -4.169
  624   1HZ   LYS  84          1HZ       LYS  84 -13.296   7.294  -1.452
  625   2HZ   LYS  84          2HZ       LYS  84 -14.860   7.255  -2.110
  626   3HZ   LYS  84          3HZ       LYS  84 -14.100   8.720  -1.843
  627    H    GLY  85           H        GLY  85 -13.526   2.531  -4.055
  628   1HA   GLY  85          1HA       GLY  85 -14.313   0.489  -4.063
  629   2HA   GLY  85          2HA       GLY  85 -14.369   0.716  -5.799
  630    H    ASN  86           H        ASN  86 -12.661   0.203  -6.822
  631    HA   ASN  86           HA       ASN  86 -11.534  -2.372  -5.825
  632   1HB   ASN  86          1HB       ASN  86 -12.108  -1.622  -8.666
  633   2HB   ASN  86          2HB       ASN  86 -11.144  -3.045  -8.252
  634   1HD2  ASN  86          21HD      ASN  86 -12.554  -4.663  -8.923
  635   2HD2  ASN  86          22HD      ASN  86 -14.124  -4.869  -8.245
  636    H    VAL  87           H        VAL  87  -9.704  -2.092  -5.046
  637    HA   VAL  87           HA       VAL  87  -7.834  -0.310  -6.424
  638    HB   VAL  87           HB       VAL  87  -7.854  -1.121  -3.548
  639   1HG1  VAL  87          11HG      VAL  87  -6.284   0.738  -3.299
  640   2HG1  VAL  87          12HG      VAL  87  -6.304   0.933  -5.069
  641   3HG1  VAL  87          13HG      VAL  87  -5.732  -0.585  -4.337
  642   1HG2  VAL  87          21HG      VAL  87  -8.895   1.366  -4.876
  643   2HG2  VAL  87          22HG      VAL  87  -8.666   1.171  -3.129
  644   3HG2  VAL  87          23HG      VAL  87  -9.810   0.136  -3.997
  645    H    ARG  88           H        ARG  88  -6.089  -1.289  -7.302
  646    HA   ARG  88           HA       ARG  88  -5.420  -3.983  -6.421
  647   1HB   ARG  88          1HB       ARG  88  -4.252  -2.313  -8.627
  648   2HB   ARG  88          2HB       ARG  88  -3.621  -3.877  -8.148
  649   1HG   ARG  88          1HG       ARG  88  -4.921  -4.524  -9.829
  650   2HG   ARG  88          2HG       ARG  88  -6.086  -4.617  -8.538
  651   1HD   ARG  88          1HD       ARG  88  -7.062  -3.498 -10.492
  652   2HD   ARG  88          2HD       ARG  88  -7.001  -2.439  -9.087
  653    HE   ARG  88           HE       ARG  88  -4.969  -1.461 -10.132
  654   1HH1  ARG  88          11HH      ARG  88  -7.370  -3.036 -12.196
  655   2HH1  ARG  88          12HH      ARG  88  -6.983  -2.127 -13.577
  656   1HH2  ARG  88          21HH      ARG  88  -4.454  -0.175 -12.053
  657   2HH2  ARG  88          22HH      ARG  88  -5.286  -0.476 -13.490
  658    H    PHE  89           H        PHE  89  -4.445  -3.979  -4.571
  659    HA   PHE  89           HA       PHE  89  -2.287  -2.082  -4.081
  660   1HB   PHE  89          1HB       PHE  89  -3.364  -4.307  -2.332
  661   2HB   PHE  89          2HB       PHE  89  -2.134  -3.131  -1.901
  662    HD1  PHE  89           HD1      PHE  89  -2.724  -0.947  -1.228
  663    HD2  PHE  89           HD2      PHE  89  -5.689  -3.667  -2.527
  664    HE1  PHE  89           HE1      PHE  89  -4.465   0.508  -0.278
  665    HE2  PHE  89           HE2      PHE  89  -7.443  -2.189  -1.588
  666    HZ   PHE  89           HZ       PHE  89  -6.841  -0.139  -0.476
  667    H    VAL  90           H        VAL  90  -0.596  -2.755  -5.318
  668    HA   VAL  90           HA       VAL  90  -0.002  -5.573  -5.303
  669    HB   VAL  90           HB       VAL  90   1.439  -3.289  -6.650
  670   1HG1  VAL  90          11HG      VAL  90   1.782  -6.277  -7.005
  671   2HG1  VAL  90          12HG      VAL  90   2.938  -5.178  -6.253
  672   3HG1  VAL  90          13HG      VAL  90   2.590  -5.047  -7.976
  673   1HG2  VAL  90          21HG      VAL  90  -0.783  -3.605  -7.576
  674   2HG2  VAL  90          22HG      VAL  90  -0.447  -5.320  -7.833
  675   3HG2  VAL  90          23HG      VAL  90   0.446  -4.103  -8.738
  676    H    ILE  91           H        ILE  91   0.550  -5.875  -3.285
  677    HA   ILE  91           HA       ILE  91   2.781  -4.453  -2.061
  678    HB   ILE  91           HB       ILE  91   0.443  -6.079  -1.016
  679   1HG1  ILE  91          11HG      ILE  91   1.230  -3.232  -0.488
  680   2HG1  ILE  91          12HG      ILE  91   0.073  -3.697  -1.721
  681   1HG2  ILE  91          21HG      ILE  91   2.677  -4.940   0.681
  682   2HG2  ILE  91          22HG      ILE  91   2.378  -6.650   0.395
  683   3HG2  ILE  91          23HG      ILE  91   1.207  -5.696   1.297
  684   1HD1  ILE  91          11HD      ILE  91  -0.986  -2.919   0.189
  685   2HD1  ILE  91          12HD      ILE  91  -0.153  -4.133   1.191
  686   3HD1  ILE  91          13HD      ILE  91  -1.312  -4.643  -0.073
  687    H    GLY  92           H        GLY  92   4.220  -6.037  -0.768
  688   1HA   GLY  92          1HA       GLY  92   4.303  -8.558  -2.230
  689   2HA   GLY  92          2HA       GLY  92   5.739  -7.558  -2.120
  690    H    ARG  93           H        ARG  93   5.576 -10.175  -1.255
  691    HA   ARG  93           HA       ARG  93   5.926  -9.893   1.655
  692   1HB   ARG  93          1HB       ARG  93   4.211 -11.495   1.199
  693   2HB   ARG  93          2HB       ARG  93   5.208 -12.279  -0.019
  694   1HG   ARG  93          1HG       ARG  93   6.709 -13.104   1.639
  695   2HG   ARG  93          2HG       ARG  93   5.890 -12.175   2.899
  696   1HD   ARG  93          1HD       ARG  93   3.984 -13.430   2.744
  697   2HD   ARG  93          2HD       ARG  93   4.498 -14.128   1.192
  698    HE   ARG  93           HE       ARG  93   6.374 -15.087   2.702
  699   1HH1  ARG  93          11HH      ARG  93   2.953 -14.824   3.688
  700   2HH1  ARG  93          12HH      ARG  93   2.995 -16.229   4.631
  701   1HH2  ARG  93          21HH      ARG  93   6.381 -17.030   4.032
  702   2HH2  ARG  93          22HH      ARG  93   4.967 -17.476   4.863
  703    H    GLU  94           H        GLU  94   7.843 -10.465   2.502
  704    HA   GLU  94           HA       GLU  94   9.902 -11.041   0.564
  705   1HB   GLU  94          1HB       GLU  94  11.513 -10.029   2.190
  706   2HB   GLU  94          2HB       GLU  94  10.257  -8.960   1.588
  707   1HG   GLU  94          1HG       GLU  94  10.521  -8.373   3.834
  708   2HG   GLU  94          2HG       GLU  94   9.052  -9.331   3.772
  Start of MODEL   12
    1   1H    GLY   1          1H        GLY   1  16.037  -8.465   1.758
    2   2H    GLY   1          2H        GLY   1  14.460  -8.643   1.129
    3   3H    GLY   1          3H        GLY   1  15.470  -7.412   0.564
    4   1HA   GLY   1          1HA       GLY   1  16.902  -8.979  -0.479
    5   2HA   GLY   1          2HA       GLY   1  15.956 -10.290   0.234
    6    H    HIS   2           H        HIS   2  14.853 -11.223  -1.371
    7    HA   HIS   2           HA       HIS   2  13.778  -9.601  -3.497
    8   1HB   HIS   2          1HB       HIS   2  13.756 -12.568  -2.992
    9   2HB   HIS   2          2HB       HIS   2  12.744 -11.841  -4.223
   10    HD1  HIS   2           HD1      HIS   2  13.779 -11.536  -6.453
   11    HD2  HIS   2           HD2      HIS   2  16.614 -12.089  -3.472
   12    HE1  HIS   2           HE1      HIS   2  15.998 -11.756  -7.633
   13    H    MET   3           H        MET   3  12.180  -8.412  -2.921
   14    HA   MET   3           HA       MET   3  10.134  -9.113  -1.068
   15   1HB   MET   3          1HB       MET   3  10.777  -6.770  -1.636
   16   2HB   MET   3          2HB       MET   3  10.125  -7.009  -3.246
   17   1HG   MET   3          1HG       MET   3   8.500  -5.822  -2.029
   18   2HG   MET   3          2HG       MET   3   7.925  -7.481  -2.160
   19   1HE   MET   3          1HE       MET   3  10.622  -5.882   0.282
   20   2HE   MET   3          2HE       MET   3   9.592  -5.559   1.673
   21   3HE   MET   3          3HE       MET   3   9.321  -4.699   0.159
   22    H    GLU   4           H        GLU   4   8.396 -10.347  -1.466
   23    HA   GLU   4           HA       GLU   4   7.890 -11.295  -4.159
   24   1HB   GLU   4          1HB       GLU   4   7.785 -12.834  -2.227
   25   2HB   GLU   4          2HB       GLU   4   6.513 -11.852  -1.529
   26   1HG   GLU   4          1HG       GLU   4   5.074 -12.391  -3.438
   27   2HG   GLU   4          2HG       GLU   4   6.347 -13.425  -4.083
   28    H    LEU   5           H        LEU   5   6.908  -9.718  -5.389
   29    HA   LEU   5           HA       LEU   5   4.926  -8.003  -4.175
   30   1HB   LEU   5          1HB       LEU   5   5.652  -8.125  -7.116
   31   2HB   LEU   5          2HB       LEU   5   4.747  -6.882  -6.291
   32    HG   LEU   5           HG       LEU   5   6.757  -5.930  -6.684
   33   1HD1  LEU   5          11HD      LEU   5   6.044  -5.538  -4.458
   34   2HD1  LEU   5          12HD      LEU   5   7.814  -5.571  -4.527
   35   3HD1  LEU   5          13HD      LEU   5   6.922  -6.964  -3.904
   36   1HD2  LEU   5          21HD      LEU   5   8.964  -6.925  -6.218
   37   2HD2  LEU   5          22HD      LEU   5   8.040  -7.864  -7.387
   38   3HD2  LEU   5          23HD      LEU   5   8.165  -8.410  -5.715
   39    H    PHE   6           H        PHE   6   2.801  -8.254  -4.285
   40    HA   PHE   6           HA       PHE   6   1.744 -10.040  -6.252
   41   1HB   PHE   6          1HB       PHE   6   0.217 -10.928  -4.448
   42   2HB   PHE   6          2HB       PHE   6   1.822 -11.637  -4.532
   43    HD1  PHE   6           HD1      PHE   6  -0.602  -9.641  -2.763
   44    HD2  PHE   6           HD2      PHE   6   3.342 -11.158  -2.622
   45    HE1  PHE   6           HE1      PHE   6  -0.512  -9.130  -0.340
   46    HE2  PHE   6           HE2      PHE   6   3.472 -10.656  -0.218
   47    HZ   PHE   6           HZ       PHE   6   1.540  -9.640   0.932
   48    HA   PRO   7           HA       PRO   7  -1.324  -6.866  -6.418
   49   1HB   PRO   7          1HB       PRO   7  -2.991  -8.024  -8.071
   50   2HB   PRO   7          2HB       PRO   7  -1.419  -7.437  -8.608
   51   1HG   PRO   7          1HG       PRO   7  -2.238 -10.265  -7.940
   52   2HG   PRO   7          2HG       PRO   7  -1.220  -9.696  -9.296
   53   1HD   PRO   7          1HD       PRO   7  -0.339 -10.773  -6.914
   54   2HD   PRO   7          2HD       PRO   7   0.627  -9.688  -7.946
   55    H    VAL   8           H        VAL   8  -2.722  -6.493  -4.885
   56    HA   VAL   8           HA       VAL   8  -4.621  -8.586  -4.181
   57    HB   VAL   8           HB       VAL   8  -3.986  -6.118  -2.568
   58   1HG1  VAL   8          11HG      VAL   8  -5.465  -8.620  -1.819
   59   2HG1  VAL   8          12HG      VAL   8  -6.142  -7.012  -2.086
   60   3HG1  VAL   8          13HG      VAL   8  -5.066  -7.298  -0.717
   61   1HG2  VAL   8          21HG      VAL   8  -2.005  -7.426  -2.715
   62   2HG2  VAL   8          22HG      VAL   8  -2.876  -8.886  -2.222
   63   3HG2  VAL   8          23HG      VAL   8  -2.659  -7.548  -1.074
   64    H    GLU   9           H        GLU   9  -6.383  -8.219  -5.400
   65    HA   GLU   9           HA       GLU   9  -7.128  -5.480  -5.921
   66   1HB   GLU   9          1HB       GLU   9  -7.206  -7.304  -7.688
   67   2HB   GLU   9          2HB       GLU   9  -8.560  -7.980  -6.792
   68   1HG   GLU   9          1HG       GLU   9  -9.819  -5.934  -7.118
   69   2HG   GLU   9          2HG       GLU   9  -8.460  -5.228  -7.990
   70    H    LEU  10           H        LEU  10  -8.191  -4.514  -4.402
   71    HA   LEU  10           HA       LEU  10  -9.790  -6.093  -2.516
   72   1HB   LEU  10          1HB       LEU  10  -7.877  -4.170  -2.181
   73   2HB   LEU  10          2HB       LEU  10  -9.336  -3.210  -2.147
   74    HG   LEU  10           HG       LEU  10  -8.684  -3.675   0.092
   75   1HD1  LEU  10          11HD      LEU  10 -11.067  -3.739  -0.251
   76   2HD1  LEU  10          12HD      LEU  10 -10.585  -4.872   1.014
   77   3HD1  LEU  10          13HD      LEU  10 -10.981  -5.463  -0.595
   78   1HD2  LEU  10          21HD      LEU  10  -8.400  -5.937   0.964
   79   2HD2  LEU  10          22HD      LEU  10  -7.235  -5.564  -0.307
   80   3HD2  LEU  10          23HD      LEU  10  -8.627  -6.585  -0.657
   81    H    GLU  11           H        GLU  11 -11.990  -5.492  -2.276
   82    HA   GLU  11           HA       GLU  11 -12.853  -3.327  -4.018
   83   1HB   GLU  11          1HB       GLU  11 -13.746  -5.532  -4.777
   84   2HB   GLU  11          2HB       GLU  11 -14.507  -5.729  -3.204
   85   1HG   GLU  11          1HG       GLU  11 -15.790  -3.652  -3.606
   86   2HG   GLU  11          2HG       GLU  11 -15.098  -3.580  -5.224
   87    H    LYS  12           H        LYS  12 -12.691  -1.790  -2.572
   88    HA   LYS  12           HA       LYS  12 -13.737  -2.160   0.042
   89   1HB   LYS  12          1HB       LYS  12 -12.184  -0.032  -1.265
   90   2HB   LYS  12          2HB       LYS  12 -13.101   0.433   0.144
   91   1HG   LYS  12          1HG       LYS  12 -10.943  -1.680  -0.067
   92   2HG   LYS  12          2HG       LYS  12 -10.813  -0.136   0.756
   93   1HD   LYS  12          1HD       LYS  12 -13.049  -1.766   1.708
   94   2HD   LYS  12          2HD       LYS  12 -11.485  -2.552   1.966
   95   1HE   LYS  12          1HE       LYS  12 -12.132  -1.444   3.929
   96   2HE   LYS  12          2HE       LYS  12 -10.865  -0.455   3.266
   97   1HZ   LYS  12          1HZ       LYS  12 -13.803   0.068   3.133
   98   2HZ   LYS  12          2HZ       LYS  12 -12.667   1.052   2.357
   99   3HZ   LYS  12          3HZ       LYS  12 -12.684   0.954   4.021
  100    H    ASP  13           H        ASP  13 -14.808  -0.322   0.989
  101    HA   ASP  13           HA       ASP  13 -17.482  -0.155   0.128
  102   1HB   ASP  13          1HB       ASP  13 -16.073   1.505   2.223
  103   2HB   ASP  13          2HB       ASP  13 -17.757   0.998   2.184
  104    H    GLU  14           H        GLU  14 -18.516   2.116   0.069
  105    HA   GLU  14           HA       GLU  14 -17.250   3.705  -1.921
  106   1HB   GLU  14          1HB       GLU  14 -19.159   5.247  -1.662
  107   2HB   GLU  14          2HB       GLU  14 -19.683   3.582  -1.827
  108   1HG   GLU  14          1HG       GLU  14 -20.062   3.450   0.570
  109   2HG   GLU  14          2HG       GLU  14 -19.492   5.105   0.761
  110    H    ASP  15           H        ASP  15 -17.098   3.649   1.452
  111    HA   ASP  15           HA       ASP  15 -16.280   6.238   2.089
  112   1HB   ASP  15          1HB       ASP  15 -16.717   4.546   3.785
  113   2HB   ASP  15          2HB       ASP  15 -15.329   3.620   3.244
  114    H    GLY  16           H        GLY  16 -14.639   3.568   0.652
  115   1HA   GLY  16          1HA       GLY  16 -12.844   4.012  -0.890
  116   2HA   GLY  16          2HA       GLY  16 -12.268   5.243   0.243
  117    H    LEU  17           H        LEU  17 -10.372   4.420   0.877
  118    HA   LEU  17           HA       LEU  17 -10.258   1.590   1.581
  119   1HB   LEU  17          1HB       LEU  17  -8.056   3.567   1.977
  120   2HB   LEU  17          2HB       LEU  17  -7.944   1.830   1.830
  121    HG   LEU  17           HG       LEU  17  -8.517   3.826  -0.252
  122   1HD1  LEU  17          11HD      LEU  17  -6.264   1.882   0.158
  123   2HD1  LEU  17          12HD      LEU  17  -6.205   3.638   0.290
  124   3HD1  LEU  17          13HD      LEU  17  -6.460   2.878  -1.283
  125   1HD2  LEU  17          21HD      LEU  17  -8.605   0.821  -0.521
  126   2HD2  LEU  17          22HD      LEU  17  -8.588   1.961  -1.874
  127   3HD2  LEU  17          23HD      LEU  17  -9.938   1.957  -0.743
  128    H    GLY  18           H        GLY  18 -10.003   4.757   3.014
  129   1HA   GLY  18          1HA       GLY  18 -10.030   5.470   5.151
  130   2HA   GLY  18          2HA       GLY  18 -10.791   3.933   5.570
  131    H    ILE  19           H        ILE  19  -7.670   4.095   3.996
  132    HA   ILE  19           HA       ILE  19  -6.542   3.061   6.500
  133    HB   ILE  19           HB       ILE  19  -4.908   1.776   5.301
  134   1HG1  ILE  19          11HG      ILE  19  -5.989   2.961   2.737
  135   2HG1  ILE  19          12HG      ILE  19  -4.477   3.429   3.515
  136   1HG2  ILE  19          21HG      ILE  19  -7.572   1.462   3.925
  137   2HG2  ILE  19          22HG      ILE  19  -7.142   0.774   5.479
  138   3HG2  ILE  19          23HG      ILE  19  -6.307   0.234   4.012
  139   1HD1  ILE  19          11HD      ILE  19  -3.616   1.155   3.215
  140   2HD1  ILE  19          12HD      ILE  19  -4.042   1.900   1.678
  141   3HD1  ILE  19          13HD      ILE  19  -5.115   0.699   2.402
  142    H    SER  20           H        SER  20  -3.974   3.336   6.389
  143    HA   SER  20           HA       SER  20  -3.330   6.108   5.670
  144   1HB   SER  20          1HB       SER  20  -2.899   4.835   8.385
  145   2HB   SER  20          2HB       SER  20  -2.483   6.486   7.946
  146    HG   SER  20           HG       SER  20  -4.718   6.787   7.508
  147    H    ILE  21           H        ILE  21  -1.071   6.457   5.569
  148    HA   ILE  21           HA       ILE  21   0.530   4.001   5.275
  149    HB   ILE  21           HB       ILE  21   1.729   5.140   3.428
  150   1HG1  ILE  21          11HG      ILE  21   0.146   7.014   2.320
  151   2HG1  ILE  21          12HG      ILE  21  -0.283   7.265   3.984
  152   1HG2  ILE  21          21HG      ILE  21   0.065   3.494   2.909
  153   2HG2  ILE  21          22HG      ILE  21   0.022   4.789   1.709
  154   3HG2  ILE  21          23HG      ILE  21  -1.207   4.714   2.970
  155   1HD1  ILE  21          11HD      ILE  21   1.512   8.818   3.294
  156   2HD1  ILE  21          12HD      ILE  21   2.547   7.461   2.924
  157   3HD1  ILE  21          13HD      ILE  21   2.037   7.742   4.575
  158    H    ILE  22           H        ILE  22   2.897   4.485   5.394
  159    HA   ILE  22           HA       ILE  22   3.344   6.902   6.871
  160    HB   ILE  22           HB       ILE  22   3.132   5.243   8.569
  161   1HG1  ILE  22          11HG      ILE  22   6.039   6.039   8.236
  162   2HG1  ILE  22          12HG      ILE  22   4.775   7.028   8.946
  163   1HG2  ILE  22          21HG      ILE  22   4.692   3.331   8.771
  164   2HG2  ILE  22          22HG      ILE  22   5.319   3.735   7.170
  165   3HG2  ILE  22          23HG      ILE  22   3.634   3.244   7.360
  166   1HD1  ILE  22          11HD      ILE  22   5.854   4.448  10.056
  167   2HD1  ILE  22          12HD      ILE  22   4.568   5.415  10.784
  168   3HD1  ILE  22          13HD      ILE  22   6.196   6.070  10.652
  169    H    GLY  23           H        GLY  23   5.126   7.970   6.422
  170   1HA   GLY  23          1HA       GLY  23   6.799   6.896   4.325
  171   2HA   GLY  23          2HA       GLY  23   6.721   8.585   4.822
  172    H    MET  24           H        MET  24   8.271   5.659   5.075
  173    HA   MET  24           HA       MET  24  10.204   6.820   6.866
  174   1HB   MET  24          1HB       MET  24  10.372   4.627   8.144
  175   2HB   MET  24          2HB       MET  24   8.978   5.632   8.514
  176   1HG   MET  24          1HG       MET  24   7.598   4.220   7.087
  177   2HG   MET  24          2HG       MET  24   9.014   3.232   6.722
  178   1HE   MET  24          1HE       MET  24  10.193   1.619   8.421
  179   2HE   MET  24          2HE       MET  24   9.780   1.515  10.130
  180   3HE   MET  24          3HE       MET  24  10.506   2.986   9.492
  181    H    GLY  25           H        GLY  25  11.487   7.112   5.266
  182   1HA   GLY  25          1HA       GLY  25  12.017   5.389   3.151
  183   2HA   GLY  25          2HA       GLY  25  13.053   6.701   3.690
  184    H    VAL  26           H        VAL  26  12.739   3.443   3.338
  185    HA   VAL  26           HA       VAL  26  14.783   2.814   5.304
  186    HB   VAL  26           HB       VAL  26  12.761   1.375   5.210
  187   1HG1  VAL  26          11HG      VAL  26  13.648   0.654   2.429
  188   2HG1  VAL  26          12HG      VAL  26  12.202   1.553   2.878
  189   3HG1  VAL  26          13HG      VAL  26  12.362  -0.141   3.338
  190   1HG2  VAL  26          21HG      VAL  26  13.880  -0.815   5.121
  191   2HG2  VAL  26          22HG      VAL  26  14.824   0.378   6.014
  192   3HG2  VAL  26          23HG      VAL  26  15.280  -0.055   4.367
  193    H    GLY  27           H        GLY  27  16.768   1.895   4.630
  194   1HA   GLY  27          1HA       GLY  27  17.452   2.691   1.916
  195   2HA   GLY  27          2HA       GLY  27  18.570   2.475   3.240
  196    H    ALA  28           H        ALA  28  19.866   1.250   2.025
  197    HA   ALA  28           HA       ALA  28  18.951  -1.244   0.874
  198   1HB   ALA  28          1HB       ALA  28  21.233  -1.381   0.018
  199   2HB   ALA  28          2HB       ALA  28  21.660   0.049   0.959
  200   3HB   ALA  28          3HB       ALA  28  20.494   0.178  -0.352
  201    H    ASP  29           H        ASP  29  20.254  -0.131   3.798
  202    HA   ASP  29           HA       ASP  29  22.028  -2.249   4.488
  203   1HB   ASP  29          1HB       ASP  29  20.518  -0.660   6.554
  204   2HB   ASP  29          2HB       ASP  29  22.147  -1.304   6.633
  205    H    ALA  30           H        ALA  30  18.649  -1.702   4.873
  206    HA   ALA  30           HA       ALA  30  18.259  -3.997   6.565
  207   1HB   ALA  30          1HB       ALA  30  15.898  -3.383   6.462
  208   2HB   ALA  30          2HB       ALA  30  16.278  -2.178   5.223
  209   3HB   ALA  30          3HB       ALA  30  16.918  -1.995   6.850
  210    H    GLY  31           H        GLY  31  18.798  -3.661   3.303
  211   1HA   GLY  31          1HA       GLY  31  18.764  -5.397   1.732
  212   2HA   GLY  31          2HA       GLY  31  17.693  -6.277   2.820
  213    H    LEU  32           H        LEU  32  16.621  -3.166   2.369
  214    HA   LEU  32           HA       LEU  32  14.489  -4.195   0.708
  215   1HB   LEU  32          1HB       LEU  32  14.748  -1.687   2.318
  216   2HB   LEU  32          2HB       LEU  32  13.489  -1.846   1.117
  217    HG   LEU  32           HG       LEU  32  12.568  -2.338   3.261
  218   1HD1  LEU  32          11HD      LEU  32  11.659  -4.538   2.931
  219   2HD1  LEU  32          12HD      LEU  32  12.909  -4.898   1.752
  220   3HD1  LEU  32          13HD      LEU  32  11.718  -3.637   1.418
  221   1HD2  LEU  32          21HD      LEU  32  14.716  -4.441   3.565
  222   2HD2  LEU  32          22HD      LEU  32  13.325  -4.251   4.629
  223   3HD2  LEU  32          23HD      LEU  32  14.528  -2.968   4.518
  224    H    GLU  33           H        GLU  33  16.488  -1.238   0.641
  225    HA   GLU  33           HA       GLU  33  17.377  -0.045  -1.059
  226   1HB   GLU  33          1HB       GLU  33  17.000  -2.581  -2.648
  227   2HB   GLU  33          2HB       GLU  33  18.019  -1.229  -3.125
  228   1HG   GLU  33          1HG       GLU  33  19.411  -1.643  -1.144
  229   2HG   GLU  33          2HG       GLU  33  18.406  -3.037  -0.748
  230    H    LYS  34           H        LYS  34  14.644   0.153  -0.646
  231    HA   LYS  34           HA       LYS  34  13.754   1.210  -3.172
  232   1HB   LYS  34          1HB       LYS  34  11.781  -0.161  -3.427
  233   2HB   LYS  34          2HB       LYS  34  13.224  -1.161  -3.336
  234   1HG   LYS  34          1HG       LYS  34  12.646  -1.582  -0.887
  235   2HG   LYS  34          2HG       LYS  34  11.135  -0.770  -1.213
  236   1HD   LYS  34          1HD       LYS  34  10.942  -3.244  -1.371
  237   2HD   LYS  34          2HD       LYS  34  10.501  -2.406  -2.864
  238   1HE   LYS  34          1HE       LYS  34  12.623  -2.912  -3.852
  239   2HE   LYS  34          2HE       LYS  34  13.229  -3.566  -2.330
  240   1HZ   LYS  34          1HZ       LYS  34  12.611  -5.193  -4.001
  241   2HZ   LYS  34          2HZ       LYS  34  11.008  -4.719  -3.916
  242   3HZ   LYS  34          3HZ       LYS  34  11.803  -5.392  -2.554
  243    H    LEU  35           H        LEU  35  11.107   1.438  -2.649
  244    HA   LEU  35           HA       LEU  35  10.752   3.737  -1.249
  245   1HB   LEU  35          1HB       LEU  35   8.407   3.267  -1.244
  246   2HB   LEU  35          2HB       LEU  35   9.118   2.722  -2.753
  247    HG   LEU  35           HG       LEU  35   8.888   0.671  -0.634
  248   1HD1  LEU  35          11HD      LEU  35   6.793   1.835  -0.366
  249   2HD1  LEU  35          12HD      LEU  35   6.561   0.268  -1.120
  250   3HD1  LEU  35          13HD      LEU  35   6.491   1.736  -2.106
  251   1HD2  LEU  35          21HD      LEU  35   9.733   0.153  -2.887
  252   2HD2  LEU  35          22HD      LEU  35   8.175   0.647  -3.567
  253   3HD2  LEU  35          23HD      LEU  35   8.267  -0.740  -2.492
  254    H    GLY  36           H        GLY  36  10.016   4.289   0.768
  255   1HA   GLY  36          1HA       GLY  36   9.987   2.169   2.780
  256   2HA   GLY  36          2HA       GLY  36  10.580   3.800   3.084
  257    H    ILE  37           H        ILE  37   7.725   2.638   1.366
  258    HA   ILE  37           HA       ILE  37   6.175   4.268   3.223
  259    HB   ILE  37           HB       ILE  37   5.379   3.406   0.426
  260   1HG1  ILE  37          11HG      ILE  37   7.129   5.217   0.678
  261   2HG1  ILE  37          12HG      ILE  37   5.691   5.719  -0.246
  262   1HG2  ILE  37          21HG      ILE  37   3.452   3.488   1.910
  263   2HG2  ILE  37          22HG      ILE  37   3.389   4.879   0.819
  264   3HG2  ILE  37          23HG      ILE  37   3.925   5.078   2.487
  265   1HD1  ILE  37          11HD      ILE  37   4.934   6.826   1.862
  266   2HD1  ILE  37          12HD      ILE  37   6.450   7.460   1.223
  267   3HD1  ILE  37          13HD      ILE  37   6.467   6.335   2.586
  268    H    PHE  38           H        PHE  38   5.291   3.149   4.653
  269    HA   PHE  38           HA       PHE  38   4.521   0.392   4.033
  270   1HB   PHE  38          1HB       PHE  38   5.284   1.679   6.630
  271   2HB   PHE  38          2HB       PHE  38   4.677   0.031   6.489
  272    HD1  PHE  38           HD1      PHE  38   7.482   2.253   5.811
  273    HD2  PHE  38           HD2      PHE  38   6.084  -1.741   5.634
  274    HE1  PHE  38           HE1      PHE  38   9.769   1.518   5.433
  275    HE2  PHE  38           HE2      PHE  38   8.357  -2.544   5.245
  276    HZ   PHE  38           HZ       PHE  38  10.246  -0.921   5.141
  277    H    VAL  39           H        VAL  39   2.700  -0.334   5.443
  278    HA   VAL  39           HA       VAL  39   0.580   1.595   5.201
  279    HB   VAL  39           HB       VAL  39   0.495  -1.241   6.297
  280   1HG1  VAL  39          11HG      VAL  39  -1.442   0.112   6.914
  281   2HG1  VAL  39          12HG      VAL  39  -1.894  -1.139   5.753
  282   3HG1  VAL  39          13HG      VAL  39  -1.700   0.528   5.220
  283   1HG2  VAL  39          21HG      VAL  39  -0.017  -0.287   3.478
  284   2HG2  VAL  39          22HG      VAL  39  -0.241  -1.941   4.053
  285   3HG2  VAL  39          23HG      VAL  39   1.369  -1.225   4.006
  286    H    LYS  40           H        LYS  40  -0.162   2.761   6.865
  287    HA   LYS  40           HA       LYS  40   1.286   2.497   9.363
  288   1HB   LYS  40          1HB       LYS  40   1.261   4.717   8.386
  289   2HB   LYS  40          2HB       LYS  40  -0.476   4.701   8.310
  290   1HG   LYS  40          1HG       LYS  40   0.143   6.182  10.064
  291   2HG   LYS  40          2HG       LYS  40  -0.539   4.750  10.814
  292   1HD   LYS  40          1HD       LYS  40   2.441   5.265  10.556
  293   2HD   LYS  40          2HD       LYS  40   1.497   5.746  11.955
  294   1HE   LYS  40          1HE       LYS  40   0.851   3.304  12.192
  295   2HE   LYS  40          2HE       LYS  40   2.048   2.971  10.952
  296   1HZ   LYS  40          1HZ       LYS  40   3.787   3.794  12.335
  297   2HZ   LYS  40          2HZ       LYS  40   2.898   2.660  13.202
  298   3HZ   LYS  40          3HZ       LYS  40   2.674   4.306  13.502
  299    H    THR  41           H        THR  41  -2.023   2.717   8.154
  300    HA   THR  41           HA       THR  41  -2.967   1.172  10.410
  301    HB   THR  41           HB       THR  41  -4.459   3.564   9.607
  302    HG1  THR  41           HG1      THR  41  -3.302   4.884  11.082
  303   1HG2  THR  41          21HG      THR  41  -5.580   2.002  11.051
  304   2HG2  THR  41          22HG      THR  41  -5.294   3.488  11.954
  305   3HG2  THR  41          23HG      THR  41  -4.263   2.080  12.229
  306    H    VAL  42           H        VAL  42  -5.247   0.553   9.887
  307    HA   VAL  42           HA       VAL  42  -5.959   0.809   7.105
  308    HB   VAL  42           HB       VAL  42  -6.018  -1.803   8.693
  309   1HG1  VAL  42          11HG      VAL  42  -6.756  -2.830   6.604
  310   2HG1  VAL  42          12HG      VAL  42  -6.691  -1.231   5.841
  311   3HG1  VAL  42          13HG      VAL  42  -7.850  -1.536   7.133
  312   1HG2  VAL  42          21HG      VAL  42  -4.364  -2.662   7.101
  313   2HG2  VAL  42          22HG      VAL  42  -3.732  -1.284   8.008
  314   3HG2  VAL  42          23HG      VAL  42  -4.274  -1.071   6.345
  315    H    THR  43           H        THR  43  -8.317   0.839   6.983
  316    HA   THR  43           HA       THR  43  -9.710   1.628   9.253
  317    HB   THR  43           HB       THR  43 -10.566   2.032   6.922
  318    HG1  THR  43           HG1      THR  43 -12.319   2.258   8.013
  319   1HG2  THR  43          21HG      THR  43  -9.992  -0.165   6.023
  320   2HG2  THR  43          22HG      THR  43 -11.715   0.190   5.770
  321   3HG2  THR  43          23HG      THR  43 -11.193  -0.878   7.094
  322    H    GLU  44           H        GLU  44 -11.020   0.540  10.605
  323    HA   GLU  44           HA       GLU  44 -10.209  -2.142  11.168
  324   1HB   GLU  44          1HB       GLU  44 -11.393  -1.769  13.230
  325   2HB   GLU  44          2HB       GLU  44 -10.307  -0.421  12.900
  326   1HG   GLU  44          1HG       GLU  44 -12.335   0.653  11.861
  327   2HG   GLU  44          2HG       GLU  44 -13.258  -0.587  12.699
  328    H    GLY  45           H        GLY  45 -12.882  -0.464   9.824
  329   1HA   GLY  45          1HA       GLY  45 -14.278  -2.974   9.496
  330   2HA   GLY  45          2HA       GLY  45 -15.186  -1.627  10.240
  331    H    GLY  46           H        GLY  46 -13.263  -2.628   7.533
  332   1HA   GLY  46          1HA       GLY  46 -15.236  -1.680   5.760
  333   2HA   GLY  46          2HA       GLY  46 -13.593  -1.022   5.593
  334    H    ALA  47           H        ALA  47 -14.466  -2.513   3.685
  335    HA   ALA  47           HA       ALA  47 -14.145  -5.263   3.870
  336   1HB   ALA  47          1HB       ALA  47 -15.197  -4.083   1.958
  337   2HB   ALA  47          2HB       ALA  47 -14.123  -5.403   1.507
  338   3HB   ALA  47          3HB       ALA  47 -13.573  -3.740   1.351
  339    H    ALA  48           H        ALA  48 -11.641  -3.218   4.420
  340    HA   ALA  48           HA       ALA  48  -9.546  -4.511   2.889
  341   1HB   ALA  48          1HB       ALA  48  -9.373  -2.119   3.397
  342   2HB   ALA  48          2HB       ALA  48  -8.007  -3.014   4.068
  343   3HB   ALA  48          3HB       ALA  48  -9.321  -2.488   5.121
  344    H    GLN  49           H        GLN  49 -10.067  -4.107   6.437
  345    HA   GLN  49           HA       GLN  49  -8.477  -6.389   6.876
  346   1HB   GLN  49          1HB       GLN  49 -10.201  -4.758   8.703
  347   2HB   GLN  49          2HB       GLN  49  -9.300  -6.165   9.282
  348   1HG   GLN  49          1HG       GLN  49  -7.251  -5.009   8.267
  349   2HG   GLN  49          2HG       GLN  49  -8.287  -3.594   8.143
  350   1HE2  GLN  49          21HE      GLN  49  -8.882  -2.552   9.928
  351   2HE2  GLN  49          22HE      GLN  49  -8.198  -2.806  11.492
  352    H    ARG  50           H        ARG  50 -11.714  -5.997   6.013
  353    HA   ARG  50           HA       ARG  50 -12.579  -8.508   7.007
  354   1HB   ARG  50          1HB       ARG  50 -13.624  -6.724   4.858
  355   2HB   ARG  50          2HB       ARG  50 -14.352  -8.288   5.170
  356   1HG   ARG  50          1HG       ARG  50 -14.061  -6.087   7.174
  357   2HG   ARG  50          2HG       ARG  50 -15.554  -6.445   6.281
  358   1HD   ARG  50          1HD       ARG  50 -14.115  -8.184   8.295
  359   2HD   ARG  50          2HD       ARG  50 -15.690  -7.426   8.484
  360    HE   ARG  50           HE       ARG  50 -15.844  -9.040   6.249
  361   1HH1  ARG  50          11HH      ARG  50 -15.415  -9.455   9.736
  362   2HH1  ARG  50          12HH      ARG  50 -16.008 -11.043   9.770
  363   1HH2  ARG  50          21HH      ARG  50 -16.576 -11.235   6.268
  364   2HH2  ARG  50          22HH      ARG  50 -16.646 -12.108   7.729
  365    H    ASP  51           H        ASP  51 -11.041  -7.345   4.049
  366    HA   ASP  51           HA       ASP  51 -11.033  -9.740   2.606
  367   1HB   ASP  51          1HB       ASP  51 -10.268  -7.754   1.504
  368   2HB   ASP  51          2HB       ASP  51  -9.029  -7.483   2.722
  369    H    GLY  52           H        GLY  52  -8.413  -8.493   4.646
  370   1HA   GLY  52          1HA       GLY  52  -7.405  -9.706   6.408
  371   2HA   GLY  52          2HA       GLY  52  -8.146 -11.166   5.782
  372    H    ARG  53           H        ARG  53  -6.871 -10.104   3.035
  373    HA   ARG  53           HA       ARG  53  -4.450 -11.695   3.318
  374   1HB   ARG  53          1HB       ARG  53  -5.891 -11.646   1.272
  375   2HB   ARG  53          2HB       ARG  53  -5.354  -9.992   1.026
  376   1HG   ARG  53          1HG       ARG  53  -3.000 -10.889   1.042
  377   2HG   ARG  53          2HG       ARG  53  -3.718 -12.501   0.947
  378   1HD   ARG  53          1HD       ARG  53  -5.021 -11.706  -0.984
  379   2HD   ARG  53          2HD       ARG  53  -4.060 -10.214  -0.875
  380    HE   ARG  53           HE       ARG  53  -2.341 -12.441  -1.022
  381   1HH1  ARG  53          11HH      ARG  53  -4.546 -10.661  -3.113
  382   2HH1  ARG  53          12HH      ARG  53  -3.641 -10.876  -4.529
  383   1HH2  ARG  53          21HH      ARG  53  -1.138 -12.883  -2.999
  384   2HH2  ARG  53          22HH      ARG  53  -1.689 -12.240  -4.464
  385    H    ILE  54           H        ILE  54  -5.457  -8.432   2.858
  386    HA   ILE  54           HA       ILE  54  -2.739  -7.460   2.948
  387    HB   ILE  54           HB       ILE  54  -4.612  -6.465   1.482
  388   1HG1  ILE  54          11HG      ILE  54  -3.009  -4.681   3.326
  389   2HG1  ILE  54          12HG      ILE  54  -2.531  -5.387   1.777
  390   1HG2  ILE  54          21HG      ILE  54  -6.413  -6.391   3.101
  391   2HG2  ILE  54          22HG      ILE  54  -6.044  -4.739   2.583
  392   3HG2  ILE  54          23HG      ILE  54  -5.459  -5.341   4.142
  393   1HD1  ILE  54          11HD      ILE  54  -4.160  -4.023   0.610
  394   2HD1  ILE  54          12HD      ILE  54  -3.068  -3.014   1.551
  395   3HD1  ILE  54          13HD      ILE  54  -4.704  -3.327   2.138
  396    H    GLN  55           H        GLN  55  -1.876  -6.298   4.744
  397    HA   GLN  55           HA       GLN  55  -3.612  -6.034   7.014
  398   1HB   GLN  55          1HB       GLN  55  -0.937  -7.459   7.131
  399   2HB   GLN  55          2HB       GLN  55  -1.791  -6.891   8.551
  400   1HG   GLN  55          1HG       GLN  55  -3.658  -8.391   7.999
  401   2HG   GLN  55          2HG       GLN  55  -2.763  -8.974   6.601
  402   1HE2  GLN  55          21HE      GLN  55  -3.007  -8.985  10.055
  403   2HE2  GLN  55          22HE      GLN  55  -1.927 -10.300  10.320
  404    H    VAL  56           H        VAL  56  -2.237  -4.926   8.830
  405    HA   VAL  56           HA       VAL  56  -1.502  -2.377   7.732
  406    HB   VAL  56           HB       VAL  56  -2.889  -2.829   9.794
  407   1HG1  VAL  56          11HG      VAL  56  -1.612  -4.487  10.872
  408   2HG1  VAL  56          12HG      VAL  56  -1.770  -3.086  11.933
  409   3HG1  VAL  56          13HG      VAL  56  -0.255  -3.375  11.077
  410   1HG2  VAL  56          21HG      VAL  56  -2.061  -0.869  11.046
  411   2HG2  VAL  56          22HG      VAL  56  -2.145  -0.574   9.316
  412   3HG2  VAL  56          23HG      VAL  56  -0.591  -0.901  10.079
  413    H    ASN  57           H        ASN  57   0.285  -5.121   8.124
  414    HA   ASN  57           HA       ASN  57   2.658  -3.674   9.101
  415   1HB   ASN  57          1HB       ASN  57   3.590  -5.770   9.830
  416   2HB   ASN  57          2HB       ASN  57   1.906  -5.681  10.357
  417   1HD2  ASN  57          21HD      ASN  57   0.448  -7.167   9.602
  418   2HD2  ASN  57          22HD      ASN  57   0.887  -8.495   8.593
  419    H    ASP  58           H        ASP  58   1.302  -4.226   6.360
  420    HA   ASP  58           HA       ASP  58   3.543  -5.334   4.875
  421   1HB   ASP  58          1HB       ASP  58   0.738  -4.556   4.022
  422   2HB   ASP  58          2HB       ASP  58   1.947  -5.249   2.951
  423    H    GLN  59           H        GLN  59   3.439  -4.117   2.500
  424    HA   GLN  59           HA       GLN  59   4.009  -1.289   2.995
  425   1HB   GLN  59          1HB       GLN  59   6.162  -2.314   3.072
  426   2HB   GLN  59          2HB       GLN  59   5.775  -3.350   1.704
  427   1HG   GLN  59          1HG       GLN  59   5.908  -1.534   0.184
  428   2HG   GLN  59          2HG       GLN  59   6.009  -0.364   1.493
  429   1HE2  GLN  59          21HE      GLN  59   7.923  -0.057   2.509
  430   2HE2  GLN  59          22HE      GLN  59   9.428  -0.656   1.890
  431    H    ILE  60           H        ILE  60   3.111   0.036   1.490
  432    HA   ILE  60           HA       ILE  60   1.584  -1.107  -0.673
  433    HB   ILE  60           HB       ILE  60   2.188   1.817  -0.129
  434   1HG1  ILE  60          11HG      ILE  60   0.967   0.873   1.801
  435   2HG1  ILE  60          12HG      ILE  60  -0.047   1.957   0.845
  436   1HG2  ILE  60          21HG      ILE  60   0.368   2.301  -1.625
  437   2HG2  ILE  60          22HG      ILE  60  -0.053   0.597  -1.678
  438   3HG2  ILE  60          23HG      ILE  60   1.443   1.127  -2.424
  439   1HD1  ILE  60          11HD      ILE  60  -0.135  -1.044   0.778
  440   2HD1  ILE  60          12HD      ILE  60  -1.139   0.038  -0.184
  441   3HD1  ILE  60          13HD      ILE  60  -1.304   0.015   1.573
  442    H    VAL  61           H        VAL  61   2.772  -1.793  -2.416
  443    HA   VAL  61           HA       VAL  61   5.264  -0.428  -3.075
  444    HB   VAL  61           HB       VAL  61   3.974  -2.937  -4.190
  445   1HG1  VAL  61          11HG      VAL  61   6.039  -3.443  -5.271
  446   2HG1  VAL  61          12HG      VAL  61   6.745  -1.907  -4.736
  447   3HG1  VAL  61          13HG      VAL  61   5.387  -1.921  -5.881
  448   1HG2  VAL  61          21HG      VAL  61   4.684  -3.180  -1.903
  449   2HG2  VAL  61          22HG      VAL  61   6.303  -2.602  -2.312
  450   3HG2  VAL  61          23HG      VAL  61   5.708  -4.132  -2.970
  451    H    GLU  62           H        GLU  62   2.261  -1.320  -4.651
  452    HA   GLU  62           HA       GLU  62   2.328   1.087  -6.242
  453   1HB   GLU  62          1HB       GLU  62   3.435  -0.296  -7.778
  454   2HB   GLU  62          2HB       GLU  62   2.439  -1.691  -7.430
  455   1HG   GLU  62          1HG       GLU  62   0.552  -0.638  -8.489
  456   2HG   GLU  62          2HG       GLU  62   1.471   0.836  -8.733
  457    H    VAL  63           H        VAL  63   0.313   1.953  -6.189
  458    HA   VAL  63           HA       VAL  63  -1.863   0.061  -5.853
  459    HB   VAL  63           HB       VAL  63  -1.353   2.685  -4.490
  460   1HG1  VAL  63          11HG      VAL  63  -3.750   2.954  -4.024
  461   2HG1  VAL  63          12HG      VAL  63  -4.117   1.597  -5.109
  462   3HG1  VAL  63          13HG      VAL  63  -3.412   3.085  -5.751
  463   1HG2  VAL  63          21HG      VAL  63  -2.752   0.160  -3.717
  464   2HG2  VAL  63          22HG      VAL  63  -2.318   1.492  -2.650
  465   3HG2  VAL  63          23HG      VAL  63  -1.054   0.513  -3.426
  466    H    ASP  64           H        ASP  64  -3.227  -0.059  -7.350
  467    HA   ASP  64           HA       ASP  64  -4.588   0.374  -9.105
  468   1HB   ASP  64          1HB       ASP  64  -5.247   2.306  -7.612
  469   2HB   ASP  64          2HB       ASP  64  -4.101   3.307  -8.479
  470    H    GLY  65           H        GLY  65  -1.564   0.460  -9.274
  471   1HA   GLY  65          1HA       GLY  65  -0.158   0.234 -11.087
  472   2HA   GLY  65          2HA       GLY  65  -1.432   0.858 -12.131
  473    H    ILE  66           H        ILE  66  -0.732   2.796  -9.359
  474    HA   ILE  66           HA       ILE  66   0.218   4.905 -11.023
  475    HB   ILE  66           HB       ILE  66  -1.168   5.003  -8.706
  476   1HG1  ILE  66          11HG      ILE  66   0.973   7.032  -9.397
  477   2HG1  ILE  66          12HG      ILE  66  -0.577   6.895 -10.223
  478   1HG2  ILE  66          21HG      ILE  66   0.291   5.674  -6.844
  479   2HG2  ILE  66          22HG      ILE  66   1.689   5.169  -7.801
  480   3HG2  ILE  66          23HG      ILE  66   0.484   3.982  -7.312
  481   1HD1  ILE  66          11HD      ILE  66  -0.650   8.692  -8.622
  482   2HD1  ILE  66          12HD      ILE  66  -0.117   7.592  -7.352
  483   3HD1  ILE  66          13HD      ILE  66  -1.704   7.367  -8.098
  484    H    SER  67           H        SER  67   1.741   2.386  -9.446
  485    HA   SER  67           HA       SER  67   3.754   1.863  -8.600
  486   1HB   SER  67          1HB       SER  67   5.695   2.394 -10.202
  487   2HB   SER  67          2HB       SER  67   4.320   1.504 -10.858
  488    HG   SER  67           HG       SER  67   4.166   4.259 -11.027
  489    H    LEU  68           H        LEU  68   3.794   2.875  -6.642
  490    HA   LEU  68           HA       LEU  68   4.967   5.549  -6.560
  491   1HB   LEU  68          1HB       LEU  68   4.163   5.646  -4.278
  492   2HB   LEU  68          2HB       LEU  68   2.867   5.285  -5.398
  493    HG   LEU  68           HG       LEU  68   4.042   2.877  -4.324
  494   1HD1  LEU  68          11HD      LEU  68   2.847   4.860  -2.395
  495   2HD1  LEU  68          12HD      LEU  68   4.528   4.335  -2.476
  496   3HD1  LEU  68          13HD      LEU  68   3.270   3.171  -2.041
  497   1HD2  LEU  68          21HD      LEU  68   1.719   2.384  -3.890
  498   2HD2  LEU  68          22HD      LEU  68   1.928   3.069  -5.502
  499   3HD2  LEU  68          23HD      LEU  68   1.284   4.069  -4.194
  500    H    VAL  69           H        VAL  69   6.177   2.817  -6.806
  501    HA   VAL  69           HA       VAL  69   7.943   2.288  -4.722
  502    HB   VAL  69           HB       VAL  69   8.613   2.038  -7.675
  503   1HG1  VAL  69          11HG      VAL  69  10.096   0.211  -6.987
  504   2HG1  VAL  69          12HG      VAL  69   9.727   0.556  -5.297
  505   3HG1  VAL  69          13HG      VAL  69  10.563   1.757  -6.280
  506   1HG2  VAL  69          21HG      VAL  69   6.503   0.924  -7.220
  507   2HG2  VAL  69          22HG      VAL  69   7.229   0.063  -5.865
  508   3HG2  VAL  69          23HG      VAL  69   7.770  -0.270  -7.511
  509    H    GLY  70           H        GLY  70   8.676   4.129  -3.802
  510   1HA   GLY  70          1HA       GLY  70  10.762   5.292  -3.471
  511   2HA   GLY  70          2HA       GLY  70  10.870   5.482  -5.217
  512    H    VAL  71           H        VAL  71   8.300   6.187  -2.815
  513    HA   VAL  71           HA       VAL  71   8.436   8.964  -3.691
  514    HB   VAL  71           HB       VAL  71   6.027   9.235  -3.622
  515   1HG1  VAL  71          11HG      VAL  71   5.354   7.925  -5.559
  516   2HG1  VAL  71          12HG      VAL  71   6.793   6.922  -5.373
  517   3HG1  VAL  71          13HG      VAL  71   6.958   8.636  -5.752
  518   1HG2  VAL  71          21HG      VAL  71   4.494   7.363  -3.316
  519   2HG2  VAL  71          22HG      VAL  71   5.500   7.600  -1.891
  520   3HG2  VAL  71          23HG      VAL  71   5.858   6.279  -3.006
  521    H    THR  72           H        THR  72   6.896  10.277  -2.139
  522    HA   THR  72           HA       THR  72   7.798   9.764   0.594
  523    HB   THR  72           HB       THR  72   6.898  12.140   0.863
  524    HG1  THR  72           HG1      THR  72   7.153  12.352  -1.914
  525   1HG2  THR  72          21HG      THR  72   8.904  13.139  -0.163
  526   2HG2  THR  72          22HG      THR  72   9.177  11.640  -1.067
  527   3HG2  THR  72          23HG      THR  72   9.267  11.642   0.699
  528    H    GLN  73           H        GLN  73   6.194  10.627   2.225
  529    HA   GLN  73           HA       GLN  73   3.949   8.932   2.014
  530   1HB   GLN  73          1HB       GLN  73   3.561   9.272   4.260
  531   2HB   GLN  73          2HB       GLN  73   5.189   9.911   4.189
  532   1HG   GLN  73          1HG       GLN  73   2.705  11.593   4.008
  533   2HG   GLN  73          2HG       GLN  73   3.568  11.280   5.508
  534   1HE2  GLN  73          21HE      GLN  73   6.183  11.411   4.307
  535   2HE2  GLN  73          22HE      GLN  73   6.424  13.065   3.918
  536    H    ASN  74           H        ASN  74   4.427  12.255   1.207
  537    HA   ASN  74           HA       ASN  74   1.635  12.886   1.184
  538   1HB   ASN  74          1HB       ASN  74   2.214  14.976   0.015
  539   2HB   ASN  74          2HB       ASN  74   3.250  14.736   1.410
  540   1HD2  ASN  74          21HD      ASN  74   5.418  14.608   1.105
  541   2HD2  ASN  74          22HD      ASN  74   6.158  14.752  -0.444
  542    H    PHE  75           H        PHE  75   3.816  11.533  -1.149
  543    HA   PHE  75           HA       PHE  75   1.980  11.807  -3.301
  544   1HB   PHE  75          1HB       PHE  75   4.457  11.410  -3.621
  545   2HB   PHE  75          2HB       PHE  75   4.199   9.786  -3.003
  546    HD1  PHE  75           HD1      PHE  75   3.982  11.929  -5.896
  547    HD2  PHE  75           HD2      PHE  75   2.759   8.177  -4.300
  548    HE1  PHE  75           HE1      PHE  75   3.431  11.134  -8.163
  549    HE2  PHE  75           HE2      PHE  75   2.209   7.384  -6.529
  550    HZ   PHE  75           HZ       PHE  75   2.546   8.862  -8.485
  551    H    ALA  76           H        ALA  76   2.959   9.225  -1.100
  552    HA   ALA  76           HA       ALA  76   1.203   7.259  -2.036
  553   1HB   ALA  76          1HB       ALA  76   1.672   6.077   0.021
  554   2HB   ALA  76          2HB       ALA  76   2.360   7.549   0.727
  555   3HB   ALA  76          3HB       ALA  76   3.140   6.779  -0.659
  556    H    ALA  77           H        ALA  77   0.764   9.651   0.568
  557    HA   ALA  77           HA       ALA  77  -1.749   8.774   1.415
  558   1HB   ALA  77          1HB       ALA  77  -2.068  11.029   2.317
  559   2HB   ALA  77          2HB       ALA  77  -0.715  11.615   1.350
  560   3HB   ALA  77          3HB       ALA  77  -0.434  10.451   2.643
  561    H    THR  78           H        THR  78  -0.792  10.705  -1.313
  562    HA   THR  78           HA       THR  78  -3.415  11.534  -2.006
  563    HB   THR  78           HB       THR  78  -0.852  11.425  -3.564
  564    HG1  THR  78           HG1      THR  78  -0.603  12.919  -2.064
  565   1HG2  THR  78          21HG      THR  78  -3.433  12.829  -4.290
  566   2HG2  THR  78          22HG      THR  78  -2.777  11.402  -5.093
  567   3HG2  THR  78          23HG      THR  78  -1.916  12.939  -5.191
  568    H    VAL  79           H        VAL  79  -1.265   8.918  -3.289
  569    HA   VAL  79           HA       VAL  79  -3.193   8.054  -5.058
  570    HB   VAL  79           HB       VAL  79  -0.998   7.341  -5.555
  571   1HG1  VAL  79          11HG      VAL  79  -0.200   7.445  -3.481
  572   2HG1  VAL  79          12HG      VAL  79   0.220   5.832  -4.171
  573   3HG1  VAL  79          13HG      VAL  79  -1.113   6.044  -2.966
  574   1HG2  VAL  79          21HG      VAL  79  -1.244   4.926  -5.809
  575   2HG2  VAL  79          22HG      VAL  79  -2.710   5.814  -6.258
  576   3HG2  VAL  79          23HG      VAL  79  -2.621   4.980  -4.707
  577    H    LEU  80           H        LEU  80  -2.567   6.913  -1.781
  578    HA   LEU  80           HA       LEU  80  -4.649   4.940  -1.820
  579   1HB   LEU  80          1HB       LEU  80  -3.123   6.227   0.443
  580   2HB   LEU  80          2HB       LEU  80  -4.432   5.113   0.742
  581    HG   LEU  80           HG       LEU  80  -2.388   3.919   1.007
  582   1HD1  LEU  80          11HD      LEU  80  -2.566   2.133  -0.559
  583   2HD1  LEU  80          12HD      LEU  80  -3.457   3.163  -1.672
  584   3HD1  LEU  80          13HD      LEU  80  -4.175   2.719  -0.129
  585   1HD2  LEU  80          21HD      LEU  80  -0.653   3.722  -0.608
  586   2HD2  LEU  80          22HD      LEU  80  -0.952   5.452  -0.355
  587   3HD2  LEU  80          23HD      LEU  80  -1.595   4.624  -1.781
  588    H    ARG  81           H        ARG  81  -4.813   8.258  -1.773
  589    HA   ARG  81           HA       ARG  81  -7.407   8.324  -0.434
  590   1HB   ARG  81          1HB       ARG  81  -5.936  10.093   0.266
  591   2HB   ARG  81          2HB       ARG  81  -5.539  10.502  -1.386
  592   1HG   ARG  81          1HG       ARG  81  -8.358  10.846  -0.477
  593   2HG   ARG  81          2HG       ARG  81  -7.144  11.993   0.082
  594   1HD   ARG  81          1HD       ARG  81  -6.544  12.514  -2.230
  595   2HD   ARG  81          2HD       ARG  81  -7.680  11.316  -2.817
  596    HE   ARG  81           HE       ARG  81  -9.198  12.954  -1.249
  597   1HH1  ARG  81          11HH      ARG  81  -7.166  13.592  -4.121
  598   2HH1  ARG  81          12HH      ARG  81  -8.153  14.863  -4.655
  599   1HH2  ARG  81          21HH      ARG  81 -10.470  14.706  -2.028
  600   2HH2  ARG  81          22HH      ARG  81 -10.049  15.518  -3.472
  601    H    ASN  82           H        ASN  82  -6.002   8.404  -3.571
  602    HA   ASN  82           HA       ASN  82  -8.354   9.484  -4.861
  603   1HB   ASN  82          1HB       ASN  82  -5.641   8.744  -5.758
  604   2HB   ASN  82          2HB       ASN  82  -6.921   8.702  -6.967
  605   1HD2  ASN  82          21HD      ASN  82  -5.204  10.689  -4.705
  606   2HD2  ASN  82          22HD      ASN  82  -5.648  12.203  -5.427
  607    H    THR  83           H        THR  83  -7.664   6.521  -3.682
  608    HA   THR  83           HA       THR  83  -8.427   4.866  -5.838
  609    HB   THR  83           HB       THR  83  -8.507   3.198  -3.883
  610    HG1  THR  83           HG1      THR  83  -7.839   3.973  -1.975
  611   1HG2  THR  83          21HG      THR  83  -5.974   4.742  -4.472
  612   2HG2  THR  83          22HG      THR  83  -6.609   3.424  -5.458
  613   3HG2  THR  83          23HG      THR  83  -6.048   3.110  -3.818
  614    H    LYS  84           H        LYS  84 -10.210   3.416  -5.755
  615    HA   LYS  84           HA       LYS  84 -12.632   4.473  -4.467
  616   1HB   LYS  84          1HB       LYS  84 -12.219   3.142  -7.145
  617   2HB   LYS  84          2HB       LYS  84 -13.802   3.329  -6.415
  618   1HG   LYS  84          1HG       LYS  84 -11.956   5.585  -7.151
  619   2HG   LYS  84          2HG       LYS  84 -13.327   5.004  -8.105
  620   1HD   LYS  84          1HD       LYS  84 -14.800   5.473  -6.168
  621   2HD   LYS  84          2HD       LYS  84 -13.427   6.190  -5.343
  622   1HE   LYS  84          1HE       LYS  84 -14.799   7.919  -6.430
  623   2HE   LYS  84          2HE       LYS  84 -13.171   7.857  -7.097
  624   1HZ   LYS  84          1HZ       LYS  84 -14.035   6.609  -8.992
  625   2HZ   LYS  84          2HZ       LYS  84 -14.862   8.058  -8.828
  626   3HZ   LYS  84          3HZ       LYS  84 -15.578   6.616  -8.316
  627    H    GLY  85           H        GLY  85 -14.255   2.325  -4.981
  628   1HA   GLY  85          1HA       GLY  85 -13.728   0.383  -3.136
  629   2HA   GLY  85          2HA       GLY  85 -14.762   0.150  -4.535
  630    H    ASN  86           H        ASN  86 -13.289  -0.144  -6.652
  631    HA   ASN  86           HA       ASN  86 -11.791  -2.553  -6.042
  632   1HB   ASN  86          1HB       ASN  86 -12.441  -1.247  -8.688
  633   2HB   ASN  86          2HB       ASN  86 -11.431  -2.675  -8.554
  634   1HD2  ASN  86          21HD      ASN  86 -14.399  -1.993  -6.721
  635   2HD2  ASN  86          22HD      ASN  86 -15.301  -3.291  -7.414
  636    H    VAL  87           H        VAL  87  -9.764  -2.529  -5.508
  637    HA   VAL  87           HA       VAL  87  -7.986  -0.464  -6.670
  638    HB   VAL  87           HB       VAL  87  -7.527  -1.552  -3.960
  639   1HG1  VAL  87          11HG      VAL  87  -6.354   0.557  -3.610
  640   2HG1  VAL  87          12HG      VAL  87  -6.736   1.020  -5.270
  641   3HG1  VAL  87          13HG      VAL  87  -5.734  -0.403  -4.953
  642   1HG2  VAL  87          21HG      VAL  87  -9.274   0.842  -4.479
  643   2HG2  VAL  87          22HG      VAL  87  -8.678   0.272  -2.900
  644   3HG2  VAL  87          23HG      VAL  87  -9.760  -0.737  -3.852
  645    H    ARG  88           H        ARG  88  -6.163  -1.323  -7.451
  646    HA   ARG  88           HA       ARG  88  -5.429  -4.063  -6.732
  647   1HB   ARG  88          1HB       ARG  88  -4.503  -2.199  -8.891
  648   2HB   ARG  88          2HB       ARG  88  -3.745  -3.749  -8.555
  649   1HG   ARG  88          1HG       ARG  88  -5.711  -4.928  -9.123
  650   2HG   ARG  88          2HG       ARG  88  -6.651  -3.436  -9.226
  651   1HD   ARG  88          1HD       ARG  88  -6.032  -4.265 -11.418
  652   2HD   ARG  88          2HD       ARG  88  -5.326  -2.682 -11.032
  653    HE   ARG  88           HE       ARG  88  -3.659  -4.996 -10.536
  654   1HH1  ARG  88          11HH      ARG  88  -4.469  -2.408 -12.846
  655   2HH1  ARG  88          12HH      ARG  88  -2.981  -2.445 -13.639
  656   1HH2  ARG  88          21HH      ARG  88  -1.546  -5.021 -11.672
  657   2HH2  ARG  88          22HH      ARG  88  -1.303  -3.958 -12.964
  658    H    PHE  89           H        PHE  89  -4.515  -3.949  -4.797
  659    HA   PHE  89           HA       PHE  89  -2.368  -2.045  -4.332
  660   1HB   PHE  89          1HB       PHE  89  -3.431  -4.282  -2.582
  661   2HB   PHE  89          2HB       PHE  89  -2.196  -3.130  -2.124
  662    HD1  PHE  89           HD1      PHE  89  -2.760  -0.871  -1.579
  663    HD2  PHE  89           HD2      PHE  89  -5.723  -3.693  -2.664
  664    HE1  PHE  89           HE1      PHE  89  -4.484   0.629  -0.675
  665    HE2  PHE  89           HE2      PHE  89  -7.466  -2.199  -1.773
  666    HZ   PHE  89           HZ       PHE  89  -6.829  -0.030  -0.763
  667    H    VAL  90           H        VAL  90  -0.609  -2.640  -5.472
  668    HA   VAL  90           HA       VAL  90   0.016  -5.461  -5.550
  669    HB   VAL  90           HB       VAL  90   1.396  -3.143  -6.927
  670   1HG1  VAL  90          11HG      VAL  90   1.666  -6.123  -7.359
  671   2HG1  VAL  90          12HG      VAL  90   2.861  -5.073  -6.603
  672   3HG1  VAL  90          13HG      VAL  90   2.475  -4.878  -8.314
  673   1HG2  VAL  90          21HG      VAL  90  -0.879  -3.401  -7.761
  674   2HG2  VAL  90          22HG      VAL  90  -0.586  -5.112  -8.074
  675   3HG2  VAL  90          23HG      VAL  90   0.287  -3.886  -8.990
  676    H    ILE  91           H        ILE  91   0.488  -5.631  -3.495
  677    HA   ILE  91           HA       ILE  91   2.634  -4.088  -2.313
  678    HB   ILE  91           HB       ILE  91   0.378  -5.785  -1.320
  679   1HG1  ILE  91          11HG      ILE  91   1.151  -2.963  -0.752
  680   2HG1  ILE  91          12HG      ILE  91  -0.035  -3.444  -1.956
  681   1HG2  ILE  91          21HG      ILE  91   1.072  -5.449   0.993
  682   2HG2  ILE  91          22HG      ILE  91   2.579  -4.718   0.444
  683   3HG2  ILE  91          23HG      ILE  91   2.248  -6.415   0.101
  684   1HD1  ILE  91          11HD      ILE  91  -1.085  -2.695   0.013
  685   2HD1  ILE  91          12HD      ILE  91  -0.158  -3.864   0.985
  686   3HD1  ILE  91          13HD      ILE  91  -1.343  -4.434  -0.230
  687    H    GLY  92           H        GLY  92   4.236  -5.225  -1.271
  688   1HA   GLY  92          1HA       GLY  92   4.436  -7.978  -2.111
  689   2HA   GLY  92          2HA       GLY  92   5.839  -6.886  -2.205
  690    H    ARG  93           H        ARG  93   5.757  -9.217  -0.619
  691    HA   ARG  93           HA       ARG  93   6.045  -7.901   1.975
  692   1HB   ARG  93          1HB       ARG  93   3.801  -8.920   1.811
  693   2HB   ARG  93          2HB       ARG  93   4.592 -10.488   1.688
  694   1HG   ARG  93          1HG       ARG  93   5.739  -9.960   3.841
  695   2HG   ARG  93          2HG       ARG  93   4.652  -8.573   3.985
  696   1HD   ARG  93          1HD       ARG  93   2.764 -10.037   3.795
  697   2HD   ARG  93          2HD       ARG  93   3.885 -11.406   3.641
  698    HE   ARG  93           HE       ARG  93   3.177  -9.959   6.030
  699   1HH1  ARG  93          11HH      ARG  93   5.526 -12.215   4.541
  700   2HH1  ARG  93          12HH      ARG  93   6.073 -12.847   6.007
  701   1HH2  ARG  93          21HH      ARG  93   3.901 -10.903   8.060
  702   2HH2  ARG  93          22HH      ARG  93   5.105 -12.102   8.067
  703    H    GLU  94           H        GLU  94   7.695  -8.556   3.137
  704    HA   GLU  94           HA       GLU  94   8.988 -11.122   2.584
  705   1HB   GLU  94          1HB       GLU  94  10.353  -8.512   3.298
  706   2HB   GLU  94          2HB       GLU  94  11.147 -10.074   3.305
  707   1HG   GLU  94          1HG       GLU  94  10.610 -10.218   0.850
  708   2HG   GLU  94          2HG       GLU  94  10.099  -8.529   0.961
  Start of MODEL   13
    1   1H    GLY   1          1H        GLY   1  12.904 -15.105  -3.783
    2   2H    GLY   1          2H        GLY   1  12.405 -15.272  -5.390
    3   3H    GLY   1          3H        GLY   1  11.475 -14.377  -4.288
    4   1HA   GLY   1          1HA       GLY   1  14.193 -13.651  -5.167
    5   2HA   GLY   1          2HA       GLY   1  12.701 -12.907  -5.736
    6    H    HIS   2           H        HIS   2  14.384 -11.185  -4.687
    7    HA   HIS   2           HA       HIS   2  14.232 -10.888  -1.867
    8   1HB   HIS   2          1HB       HIS   2  14.889  -8.859  -4.026
    9   2HB   HIS   2          2HB       HIS   2  15.067  -8.569  -2.304
   10    HD1  HIS   2           HD1      HIS   2  16.725 -10.265  -5.211
   11    HD2  HIS   2           HD2      HIS   2  17.261  -9.823  -1.106
   12    HE1  HIS   2           HE1      HIS   2  19.063 -11.030  -4.727
   13    H    MET   3           H        MET   3  12.250 -10.752  -1.001
   14    HA   MET   3           HA       MET   3  10.285  -9.929  -0.339
   15   1HB   MET   3          1HB       MET   3  11.371  -7.769  -0.426
   16   2HB   MET   3          2HB       MET   3  10.991  -7.621  -2.127
   17   1HG   MET   3          1HG       MET   3   8.616  -7.510  -1.605
   18   2HG   MET   3          2HG       MET   3   8.979  -7.663   0.123
   19   1HE   MET   3          1HE       MET   3   7.750  -5.438   0.790
   20   2HE   MET   3          2HE       MET   3   7.216  -5.274  -0.881
   21   3HE   MET   3          3HE       MET   3   7.964  -3.906  -0.057
   22    H    GLU   4           H        GLU   4   8.479 -10.866  -0.880
   23    HA   GLU   4           HA       GLU   4   7.989 -11.454  -3.679
   24   1HB   GLU   4          1HB       GLU   4   7.637 -13.216  -1.950
   25   2HB   GLU   4          2HB       GLU   4   6.408 -12.190  -1.227
   26   1HG   GLU   4          1HG       GLU   4   5.055 -12.369  -3.245
   27   2HG   GLU   4          2HG       GLU   4   6.295 -13.375  -3.984
   28    H    LEU   5           H        LEU   5   7.163  -9.786  -4.789
   29    HA   LEU   5           HA       LEU   5   5.179  -8.103  -3.561
   30   1HB   LEU   5          1HB       LEU   5   6.133  -8.111  -6.435
   31   2HB   LEU   5          2HB       LEU   5   5.145  -6.887  -5.673
   32    HG   LEU   5           HG       LEU   5   7.200  -5.898  -5.786
   33   1HD1  LEU   5          11HD      LEU   5   6.301  -5.679  -3.588
   34   2HD1  LEU   5          12HD      LEU   5   8.072  -5.654  -3.579
   35   3HD1  LEU   5          13HD      LEU   5   7.206  -7.116  -3.094
   36   1HD2  LEU   5          21HD      LEU   5   9.341  -6.913  -5.243
   37   2HD2  LEU   5          22HD      LEU   5   8.505  -7.822  -6.507
   38   3HD2  LEU   5          23HD      LEU   5   8.528  -8.426  -4.852
   39    H    PHE   6           H        PHE   6   3.041  -8.332  -3.805
   40    HA   PHE   6           HA       PHE   6   2.090 -10.093  -5.869
   41   1HB   PHE   6          1HB       PHE   6   0.449 -10.955  -4.105
   42   2HB   PHE   6          2HB       PHE   6   2.039 -11.706  -4.177
   43    HD1  PHE   6           HD1      PHE   6  -0.250  -9.472  -2.459
   44    HD2  PHE   6           HD2      PHE   6   3.470 -11.455  -2.246
   45    HE1  PHE   6           HE1      PHE   6  -0.117  -8.937  -0.037
   46    HE2  PHE   6           HE2      PHE   6   3.641 -10.950   0.137
   47    HZ   PHE   6           HZ       PHE   6   1.842  -9.677   1.261
   48    HA   PRO   7           HA       PRO   7  -1.018  -6.979  -6.089
   49   1HB   PRO   7          1HB       PRO   7  -2.613  -8.111  -7.821
   50   2HB   PRO   7          2HB       PRO   7  -1.025  -7.512  -8.293
   51   1HG   PRO   7          1HG       PRO   7  -1.868 -10.353  -7.746
   52   2HG   PRO   7          2HG       PRO   7  -0.760  -9.750  -9.009
   53   1HD   PRO   7          1HD       PRO   7  -0.056 -10.875  -6.560
   54   2HD   PRO   7          2HD       PRO   7   0.991  -9.835  -7.564
   55    H    VAL   8           H        VAL   8  -2.443  -6.673  -4.580
   56    HA   VAL   8           HA       VAL   8  -4.394  -8.769  -4.032
   57    HB   VAL   8           HB       VAL   8  -3.788  -6.355  -2.290
   58   1HG1  VAL   8          11HG      VAL   8  -5.988  -7.180  -1.970
   59   2HG1  VAL   8          12HG      VAL   8  -4.999  -7.534  -0.549
   60   3HG1  VAL   8          13HG      VAL   8  -5.377  -8.814  -1.709
   61   1HG2  VAL   8          21HG      VAL   8  -2.803  -9.175  -1.953
   62   2HG2  VAL   8          22HG      VAL   8  -2.581  -7.854  -0.793
   63   3HG2  VAL   8          23HG      VAL   8  -1.839  -7.764  -2.400
   64    H    GLU   9           H        GLU   9  -6.146  -8.266  -5.314
   65    HA   GLU   9           HA       GLU   9  -6.618  -5.437  -5.752
   66   1HB   GLU   9          1HB       GLU   9  -6.641  -6.964  -7.743
   67   2HB   GLU   9          2HB       GLU   9  -8.070  -7.737  -7.050
   68   1HG   GLU   9          1HG       GLU   9  -9.139  -5.470  -7.007
   69   2HG   GLU   9          2HG       GLU   9  -7.776  -4.893  -7.959
   70    H    LEU  10           H        LEU  10  -7.574  -4.690  -4.102
   71    HA   LEU  10           HA       LEU  10  -9.420  -6.379  -2.650
   72   1HB   LEU  10          1HB       LEU  10  -7.540  -4.494  -1.983
   73   2HB   LEU  10          2HB       LEU  10  -9.044  -3.609  -1.843
   74    HG   LEU  10           HG       LEU  10  -8.289  -6.110  -0.306
   75   1HD1  LEU  10          11HD      LEU  10  -7.113  -4.181   0.308
   76   2HD1  LEU  10          12HD      LEU  10  -8.268  -4.689   1.561
   77   3HD1  LEU  10          13HD      LEU  10  -8.634  -3.295   0.509
   78   1HD2  LEU  10          21HD      LEU  10 -10.793  -4.452  -0.299
   79   2HD2  LEU  10          22HD      LEU  10 -10.342  -5.605   0.954
   80   3HD2  LEU  10          23HD      LEU  10 -10.612  -6.169  -0.703
   81    H    GLU  11           H        GLU  11 -11.517  -5.480  -2.192
   82    HA   GLU  11           HA       GLU  11 -12.401  -3.565  -4.184
   83   1HB   GLU  11          1HB       GLU  11 -13.181  -5.751  -4.887
   84   2HB   GLU  11          2HB       GLU  11 -13.829  -6.071  -3.289
   85   1HG   GLU  11          1HG       GLU  11 -15.484  -4.332  -3.579
   86   2HG   GLU  11          2HG       GLU  11 -14.785  -3.907  -5.143
   87    H    LYS  12           H        LYS  12 -12.464  -1.892  -2.989
   88    HA   LYS  12           HA       LYS  12 -13.737  -2.024  -0.416
   89   1HB   LYS  12          1HB       LYS  12 -11.787  -0.256  -1.708
   90   2HB   LYS  12          2HB       LYS  12 -12.795   0.489  -0.497
   91   1HG   LYS  12          1HG       LYS  12 -10.942  -1.878  -0.207
   92   2HG   LYS  12          2HG       LYS  12 -10.726  -0.268   0.480
   93   1HD   LYS  12          1HD       LYS  12 -13.260  -1.316   1.234
   94   2HD   LYS  12          2HD       LYS  12 -12.001  -2.494   1.707
   95   1HE   LYS  12          1HE       LYS  12 -12.355  -1.192   3.544
   96   2HE   LYS  12          2HE       LYS  12 -10.968  -0.440   2.847
   97   1HZ   LYS  12          1HZ       LYS  12 -12.423   1.327   1.800
   98   2HZ   LYS  12          2HZ       LYS  12 -12.676   1.287   3.460
   99   3HZ   LYS  12          3HZ       LYS  12 -13.772   0.584   2.449
  100    H    ASP  13           H        ASP  13 -14.515   0.378  -0.010
  101    HA   ASP  13           HA       ASP  13 -16.948   0.796  -1.371
  102   1HB   ASP  13          1HB       ASP  13 -15.436   2.765   0.311
  103   2HB   ASP  13          2HB       ASP  13 -17.159   2.625   0.106
  104    H    GLU  14           H        GLU  14 -17.321   2.681  -2.622
  105    HA   GLU  14           HA       GLU  14 -15.155   3.502  -4.285
  106   1HB   GLU  14          1HB       GLU  14 -16.805   5.064  -5.314
  107   2HB   GLU  14          2HB       GLU  14 -17.334   3.392  -5.278
  108   1HG   GLU  14          1HG       GLU  14 -18.764   3.873  -3.365
  109   2HG   GLU  14          2HG       GLU  14 -18.203   5.546  -3.369
  110    H    ASP  15           H        ASP  15 -16.143   4.409  -1.289
  111    HA   ASP  15           HA       ASP  15 -15.397   7.173  -1.219
  112   1HB   ASP  15          1HB       ASP  15 -16.799   5.932   0.525
  113   2HB   ASP  15          2HB       ASP  15 -15.295   5.223   1.088
  114    H    GLY  16           H        GLY  16 -13.741   4.035  -0.655
  115   1HA   GLY  16          1HA       GLY  16 -11.402   4.286  -1.528
  116   2HA   GLY  16          2HA       GLY  16 -11.259   5.489  -0.251
  117    H    LEU  17           H        LEU  17  -9.816   4.450   0.969
  118    HA   LEU  17           HA       LEU  17 -10.426   1.710   1.863
  119   1HB   LEU  17          1HB       LEU  17  -7.915   3.225   2.411
  120   2HB   LEU  17          2HB       LEU  17  -8.182   1.494   2.430
  121    HG   LEU  17           HG       LEU  17  -8.091   3.262   0.053
  122   1HD1  LEU  17          11HD      LEU  17  -5.949   2.989   0.980
  123   2HD1  LEU  17          12HD      LEU  17  -6.033   1.965  -0.455
  124   3HD1  LEU  17          13HD      LEU  17  -6.167   1.252   1.151
  125   1HD2  LEU  17          21HD      LEU  17  -8.140   1.158  -1.271
  126   2HD2  LEU  17          22HD      LEU  17  -9.629   1.462  -0.383
  127   3HD2  LEU  17          23HD      LEU  17  -8.479   0.266   0.219
  128    H    GLY  18           H        GLY  18  -9.451   4.896   2.915
  129   1HA   GLY  18          1HA       GLY  18  -9.886   6.025   4.846
  130   2HA   GLY  18          2HA       GLY  18 -10.776   4.623   5.437
  131    H    ILE  19           H        ILE  19  -7.491   4.426   4.200
  132    HA   ILE  19           HA       ILE  19  -6.715   3.571   6.917
  133    HB   ILE  19           HB       ILE  19  -4.944   2.243   5.989
  134   1HG1  ILE  19          11HG      ILE  19  -5.709   3.317   3.260
  135   2HG1  ILE  19          12HG      ILE  19  -4.311   3.825   4.206
  136   1HG2  ILE  19          21HG      ILE  19  -7.182   1.255   5.957
  137   2HG2  ILE  19          22HG      ILE  19  -6.205   0.655   4.613
  138   3HG2  ILE  19          23HG      ILE  19  -7.439   1.885   4.335
  139   1HD1  ILE  19          11HD      ILE  19  -3.370   1.589   4.078
  140   2HD1  ILE  19          12HD      ILE  19  -3.689   2.215   2.461
  141   3HD1  ILE  19          13HD      ILE  19  -4.781   1.032   3.180
  142    H    SER  20           H        SER  20  -4.093   3.682   6.972
  143    HA   SER  20           HA       SER  20  -3.274   6.458   6.468
  144   1HB   SER  20          1HB       SER  20  -2.954   4.907   9.055
  145   2HB   SER  20          2HB       SER  20  -2.436   6.561   8.774
  146    HG   SER  20           HG       SER  20  -4.778   6.854   8.220
  147    H    ILE  21           H        ILE  21  -0.970   6.657   6.387
  148    HA   ILE  21           HA       ILE  21   0.485   4.144   5.925
  149    HB   ILE  21           HB       ILE  21   1.671   5.267   4.070
  150   1HG1  ILE  21          11HG      ILE  21   0.185   7.312   3.086
  151   2HG1  ILE  21          12HG      ILE  21  -0.154   7.507   4.778
  152   1HG2  ILE  21          21HG      ILE  21  -1.302   5.061   3.681
  153   2HG2  ILE  21          22HG      ILE  21  -0.122   3.760   3.533
  154   3HG2  ILE  21          23HG      ILE  21  -0.107   5.100   2.386
  155   1HD1  ILE  21          11HD      ILE  21   1.687   8.948   4.056
  156   2HD1  ILE  21          12HD      ILE  21   2.613   7.567   3.566
  157   3HD1  ILE  21          13HD      ILE  21   2.227   7.798   5.261
  158    H    ILE  22           H        ILE  22   2.863   4.494   6.085
  159    HA   ILE  22           HA       ILE  22   3.503   6.922   7.483
  160    HB   ILE  22           HB       ILE  22   3.215   5.315   9.241
  161   1HG1  ILE  22          11HG      ILE  22   6.160   5.886   8.834
  162   2HG1  ILE  22          12HG      ILE  22   4.991   7.019   9.486
  163   1HG2  ILE  22          21HG      ILE  22   4.629   3.316   9.473
  164   2HG2  ILE  22          22HG      ILE  22   5.308   3.652   7.876
  165   3HG2  ILE  22          23HG      ILE  22   3.593   3.259   8.040
  166   1HD1  ILE  22          11HD      ILE  22   5.814   4.412  10.739
  167   2HD1  ILE  22          12HD      ILE  22   4.657   5.562  11.417
  168   3HD1  ILE  22          13HD      ILE  22   6.350   6.014  11.232
  169    H    GLY  23           H        GLY  23   5.339   7.879   6.860
  170   1HA   GLY  23          1HA       GLY  23   6.691   6.647   4.626
  171   2HA   GLY  23          2HA       GLY  23   6.829   8.328   5.141
  172    H    MET  24           H        MET  24   8.223   5.309   5.119
  173    HA   MET  24           HA       MET  24  10.309   6.171   7.048
  174   1HB   MET  24          1HB       MET  24   9.434   3.332   6.442
  175   2HB   MET  24          2HB       MET  24  10.686   3.809   7.572
  176   1HG   MET  24          1HG       MET  24   7.738   4.392   7.848
  177   2HG   MET  24          2HG       MET  24   8.623   3.140   8.707
  178   1HE   MET  24          1HE       MET  24  11.324   4.533   9.531
  179   2HE   MET  24          2HE       MET  24  10.344   3.597  10.660
  180   3HE   MET  24          3HE       MET  24  10.914   5.207  11.110
  181    H    GLY  25           H        GLY  25  12.365   4.898   6.528
  182   1HA   GLY  25          1HA       GLY  25  12.583   4.889   3.592
  183   2HA   GLY  25          2HA       GLY  25  13.815   5.600   4.617
  184    H    VAL  26           H        VAL  26  12.567   2.770   3.254
  185    HA   VAL  26           HA       VAL  26  14.574   1.210   4.669
  186    HB   VAL  26           HB       VAL  26  12.345   0.177   4.649
  187   1HG1  VAL  26          11HG      VAL  26  11.463   1.042   2.582
  188   2HG1  VAL  26          12HG      VAL  26  11.305  -0.714   2.642
  189   3HG1  VAL  26          13HG      VAL  26  12.569   0.028   1.658
  190   1HG2  VAL  26          21HG      VAL  26  14.318  -1.374   2.998
  191   2HG2  VAL  26          22HG      VAL  26  12.931  -2.065   3.836
  192   3HG2  VAL  26          23HG      VAL  26  14.236  -1.316   4.759
  193    H    GLY  27           H        GLY  27  16.436   1.710   3.851
  194   1HA   GLY  27          1HA       GLY  27  16.732   1.689   0.958
  195   2HA   GLY  27          2HA       GLY  27  17.752   2.591   2.065
  196    H    ALA  28           H        ALA  28  19.635   1.771   2.501
  197    HA   ALA  28           HA       ALA  28  20.509  -0.499   1.050
  198   1HB   ALA  28          1HB       ALA  28  22.013   1.195   3.024
  199   2HB   ALA  28          2HB       ALA  28  21.861   1.515   1.296
  200   3HB   ALA  28          3HB       ALA  28  22.717   0.080   1.858
  201    H    ASP  29           H        ASP  29  19.489  -0.064   4.315
  202    HA   ASP  29           HA       ASP  29  20.990  -2.160   5.498
  203   1HB   ASP  29          1HB       ASP  29  19.898  -0.389   6.836
  204   2HB   ASP  29          2HB       ASP  29  18.325  -1.045   6.384
  205    H    ALA  30           H        ALA  30  18.069  -2.118   3.702
  206    HA   ALA  30           HA       ALA  30  17.739  -4.995   4.183
  207   1HB   ALA  30          1HB       ALA  30  15.862  -3.028   2.892
  208   2HB   ALA  30          2HB       ALA  30  15.731  -3.665   4.532
  209   3HB   ALA  30          3HB       ALA  30  15.525  -4.738   3.144
  210    H    GLY  31           H        GLY  31  18.751  -2.685   1.876
  211   1HA   GLY  31          1HA       GLY  31  19.984  -3.217  -0.092
  212   2HA   GLY  31          2HA       GLY  31  19.271  -4.834  -0.005
  213    H    LEU  32           H        LEU  32  17.295  -2.019   0.310
  214    HA   LEU  32           HA       LEU  32  16.057  -2.923  -2.171
  215   1HB   LEU  32          1HB       LEU  32  14.758  -1.539   0.144
  216   2HB   LEU  32          2HB       LEU  32  13.942  -2.162  -1.290
  217    HG   LEU  32           HG       LEU  32  15.173  -3.696   0.981
  218   1HD1  LEU  32          11HD      LEU  32  12.958  -2.917   1.403
  219   2HD1  LEU  32          12HD      LEU  32  12.948  -4.668   1.195
  220   3HD1  LEU  32          13HD      LEU  32  12.385  -3.620  -0.109
  221   1HD2  LEU  32          21HD      LEU  32  15.856  -4.876  -0.987
  222   2HD2  LEU  32          22HD      LEU  32  14.229  -4.790  -1.675
  223   3HD2  LEU  32          23HD      LEU  32  14.534  -5.776  -0.240
  224    H    GLU  33           H        GLU  33  16.113   0.091  -0.206
  225    HA   GLU  33           HA       GLU  33  16.244   2.262  -0.759
  226   1HB   GLU  33          1HB       GLU  33  17.695   1.221  -3.191
  227   2HB   GLU  33          2HB       GLU  33  17.596   2.926  -2.759
  228   1HG   GLU  33          1HG       GLU  33  18.726   2.399  -0.616
  229   2HG   GLU  33          2HG       GLU  33  18.894   0.734  -1.153
  230    H    LYS  34           H        LYS  34  13.980   0.908  -1.303
  231    HA   LYS  34           HA       LYS  34  12.904   2.534  -3.488
  232   1HB   LYS  34          1HB       LYS  34  10.949   0.943  -3.526
  233   2HB   LYS  34          2HB       LYS  34  12.461   0.201  -3.972
  234   1HG   LYS  34          1HG       LYS  34  12.615  -0.952  -1.902
  235   2HG   LYS  34          2HG       LYS  34  11.317   0.011  -1.210
  236   1HD   LYS  34          1HD       LYS  34  10.679  -2.339  -1.892
  237   2HD   LYS  34          2HD       LYS  34   9.669  -1.046  -2.529
  238   1HE   LYS  34          1HE       LYS  34  10.135  -2.734  -4.235
  239   2HE   LYS  34          2HE       LYS  34  10.822  -1.165  -4.649
  240   1HZ   LYS  34          1HZ       LYS  34  13.012  -2.004  -3.970
  241   2HZ   LYS  34          2HZ       LYS  34  12.339  -2.934  -5.158
  242   3HZ   LYS  34          3HZ       LYS  34  12.350  -3.506  -3.591
  243    H    LEU  35           H        LEU  35  10.250   2.334  -2.659
  244    HA   LEU  35           HA       LEU  35   9.912   4.447  -0.927
  245   1HB   LEU  35          1HB       LEU  35   7.591   3.775  -0.946
  246   2HB   LEU  35          2HB       LEU  35   8.267   3.600  -2.553
  247    HG   LEU  35           HG       LEU  35   8.664   1.134  -1.380
  248   1HD1  LEU  35          11HD      LEU  35   5.953   2.117  -0.593
  249   2HD1  LEU  35          12HD      LEU  35   7.267   1.548   0.448
  250   3HD1  LEU  35          13HD      LEU  35   6.455   0.433  -0.632
  251   1HD2  LEU  35          21HD      LEU  35   8.102   1.476  -3.669
  252   2HD2  LEU  35          22HD      LEU  35   6.451   1.975  -3.243
  253   3HD2  LEU  35          23HD      LEU  35   7.015   0.325  -2.933
  254    H    GLY  36           H        GLY  36   9.526   4.502   1.300
  255   1HA   GLY  36          1HA       GLY  36   9.635   1.911   2.682
  256   2HA   GLY  36          2HA       GLY  36  10.234   3.424   3.371
  257    H    ILE  37           H        ILE  37   7.313   3.026   1.530
  258    HA   ILE  37           HA       ILE  37   5.865   4.280   3.678
  259    HB   ILE  37           HB       ILE  37   4.789   3.366   1.005
  260   1HG1  ILE  37          11HG      ILE  37   6.650   5.061   0.857
  261   2HG1  ILE  37          12HG      ILE  37   5.118   5.628   0.171
  262   1HG2  ILE  37          21HG      ILE  37   3.692   5.273   3.079
  263   2HG2  ILE  37          22HG      ILE  37   3.071   3.676   2.714
  264   3HG2  ILE  37          23HG      ILE  37   2.956   4.962   1.505
  265   1HD1  ILE  37          11HD      ILE  37   4.791   6.827   2.344
  266   2HD1  ILE  37          12HD      ILE  37   6.126   7.390   1.353
  267   3HD1  ILE  37          13HD      ILE  37   6.447   6.356   2.758
  268    H    PHE  38           H        PHE  38   5.327   3.031   5.219
  269    HA   PHE  38           HA       PHE  38   4.291   0.351   4.648
  270   1HB   PHE  38          1HB       PHE  38   5.180   1.632   7.226
  271   2HB   PHE  38          2HB       PHE  38   4.460   0.030   7.137
  272    HD1  PHE  38           HD1      PHE  38   7.464   1.996   6.645
  273    HD2  PHE  38           HD2      PHE  38   5.678  -1.808   6.012
  274    HE1  PHE  38           HE1      PHE  38   9.689   1.027   6.233
  275    HE2  PHE  38           HE2      PHE  38   7.897  -2.787   5.599
  276    HZ   PHE  38           HZ       PHE  38   9.908  -1.370   5.711
  277    H    VAL  39           H        VAL  39   2.378  -0.285   5.866
  278    HA   VAL  39           HA       VAL  39   0.405   1.797   5.723
  279    HB   VAL  39           HB       VAL  39   0.158  -1.081   6.690
  280   1HG1  VAL  39          11HG      VAL  39  -1.667   0.318   7.508
  281   2HG1  VAL  39          12HG      VAL  39  -2.256  -0.798   6.274
  282   3HG1  VAL  39          13HG      VAL  39  -1.976   0.898   5.872
  283   1HG2  VAL  39          21HG      VAL  39   0.903  -0.962   4.359
  284   2HG2  VAL  39          22HG      VAL  39  -0.433   0.106   3.975
  285   3HG2  VAL  39          23HG      VAL  39  -0.753  -1.562   4.453
  286    H    LYS  40           H        LYS  40  -0.271   2.982   7.419
  287    HA   LYS  40           HA       LYS  40   1.152   2.508   9.896
  288   1HB   LYS  40          1HB       LYS  40   1.288   4.770   9.046
  289   2HB   LYS  40          2HB       LYS  40  -0.449   4.889   8.973
  290   1HG   LYS  40          1HG       LYS  40   0.267   6.215  10.805
  291   2HG   LYS  40          2HG       LYS  40  -0.504   4.793  11.476
  292   1HD   LYS  40          1HD       LYS  40   2.506   5.154  11.249
  293   2HD   LYS  40          2HD       LYS  40   1.572   5.565  12.680
  294   1HE   LYS  40          1HE       LYS  40   0.809   3.115  12.655
  295   2HE   LYS  40          2HE       LYS  40   2.075   2.893  11.453
  296   1HZ   LYS  40          1HZ       LYS  40   2.596   3.948  14.166
  297   2HZ   LYS  40          2HZ       LYS  40   3.742   3.500  13.001
  298   3HZ   LYS  40          3HZ       LYS  40   2.775   2.343  13.716
  299    H    THR  41           H        THR  41  -2.135   2.724   8.671
  300    HA   THR  41           HA       THR  41  -3.095   1.171  10.892
  301    HB   THR  41           HB       THR  41  -4.566   3.637  10.330
  302    HG1  THR  41           HG1      THR  41  -2.185   3.409  11.878
  303   1HG2  THR  41          21HG      THR  41  -4.231   1.996  12.841
  304   2HG2  THR  41          22HG      THR  41  -5.612   2.000  11.737
  305   3HG2  THR  41          23HG      THR  41  -5.259   3.426  12.715
  306    H    VAL  42           H        VAL  42  -5.319   0.581  10.387
  307    HA   VAL  42           HA       VAL  42  -6.015   1.086   7.618
  308    HB   VAL  42           HB       VAL  42  -6.813  -1.379   9.238
  309   1HG1  VAL  42          11HG      VAL  42  -8.314  -0.933   7.419
  310   2HG1  VAL  42          12HG      VAL  42  -7.356  -2.354   7.004
  311   3HG1  VAL  42          13HG      VAL  42  -6.964  -0.777   6.306
  312   1HG2  VAL  42          21HG      VAL  42  -4.387  -1.423   8.960
  313   2HG2  VAL  42          22HG      VAL  42  -4.571  -1.179   7.223
  314   3HG2  VAL  42          23HG      VAL  42  -5.146  -2.669   7.968
  315    H    THR  43           H        THR  43  -8.519   0.918   7.475
  316    HA   THR  43           HA       THR  43  -9.730   2.694   9.322
  317    HB   THR  43           HB       THR  43 -10.357   2.607   6.945
  318    HG1  THR  43           HG1      THR  43 -12.129   3.370   7.740
  319   1HG2  THR  43          21HG      THR  43 -11.639   0.720   6.040
  320   2HG2  THR  43          22HG      THR  43 -11.451  -0.137   7.577
  321   3HG2  THR  43          23HG      THR  43 -10.039   0.210   6.585
  322    H    GLU  44           H        GLU  44 -12.091   1.899  10.037
  323    HA   GLU  44           HA       GLU  44 -11.859   0.339  12.318
  324   1HB   GLU  44          1HB       GLU  44 -13.708   1.863  11.974
  325   2HB   GLU  44          2HB       GLU  44 -14.309   0.871  10.651
  326   1HG   GLU  44          1HG       GLU  44 -15.653   0.443  12.586
  327   2HG   GLU  44          2HG       GLU  44 -14.623  -0.956  12.234
  328    H    GLY  45           H        GLY  45 -13.650  -0.753   9.416
  329   1HA   GLY  45          1HA       GLY  45 -12.333  -3.118   9.136
  330   2HA   GLY  45          2HA       GLY  45 -13.539  -3.426  10.385
  331    H    GLY  46           H        GLY  46 -13.591  -1.530   7.355
  332   1HA   GLY  46          1HA       GLY  46 -15.897  -3.015   6.556
  333   2HA   GLY  46          2HA       GLY  46 -15.130  -1.694   5.668
  334    H    ALA  47           H        ALA  47 -14.913  -2.739   3.806
  335    HA   ALA  47           HA       ALA  47 -14.306  -5.441   3.464
  336   1HB   ALA  47          1HB       ALA  47 -14.092  -5.019   1.120
  337   2HB   ALA  47          2HB       ALA  47 -13.912  -3.289   1.412
  338   3HB   ALA  47          3HB       ALA  47 -15.433  -4.091   1.782
  339    H    ALA  48           H        ALA  48 -12.066  -3.052   4.276
  340    HA   ALA  48           HA       ALA  48  -9.780  -4.298   2.949
  341   1HB   ALA  48          1HB       ALA  48  -8.402  -2.728   4.273
  342   2HB   ALA  48          2HB       ALA  48  -9.849  -2.187   5.126
  343   3HB   ALA  48          3HB       ALA  48  -9.681  -1.899   3.394
  344    H    GLN  49           H        GLN  49 -10.511  -3.745   6.426
  345    HA   GLN  49           HA       GLN  49  -8.951  -5.979   7.122
  346   1HB   GLN  49          1HB       GLN  49 -10.796  -4.225   8.698
  347   2HB   GLN  49          2HB       GLN  49  -9.964  -5.586   9.461
  348   1HG   GLN  49          1HG       GLN  49  -7.817  -4.583   8.567
  349   2HG   GLN  49          2HG       GLN  49  -8.792  -3.195   8.103
  350   1HE2  GLN  49          21HE      GLN  49 -10.452  -3.264  10.519
  351   2HE2  GLN  49          22HE      GLN  49  -9.422  -2.707  11.753
  352    H    ARG  50           H        ARG  50 -12.152  -5.800   6.020
  353    HA   ARG  50           HA       ARG  50 -12.908  -8.320   7.144
  354   1HB   ARG  50          1HB       ARG  50 -14.117  -6.673   4.949
  355   2HB   ARG  50          2HB       ARG  50 -14.742  -8.255   5.377
  356   1HG   ARG  50          1HG       ARG  50 -14.478  -5.938   7.234
  357   2HG   ARG  50          2HG       ARG  50 -15.988  -6.378   6.408
  358   1HD   ARG  50          1HD       ARG  50 -15.848  -8.580   7.574
  359   2HD   ARG  50          2HD       ARG  50 -14.424  -7.984   8.426
  360    HE   ARG  50           HE       ARG  50 -16.880  -6.459   8.618
  361   1HH1  ARG  50          11HH      ARG  50 -14.541  -8.629  10.176
  362   2HH1  ARG  50          12HH      ARG  50 -15.174  -8.357  11.739
  363   1HH2  ARG  50          21HH      ARG  50 -17.732  -6.147  10.784
  364   2HH2  ARG  50          22HH      ARG  50 -16.995  -6.952  12.088
  365    H    ASP  51           H        ASP  51 -11.251  -7.153   4.301
  366    HA   ASP  51           HA       ASP  51 -11.451  -9.347   2.624
  367   1HB   ASP  51          1HB       ASP  51 -10.357  -7.308   1.927
  368   2HB   ASP  51          2HB       ASP  51  -9.046  -7.574   3.070
  369    H    GLY  52           H        GLY  52  -8.832  -8.805   4.961
  370   1HA   GLY  52          1HA       GLY  52  -8.243 -10.508   6.534
  371   2HA   GLY  52          2HA       GLY  52  -8.843 -11.703   5.401
  372    H    ARG  53           H        ARG  53  -7.178 -10.000   3.284
  373    HA   ARG  53           HA       ARG  53  -4.688 -11.473   3.810
  374   1HB   ARG  53          1HB       ARG  53  -5.930 -11.510   1.568
  375   2HB   ARG  53          2HB       ARG  53  -5.408  -9.853   1.378
  376   1HG   ARG  53          1HG       ARG  53  -3.465 -12.120   1.772
  377   2HG   ARG  53          2HG       ARG  53  -4.078 -11.681   0.189
  378   1HD   ARG  53          1HD       ARG  53  -2.190 -10.460   0.148
  379   2HD   ARG  53          2HD       ARG  53  -3.180  -9.277   0.989
  380    HE   ARG  53           HE       ARG  53  -1.510 -11.146   2.524
  381   1HH1  ARG  53          11HH      ARG  53  -2.091  -7.812   1.454
  382   2HH1  ARG  53          12HH      ARG  53  -1.009  -7.154   2.624
  383   1HH2  ARG  53          21HH      ARG  53   0.105 -10.154   3.990
  384   2HH2  ARG  53          22HH      ARG  53   0.291  -8.454   3.953
  385    H    ILE  54           H        ILE  54  -5.672  -8.204   2.850
  386    HA   ILE  54           HA       ILE  54  -3.072  -7.171   3.294
  387    HB   ILE  54           HB       ILE  54  -4.887  -6.095   1.813
  388   1HG1  ILE  54          11HG      ILE  54  -3.545  -4.208   3.775
  389   2HG1  ILE  54          12HG      ILE  54  -2.685  -5.015   2.472
  390   1HG2  ILE  54          21HG      ILE  54  -6.726  -6.070   3.399
  391   2HG2  ILE  54          22HG      ILE  54  -6.320  -4.388   3.009
  392   3HG2  ILE  54          23HG      ILE  54  -5.757  -5.122   4.522
  393   1HD1  ILE  54          11HD      ILE  54  -3.265  -2.716   1.911
  394   2HD1  ILE  54          12HD      ILE  54  -4.986  -3.098   2.099
  395   3HD1  ILE  54          13HD      ILE  54  -4.029  -3.868   0.831
  396    H    GLN  55           H        GLN  55  -2.215  -5.977   4.976
  397    HA   GLN  55           HA       GLN  55  -3.803  -5.813   7.368
  398   1HB   GLN  55          1HB       GLN  55  -1.760  -6.745   8.651
  399   2HB   GLN  55          2HB       GLN  55  -2.802  -7.880   7.799
  400   1HG   GLN  55          1HG       GLN  55  -1.267  -8.007   5.974
  401   2HG   GLN  55          2HG       GLN  55  -0.283  -6.725   6.662
  402   1HE2  GLN  55          21HE      GLN  55   1.431  -8.016   6.553
  403   2HE2  GLN  55          22HE      GLN  55   1.750  -9.301   7.677
  404    H    VAL  56           H        VAL  56  -2.378  -4.710   9.161
  405    HA   VAL  56           HA       VAL  56  -1.576  -2.146   8.121
  406    HB   VAL  56           HB       VAL  56  -2.801  -2.666  10.335
  407   1HG1  VAL  56          11HG      VAL  56   0.014  -3.118  11.307
  408   2HG1  VAL  56          12HG      VAL  56  -1.272  -4.301  11.248
  409   3HG1  VAL  56          13HG      VAL  56  -1.401  -2.916  12.341
  410   1HG2  VAL  56          21HG      VAL  56  -2.159  -0.417   9.750
  411   2HG2  VAL  56          22HG      VAL  56  -0.513  -0.710  10.308
  412   3HG2  VAL  56          23HG      VAL  56  -1.846  -0.691  11.461
  413    H    ASN  57           H        ASN  57   0.008  -5.002   8.522
  414    HA   ASN  57           HA       ASN  57   2.546  -3.834   9.325
  415   1HB   ASN  57          1HB       ASN  57   1.780  -5.963  10.357
  416   2HB   ASN  57          2HB       ASN  57   1.826  -6.727   8.774
  417   1HD2  ASN  57          21HD      ASN  57   3.711  -5.439  11.402
  418   2HD2  ASN  57          22HD      ASN  57   5.194  -6.197  10.936
  419    H    ASP  58           H        ASP  58   0.897  -4.109   6.537
  420    HA   ASP  58           HA       ASP  58   2.986  -5.147   4.851
  421   1HB   ASP  58          1HB       ASP  58   0.327  -3.925   4.158
  422   2HB   ASP  58          2HB       ASP  58   1.487  -4.534   2.988
  423    H    GLN  59           H        GLN  59   3.325  -3.883   2.779
  424    HA   GLN  59           HA       GLN  59   3.835  -1.062   3.302
  425   1HB   GLN  59          1HB       GLN  59   5.967  -2.171   3.530
  426   2HB   GLN  59          2HB       GLN  59   5.657  -3.132   2.086
  427   1HG   GLN  59          1HG       GLN  59   5.864  -1.214   0.688
  428   2HG   GLN  59          2HG       GLN  59   5.946  -0.141   2.078
  429   1HE2  GLN  59          21HE      GLN  59   7.825   0.027   3.188
  430   2HE2  GLN  59          22HE      GLN  59   9.332  -0.586   2.561
  431    H    ILE  60           H        ILE  60   2.993   0.187   1.748
  432    HA   ILE  60           HA       ILE  60   1.561  -1.059  -0.421
  433    HB   ILE  60           HB       ILE  60   2.046   1.896   0.061
  434   1HG1  ILE  60          11HG      ILE  60   0.832   0.958   1.987
  435   2HG1  ILE  60          12HG      ILE  60  -0.231   1.954   0.993
  436   1HG2  ILE  60          21HG      ILE  60   1.408   1.184  -2.223
  437   2HG2  ILE  60          22HG      ILE  60   0.239   2.271  -1.474
  438   3HG2  ILE  60          23HG      ILE  60  -0.083   0.534  -1.552
  439   1HD1  ILE  60          11HD      ILE  60  -0.133  -1.046   1.016
  440   2HD1  ILE  60          12HD      ILE  60  -1.182  -0.059  -0.002
  441   3HD1  ILE  60          13HD      ILE  60  -1.381  -0.037   1.751
  442    H    VAL  61           H        VAL  61   2.839  -1.779  -2.071
  443    HA   VAL  61           HA       VAL  61   5.263  -0.334  -2.710
  444    HB   VAL  61           HB       VAL  61   4.149  -2.929  -3.794
  445   1HG1  VAL  61          11HG      VAL  61   5.603  -1.933  -5.439
  446   2HG1  VAL  61          12HG      VAL  61   6.271  -3.396  -4.712
  447   3HG1  VAL  61          13HG      VAL  61   6.902  -1.807  -4.229
  448   1HG2  VAL  61          21HG      VAL  61   6.333  -2.427  -1.789
  449   2HG2  VAL  61          22HG      VAL  61   5.872  -4.001  -2.441
  450   3HG2  VAL  61          23HG      VAL  61   4.727  -3.082  -1.466
  451    H    GLU  62           H        GLU  62   2.332  -1.309  -4.362
  452    HA   GLU  62           HA       GLU  62   2.451   1.070  -6.042
  453   1HB   GLU  62          1HB       GLU  62   3.666  -0.610  -7.341
  454   2HB   GLU  62          2HB       GLU  62   2.330  -1.730  -7.171
  455   1HG   GLU  62          1HG       GLU  62   0.889  -0.104  -8.359
  456   2HG   GLU  62          2HG       GLU  62   2.324   0.878  -8.639
  457    H    VAL  63           H        VAL  63   0.411   1.837  -5.985
  458    HA   VAL  63           HA       VAL  63  -1.734  -0.115  -5.727
  459    HB   VAL  63           HB       VAL  63  -1.416   2.560  -4.381
  460   1HG1  VAL  63          11HG      VAL  63  -4.096   1.315  -5.070
  461   2HG1  VAL  63          12HG      VAL  63  -3.466   2.833  -5.728
  462   3HG1  VAL  63          13HG      VAL  63  -3.836   2.702  -4.001
  463   1HG2  VAL  63          21HG      VAL  63  -1.037   0.422  -3.274
  464   2HG2  VAL  63          22HG      VAL  63  -2.706  -0.031  -3.605
  465   3HG2  VAL  63          23HG      VAL  63  -2.358   1.342  -2.552
  466    H    ASP  64           H        ASP  64  -3.031  -0.303  -7.231
  467    HA   ASP  64           HA       ASP  64  -4.425   0.050  -8.921
  468   1HB   ASP  64          1HB       ASP  64  -5.038   2.187  -7.801
  469   2HB   ASP  64          2HB       ASP  64  -3.804   3.009  -8.742
  470    H    GLY  65           H        GLY  65  -1.344   0.580  -9.061
  471   1HA   GLY  65          1HA       GLY  65   0.075   0.018 -10.900
  472   2HA   GLY  65          2HA       GLY  65  -1.202   0.577 -11.985
  473    H    ILE  66           H        ILE  66  -0.801   2.644  -9.347
  474    HA   ILE  66           HA       ILE  66   0.075   4.796 -10.986
  475    HB   ILE  66           HB       ILE  66  -1.408   4.810  -8.760
  476   1HG1  ILE  66          11HG      ILE  66   0.638   6.961  -9.328
  477   2HG1  ILE  66          12HG      ILE  66  -0.843   6.724 -10.255
  478   1HG2  ILE  66          21HG      ILE  66   1.375   5.247  -7.679
  479   2HG2  ILE  66          22HG      ILE  66   0.314   3.889  -7.300
  480   3HG2  ILE  66          23HG      ILE  66  -0.133   5.529  -6.805
  481   1HD1  ILE  66          11HD      ILE  66  -0.618   7.436  -7.369
  482   2HD1  ILE  66          12HD      ILE  66  -2.138   7.153  -8.221
  483   3HD1  ILE  66          13HD      ILE  66  -1.108   8.524  -8.670
  484    H    SER  67           H        SER  67   1.715   2.465  -9.208
  485    HA   SER  67           HA       SER  67   3.802   2.123  -8.412
  486   1HB   SER  67          1HB       SER  67   5.643   2.642 -10.057
  487   2HB   SER  67          2HB       SER  67   4.263   1.785 -10.749
  488    HG   SER  67           HG       SER  67   4.004   4.488 -10.835
  489    H    LEU  68           H        LEU  68   3.876   3.147  -6.543
  490    HA   LEU  68           HA       LEU  68   4.685   5.949  -6.529
  491   1HB   LEU  68          1HB       LEU  68   3.899   5.918  -4.208
  492   2HB   LEU  68          2HB       LEU  68   2.659   5.430  -5.344
  493    HG   LEU  68           HG       LEU  68   3.890   3.081  -4.562
  494   1HD1  LEU  68          11HD      LEU  68   4.958   4.224  -2.747
  495   2HD1  LEU  68          12HD      LEU  68   3.745   3.094  -2.133
  496   3HD1  LEU  68          13HD      LEU  68   3.408   4.833  -2.169
  497   1HD2  LEU  68          21HD      LEU  68   1.611   3.395  -5.127
  498   2HD2  LEU  68          22HD      LEU  68   1.315   4.331  -3.649
  499   3HD2  LEU  68          23HD      LEU  68   1.744   2.609  -3.558
  500    H    VAL  69           H        VAL  69   6.213   3.432  -6.846
  501    HA   VAL  69           HA       VAL  69   7.977   3.024  -4.708
  502    HB   VAL  69           HB       VAL  69   8.676   2.665  -7.634
  503   1HG1  VAL  69          11HG      VAL  69   9.791   1.347  -5.171
  504   2HG1  VAL  69          12HG      VAL  69  10.613   2.542  -6.171
  505   3HG1  VAL  69          13HG      VAL  69  10.235   0.947  -6.828
  506   1HG2  VAL  69          21HG      VAL  69   7.343   0.707  -5.745
  507   2HG2  VAL  69          22HG      VAL  69   7.921   0.328  -7.369
  508   3HG2  VAL  69          23HG      VAL  69   6.605   1.477  -7.149
  509    H    GLY  70           H        GLY  70   8.774   4.808  -3.781
  510   1HA   GLY  70          1HA       GLY  70  10.948   5.942  -3.673
  511   2HA   GLY  70          2HA       GLY  70  10.721   6.352  -5.367
  512    H    VAL  71           H        VAL  71   7.800   6.601  -3.673
  513    HA   VAL  71           HA       VAL  71   8.086   9.488  -3.721
  514    HB   VAL  71           HB       VAL  71   5.713   9.652  -3.626
  515   1HG1  VAL  71          11HG      VAL  71   5.022   8.416  -5.603
  516   2HG1  VAL  71          12HG      VAL  71   6.456   7.409  -5.471
  517   3HG1  VAL  71          13HG      VAL  71   6.624   9.135  -5.807
  518   1HG2  VAL  71          21HG      VAL  71   5.276   7.918  -1.944
  519   2HG2  VAL  71          22HG      VAL  71   5.618   6.668  -3.134
  520   3HG2  VAL  71          23HG      VAL  71   4.222   7.733  -3.342
  521    H    THR  72           H        THR  72   6.706  10.622  -1.964
  522    HA   THR  72           HA       THR  72   7.644   9.712   0.640
  523    HB   THR  72           HB       THR  72   6.688  12.023   1.249
  524    HG1  THR  72           HG1      THR  72   7.160  12.718  -1.431
  525   1HG2  THR  72          21HG      THR  72   9.081  11.814  -0.617
  526   2HG2  THR  72          22HG      THR  72   9.112  11.531   1.121
  527   3HG2  THR  72          23HG      THR  72   8.774  13.143   0.499
  528    H    GLN  73           H        GLN  73   6.156  10.381   2.374
  529    HA   GLN  73           HA       GLN  73   3.974   8.704   2.334
  530   1HB   GLN  73          1HB       GLN  73   3.573   9.393   4.576
  531   2HB   GLN  73          2HB       GLN  73   5.290   9.496   4.312
  532   1HG   GLN  73          1HG       GLN  73   3.350  11.726   4.357
  533   2HG   GLN  73          2HG       GLN  73   4.464  11.326   5.667
  534   1HE2  GLN  73          21HE      GLN  73   6.795  11.405   5.029
  535   2HE2  GLN  73          22HE      GLN  73   7.250  12.634   3.941
  536    H    ASN  74           H        ASN  74   4.187  12.096   1.613
  537    HA   ASN  74           HA       ASN  74   1.411  12.529   1.752
  538   1HB   ASN  74          1HB       ASN  74   1.832  14.716   0.677
  539   2HB   ASN  74          2HB       ASN  74   2.917  14.427   2.026
  540   1HD2  ASN  74          21HD      ASN  74   5.093  14.262   1.628
  541   2HD2  ASN  74          22HD      ASN  74   5.794  14.593   0.095
  542    H    PHE  75           H        PHE  75   3.550  11.631  -0.869
  543    HA   PHE  75           HA       PHE  75   1.552  11.898  -2.876
  544   1HB   PHE  75          1HB       PHE  75   4.014  11.759  -3.387
  545   2HB   PHE  75          2HB       PHE  75   3.943  10.069  -2.899
  546    HD1  PHE  75           HD1      PHE  75   3.325  12.429  -5.566
  547    HD2  PHE  75           HD2      PHE  75   2.570   8.412  -4.303
  548    HE1  PHE  75           HE1      PHE  75   2.719  11.800  -7.867
  549    HE2  PHE  75           HE2      PHE  75   1.982   7.797  -6.587
  550    HZ   PHE  75           HZ       PHE  75   2.050   9.488  -8.381
  551    H    ALA  76           H        ALA  76   2.870   9.191  -0.984
  552    HA   ALA  76           HA       ALA  76   1.221   7.228  -2.064
  553   1HB   ALA  76          1HB       ALA  76   2.441   7.306   0.687
  554   2HB   ALA  76          2HB       ALA  76   3.232   6.760  -0.798
  555   3HB   ALA  76          3HB       ALA  76   1.841   5.877  -0.166
  556    H    ALA  77           H        ALA  77   0.744   9.262   0.828
  557    HA   ALA  77           HA       ALA  77  -1.638   8.193   1.753
  558   1HB   ALA  77          1HB       ALA  77  -0.788  11.085   1.725
  559   2HB   ALA  77          2HB       ALA  77  -0.390   9.902   2.972
  560   3HB   ALA  77          3HB       ALA  77  -2.063  10.408   2.730
  561    H    THR  78           H        THR  78  -1.075  10.627  -0.693
  562    HA   THR  78           HA       THR  78  -3.731  11.250  -1.334
  563    HB   THR  78           HB       THR  78  -1.211  11.300  -2.958
  564    HG1  THR  78           HG1      THR  78  -1.029  12.692  -1.253
  565   1HG2  THR  78          21HG      THR  78  -2.357  12.917  -4.443
  566   2HG2  THR  78          22HG      THR  78  -3.854  12.645  -3.540
  567   3HG2  THR  78          23HG      THR  78  -3.106  11.318  -4.441
  568    H    VAL  79           H        VAL  79  -1.550   8.781  -2.638
  569    HA   VAL  79           HA       VAL  79  -3.278   7.790  -4.624
  570    HB   VAL  79           HB       VAL  79  -1.210   6.198  -3.084
  571   1HG1  VAL  79          11HG      VAL  79  -2.773   4.810  -4.369
  572   2HG1  VAL  79          12HG      VAL  79  -1.164   4.751  -5.072
  573   3HG1  VAL  79          13HG      VAL  79  -2.419   5.730  -5.821
  574   1HG2  VAL  79          21HG      VAL  79   0.268   6.751  -5.016
  575   2HG2  VAL  79          22HG      VAL  79  -0.157   8.111  -3.985
  576   3HG2  VAL  79          23HG      VAL  79  -0.964   7.917  -5.534
  577    H    LEU  80           H        LEU  80  -2.678   6.628  -1.325
  578    HA   LEU  80           HA       LEU  80  -4.725   4.651  -1.370
  579   1HB   LEU  80          1HB       LEU  80  -3.238   5.916   0.936
  580   2HB   LEU  80          2HB       LEU  80  -4.466   4.701   1.177
  581    HG   LEU  80           HG       LEU  80  -2.363   3.626   1.381
  582   1HD1  LEU  80          11HD      LEU  80  -3.437   2.957  -1.328
  583   2HD1  LEU  80          12HD      LEU  80  -3.983   2.325   0.225
  584   3HD1  LEU  80          13HD      LEU  80  -2.359   1.956  -0.354
  585   1HD2  LEU  80          21HD      LEU  80  -0.620   3.623  -0.299
  586   2HD2  LEU  80          22HD      LEU  80  -0.959   5.269   0.241
  587   3HD2  LEU  80          23HD      LEU  80  -1.575   4.703  -1.309
  588    H    ARG  81           H        ARG  81  -4.961   7.884  -1.278
  589    HA   ARG  81           HA       ARG  81  -7.563   7.915   0.048
  590   1HB   ARG  81          1HB       ARG  81  -6.123   9.605   0.875
  591   2HB   ARG  81          2HB       ARG  81  -5.611  10.071  -0.725
  592   1HG   ARG  81          1HG       ARG  81  -8.467  10.440  -0.290
  593   2HG   ARG  81          2HG       ARG  81  -7.451  11.382   0.806
  594   1HD   ARG  81          1HD       ARG  81  -7.019  11.297  -2.170
  595   2HD   ARG  81          2HD       ARG  81  -8.015  12.542  -1.375
  596    HE   ARG  81           HE       ARG  81  -5.377  12.271  -0.310
  597   1HH1  ARG  81          11HH      ARG  81  -7.327  13.812  -2.833
  598   2HH1  ARG  81          12HH      ARG  81  -6.198  15.046  -3.150
  599   1HH2  ARG  81          21HH      ARG  81  -3.793  13.975  -0.781
  600   2HH2  ARG  81          22HH      ARG  81  -4.167  15.157  -1.935
  601    H    ASN  82           H        ASN  82  -6.116   8.025  -3.058
  602    HA   ASN  82           HA       ASN  82  -8.523   9.005  -4.359
  603   1HB   ASN  82          1HB       ASN  82  -5.757   8.475  -5.258
  604   2HB   ASN  82          2HB       ASN  82  -7.029   8.307  -6.464
  605   1HD2  ASN  82          21HD      ASN  82  -5.480  10.474  -4.242
  606   2HD2  ASN  82          22HD      ASN  82  -6.061  11.922  -4.995
  607    H    THR  83           H        THR  83  -7.617   6.206  -3.121
  608    HA   THR  83           HA       THR  83  -8.158   4.238  -4.984
  609    HB   THR  83           HB       THR  83  -8.737   2.924  -2.884
  610    HG1  THR  83           HG1      THR  83  -9.164   5.206  -1.935
  611   1HG2  THR  83          21HG      THR  83  -6.493   2.953  -3.909
  612   2HG2  THR  83          22HG      THR  83  -6.377   2.944  -2.152
  613   3HG2  THR  83          23HG      THR  83  -6.118   4.442  -3.045
  614    H    LYS  84           H        LYS  84  -9.961   2.885  -5.171
  615    HA   LYS  84           HA       LYS  84 -12.545   3.862  -4.358
  616   1HB   LYS  84          1HB       LYS  84 -13.304   3.191  -6.790
  617   2HB   LYS  84          2HB       LYS  84 -12.625   4.777  -6.510
  618   1HG   LYS  84          1HG       LYS  84 -11.762   3.929  -8.556
  619   2HG   LYS  84          2HG       LYS  84 -10.454   3.919  -7.377
  620   1HD   LYS  84          1HD       LYS  84 -10.801   1.492  -7.072
  621   2HD   LYS  84          2HD       LYS  84 -12.087   1.542  -8.280
  622   1HE   LYS  84          1HE       LYS  84  -9.209   2.317  -8.787
  623   2HE   LYS  84          2HE       LYS  84  -9.912   0.754  -9.193
  624   1HZ   LYS  84          1HZ       LYS  84  -9.801   2.295 -11.089
  625   2HZ   LYS  84          2HZ       LYS  84 -10.812   3.369 -10.312
  626   3HZ   LYS  84          3HZ       LYS  84 -11.385   1.849 -10.757
  627    H    GLY  85           H        GLY  85 -13.919   1.806  -5.818
  628   1HA   GLY  85          1HA       GLY  85 -13.890  -0.327  -4.121
  629   2HA   GLY  85          2HA       GLY  85 -14.423  -0.421  -5.787
  630    H    ASN  86           H        ASN  86 -12.785  -0.988  -7.397
  631    HA   ASN  86           HA       ASN  86 -11.205  -3.196  -6.415
  632   1HB   ASN  86          1HB       ASN  86 -11.562  -2.125  -9.216
  633   2HB   ASN  86          2HB       ASN  86 -10.618  -3.557  -8.818
  634   1HD2  ASN  86          21HD      ASN  86 -11.678  -5.487  -8.575
  635   2HD2  ASN  86          22HD      ASN  86 -13.385  -5.663  -8.613
  636    H    VAL  87           H        VAL  87  -9.436  -2.695  -5.401
  637    HA   VAL  87           HA       VAL  87  -7.574  -0.773  -6.636
  638    HB   VAL  87           HB       VAL  87  -7.661  -1.592  -3.755
  639   1HG1  VAL  87          11HG      VAL  87  -5.532  -0.983  -4.508
  640   2HG1  VAL  87          12HG      VAL  87  -6.153   0.314  -3.461
  641   3HG1  VAL  87          13HG      VAL  87  -6.125   0.518  -5.231
  642   1HG2  VAL  87          21HG      VAL  87  -8.664   0.917  -5.057
  643   2HG2  VAL  87          22HG      VAL  87  -8.543   0.623  -3.311
  644   3HG2  VAL  87          23HG      VAL  87  -9.631  -0.355  -4.304
  645    H    ARG  88           H        ARG  88  -5.875  -1.759  -7.534
  646    HA   ARG  88           HA       ARG  88  -5.020  -4.347  -6.529
  647   1HB   ARG  88          1HB       ARG  88  -3.959  -2.647  -8.757
  648   2HB   ARG  88          2HB       ARG  88  -3.181  -4.125  -8.209
  649   1HG   ARG  88          1HG       ARG  88  -4.374  -4.913  -9.922
  650   2HG   ARG  88          2HG       ARG  88  -5.515  -5.147  -8.624
  651   1HD   ARG  88          1HD       ARG  88  -6.605  -4.187 -10.603
  652   2HD   ARG  88          2HD       ARG  88  -6.715  -3.129  -9.192
  653    HE   ARG  88           HE       ARG  88  -4.782  -1.916 -10.207
  654   1HH1  ARG  88          11HH      ARG  88  -7.109  -3.622 -12.268
  655   2HH1  ARG  88          12HH      ARG  88  -6.781  -2.662 -13.638
  656   1HH2  ARG  88          21HH      ARG  88  -4.420  -0.538 -12.108
  657   2HH2  ARG  88          22HH      ARG  88  -5.277  -0.876 -13.532
  658    H    PHE  89           H        PHE  89  -4.144  -4.231  -4.674
  659    HA   PHE  89           HA       PHE  89  -2.081  -2.254  -4.129
  660   1HB   PHE  89          1HB       PHE  89  -3.174  -4.511  -2.437
  661   2HB   PHE  89          2HB       PHE  89  -1.952  -3.358  -1.939
  662    HD1  PHE  89           HD1      PHE  89  -2.543  -1.125  -1.359
  663    HD2  PHE  89           HD2      PHE  89  -5.484  -3.912  -2.591
  664    HE1  PHE  89           HE1      PHE  89  -4.291   0.333  -0.460
  665    HE2  PHE  89           HE2      PHE  89  -7.241  -2.451  -1.701
  666    HZ   PHE  89           HZ       PHE  89  -6.643  -0.339  -0.623
  667    H    VAL  90           H        VAL  90  -0.310  -2.853  -5.280
  668    HA   VAL  90           HA       VAL  90   0.402  -5.661  -5.196
  669    HB   VAL  90           HB       VAL  90   1.887  -3.406  -6.571
  670   1HG1  VAL  90          11HG      VAL  90   3.010  -5.196  -7.835
  671   2HG1  VAL  90          12HG      VAL  90   2.148  -6.394  -6.872
  672   3HG1  VAL  90          13HG      VAL  90   3.307  -5.314  -6.101
  673   1HG2  VAL  90          21HG      VAL  90   0.916  -4.212  -8.684
  674   2HG2  VAL  90          22HG      VAL  90  -0.325  -3.650  -7.562
  675   3HG2  VAL  90          23HG      VAL  90  -0.051  -5.379  -7.778
  676    H    ILE  91           H        ILE  91   0.713  -5.702  -3.099
  677    HA   ILE  91           HA       ILE  91   2.832  -4.157  -1.850
  678    HB   ILE  91           HB       ILE  91   0.539  -5.861  -0.926
  679   1HG1  ILE  91          11HG      ILE  91   1.206  -2.989  -0.389
  680   2HG1  ILE  91          12HG      ILE  91   0.069  -3.533  -1.613
  681   1HG2  ILE  91          21HG      ILE  91   2.416  -6.382   0.551
  682   2HG2  ILE  91          22HG      ILE  91   1.102  -5.552   1.368
  683   3HG2  ILE  91          23HG      ILE  91   2.573  -4.663   0.947
  684   1HD1  ILE  91          11HD      ILE  91  -1.275  -4.503   0.068
  685   2HD1  ILE  91          12HD      ILE  91  -1.023  -2.749   0.283
  686   3HD1  ILE  91          13HD      ILE  91  -0.168  -3.909   1.327
  687    H    GLY  92           H        GLY  92   4.395  -5.357  -0.648
  688   1HA   GLY  92          1HA       GLY  92   4.566  -8.122  -1.486
  689   2HA   GLY  92          2HA       GLY  92   5.995  -7.085  -1.557
  690    H    ARG  93           H        ARG  93   5.813  -9.447  -0.007
  691    HA   ARG  93           HA       ARG  93   6.128  -8.260   2.620
  692   1HB   ARG  93          1HB       ARG  93   4.356 -10.516   1.897
  693   2HB   ARG  93          2HB       ARG  93   5.250 -10.637   3.399
  694   1HG   ARG  93          1HG       ARG  93   3.774  -8.134   2.826
  695   2HG   ARG  93          2HG       ARG  93   2.851  -9.557   3.350
  696   1HD   ARG  93          1HD       ARG  93   5.223  -8.379   4.809
  697   2HD   ARG  93          2HD       ARG  93   3.537  -8.037   5.216
  698    HE   ARG  93           HE       ARG  93   3.542 -10.673   5.293
  699   1HH1  ARG  93          11HH      ARG  93   5.821  -8.425   6.811
  700   2HH1  ARG  93          12HH      ARG  93   6.210  -9.467   8.092
  701   1HH2  ARG  93          21HH      ARG  93   4.065 -12.089   7.116
  702   2HH2  ARG  93          22HH      ARG  93   5.193 -11.560   8.270
  703    H    GLU  94           H        GLU  94   7.451  -9.190   3.988
  704    HA   GLU  94           HA       GLU  94   9.127 -11.426   3.295
  705   1HB   GLU  94          1HB       GLU  94  10.047  -8.638   4.044
  706   2HB   GLU  94          2HB       GLU  94  11.039 -10.056   4.330
  707   1HG   GLU  94          1HG       GLU  94   9.961  -9.290   1.673
  708   2HG   GLU  94          2HG       GLU  94  11.545  -8.747   2.237
  Start of MODEL   14
    1   1H    GLY   1          1H        GLY   1  12.904 -15.105  -3.783
    2   2H    GLY   1          2H        GLY   1  12.405 -15.272  -5.390
    3   3H    GLY   1          3H        GLY   1  11.475 -14.377  -4.288
    4   1HA   GLY   1          1HA       GLY   1  14.193 -13.651  -5.167
    5   2HA   GLY   1          2HA       GLY   1  12.701 -12.907  -5.736
    6    H    HIS   2           H        HIS   2  14.384 -11.185  -4.687
    7    HA   HIS   2           HA       HIS   2  14.232 -10.888  -1.867
    8   1HB   HIS   2          1HB       HIS   2  14.889  -8.859  -4.026
    9   2HB   HIS   2          2HB       HIS   2  15.067  -8.569  -2.304
   10    HD1  HIS   2           HD1      HIS   2  16.725 -10.265  -5.211
   11    HD2  HIS   2           HD2      HIS   2  17.261  -9.823  -1.106
   12    HE1  HIS   2           HE1      HIS   2  19.063 -11.030  -4.727
   13    H    MET   3           H        MET   3  12.250 -10.752  -1.001
   14    HA   MET   3           HA       MET   3  10.285  -9.929  -0.339
   15   1HB   MET   3          1HB       MET   3  11.371  -7.769  -0.426
   16   2HB   MET   3          2HB       MET   3  10.991  -7.621  -2.127
   17   1HG   MET   3          1HG       MET   3   8.616  -7.510  -1.605
   18   2HG   MET   3          2HG       MET   3   8.979  -7.663   0.123
   19   1HE   MET   3          1HE       MET   3   7.750  -5.438   0.790
   20   2HE   MET   3          2HE       MET   3   7.216  -5.274  -0.881
   21   3HE   MET   3          3HE       MET   3   7.964  -3.906  -0.057
   22    H    GLU   4           H        GLU   4   8.479 -10.866  -0.880
   23    HA   GLU   4           HA       GLU   4   7.989 -11.454  -3.679
   24   1HB   GLU   4          1HB       GLU   4   7.637 -13.216  -1.950
   25   2HB   GLU   4          2HB       GLU   4   6.408 -12.190  -1.227
   26   1HG   GLU   4          1HG       GLU   4   5.055 -12.369  -3.245
   27   2HG   GLU   4          2HG       GLU   4   6.295 -13.375  -3.984
   28    H    LEU   5           H        LEU   5   7.163  -9.786  -4.789
   29    HA   LEU   5           HA       LEU   5   5.179  -8.103  -3.561
   30   1HB   LEU   5          1HB       LEU   5   6.133  -8.111  -6.435
   31   2HB   LEU   5          2HB       LEU   5   5.145  -6.887  -5.673
   32    HG   LEU   5           HG       LEU   5   7.200  -5.898  -5.786
   33   1HD1  LEU   5          11HD      LEU   5   6.301  -5.679  -3.588
   34   2HD1  LEU   5          12HD      LEU   5   8.072  -5.654  -3.579
   35   3HD1  LEU   5          13HD      LEU   5   7.206  -7.116  -3.094
   36   1HD2  LEU   5          21HD      LEU   5   9.341  -6.913  -5.243
   37   2HD2  LEU   5          22HD      LEU   5   8.505  -7.822  -6.507
   38   3HD2  LEU   5          23HD      LEU   5   8.528  -8.426  -4.852
   39    H    PHE   6           H        PHE   6   3.041  -8.332  -3.805
   40    HA   PHE   6           HA       PHE   6   2.090 -10.093  -5.869
   41   1HB   PHE   6          1HB       PHE   6   0.449 -10.955  -4.105
   42   2HB   PHE   6          2HB       PHE   6   2.039 -11.706  -4.177
   43    HD1  PHE   6           HD1      PHE   6  -0.250  -9.472  -2.459
   44    HD2  PHE   6           HD2      PHE   6   3.470 -11.455  -2.246
   45    HE1  PHE   6           HE1      PHE   6  -0.117  -8.937  -0.037
   46    HE2  PHE   6           HE2      PHE   6   3.641 -10.950   0.137
   47    HZ   PHE   6           HZ       PHE   6   1.842  -9.677   1.261
   48    HA   PRO   7           HA       PRO   7  -1.018  -6.979  -6.089
   49   1HB   PRO   7          1HB       PRO   7  -2.613  -8.111  -7.821
   50   2HB   PRO   7          2HB       PRO   7  -1.025  -7.512  -8.293
   51   1HG   PRO   7          1HG       PRO   7  -1.868 -10.353  -7.746
   52   2HG   PRO   7          2HG       PRO   7  -0.760  -9.750  -9.009
   53   1HD   PRO   7          1HD       PRO   7  -0.056 -10.875  -6.560
   54   2HD   PRO   7          2HD       PRO   7   0.991  -9.835  -7.564
   55    H    VAL   8           H        VAL   8  -2.443  -6.673  -4.580
   56    HA   VAL   8           HA       VAL   8  -4.394  -8.769  -4.032
   57    HB   VAL   8           HB       VAL   8  -3.788  -6.355  -2.290
   58   1HG1  VAL   8          11HG      VAL   8  -5.988  -7.180  -1.970
   59   2HG1  VAL   8          12HG      VAL   8  -4.999  -7.534  -0.549
   60   3HG1  VAL   8          13HG      VAL   8  -5.377  -8.814  -1.709
   61   1HG2  VAL   8          21HG      VAL   8  -2.803  -9.175  -1.953
   62   2HG2  VAL   8          22HG      VAL   8  -2.581  -7.854  -0.793
   63   3HG2  VAL   8          23HG      VAL   8  -1.839  -7.764  -2.400
   64    H    GLU   9           H        GLU   9  -6.146  -8.266  -5.314
   65    HA   GLU   9           HA       GLU   9  -6.618  -5.437  -5.752
   66   1HB   GLU   9          1HB       GLU   9  -6.641  -6.964  -7.743
   67   2HB   GLU   9          2HB       GLU   9  -8.070  -7.737  -7.050
   68   1HG   GLU   9          1HG       GLU   9  -9.139  -5.470  -7.007
   69   2HG   GLU   9          2HG       GLU   9  -7.776  -4.893  -7.959
   70    H    LEU  10           H        LEU  10  -7.574  -4.690  -4.102
   71    HA   LEU  10           HA       LEU  10  -9.420  -6.379  -2.650
   72   1HB   LEU  10          1HB       LEU  10  -7.540  -4.494  -1.983
   73   2HB   LEU  10          2HB       LEU  10  -9.044  -3.609  -1.843
   74    HG   LEU  10           HG       LEU  10  -8.289  -6.110  -0.306
   75   1HD1  LEU  10          11HD      LEU  10  -7.113  -4.181   0.308
   76   2HD1  LEU  10          12HD      LEU  10  -8.268  -4.689   1.561
   77   3HD1  LEU  10          13HD      LEU  10  -8.634  -3.295   0.509
   78   1HD2  LEU  10          21HD      LEU  10 -10.793  -4.452  -0.299
   79   2HD2  LEU  10          22HD      LEU  10 -10.342  -5.605   0.954
   80   3HD2  LEU  10          23HD      LEU  10 -10.612  -6.169  -0.703
   81    H    GLU  11           H        GLU  11 -11.517  -5.480  -2.192
   82    HA   GLU  11           HA       GLU  11 -12.401  -3.565  -4.184
   83   1HB   GLU  11          1HB       GLU  11 -13.181  -5.751  -4.887
   84   2HB   GLU  11          2HB       GLU  11 -13.829  -6.071  -3.289
   85   1HG   GLU  11          1HG       GLU  11 -15.484  -4.332  -3.579
   86   2HG   GLU  11          2HG       GLU  11 -14.785  -3.907  -5.143
   87    H    LYS  12           H        LYS  12 -12.464  -1.892  -2.989
   88    HA   LYS  12           HA       LYS  12 -13.737  -2.024  -0.416
   89   1HB   LYS  12          1HB       LYS  12 -11.787  -0.256  -1.708
   90   2HB   LYS  12          2HB       LYS  12 -12.795   0.489  -0.497
   91   1HG   LYS  12          1HG       LYS  12 -10.942  -1.878  -0.207
   92   2HG   LYS  12          2HG       LYS  12 -10.726  -0.268   0.480
   93   1HD   LYS  12          1HD       LYS  12 -13.260  -1.316   1.234
   94   2HD   LYS  12          2HD       LYS  12 -12.001  -2.494   1.707
   95   1HE   LYS  12          1HE       LYS  12 -12.355  -1.192   3.544
   96   2HE   LYS  12          2HE       LYS  12 -10.968  -0.440   2.847
   97   1HZ   LYS  12          1HZ       LYS  12 -12.423   1.327   1.800
   98   2HZ   LYS  12          2HZ       LYS  12 -12.676   1.287   3.460
   99   3HZ   LYS  12          3HZ       LYS  12 -13.772   0.584   2.449
  100    H    ASP  13           H        ASP  13 -14.515   0.378  -0.010
  101    HA   ASP  13           HA       ASP  13 -16.948   0.796  -1.371
  102   1HB   ASP  13          1HB       ASP  13 -15.436   2.765   0.311
  103   2HB   ASP  13          2HB       ASP  13 -17.159   2.625   0.106
  104    H    GLU  14           H        GLU  14 -17.321   2.681  -2.622
  105    HA   GLU  14           HA       GLU  14 -15.155   3.502  -4.285
  106   1HB   GLU  14          1HB       GLU  14 -16.805   5.064  -5.314
  107   2HB   GLU  14          2HB       GLU  14 -17.334   3.392  -5.278
  108   1HG   GLU  14          1HG       GLU  14 -18.764   3.873  -3.365
  109   2HG   GLU  14          2HG       GLU  14 -18.203   5.546  -3.369
  110    H    ASP  15           H        ASP  15 -16.143   4.409  -1.289
  111    HA   ASP  15           HA       ASP  15 -15.397   7.173  -1.219
  112   1HB   ASP  15          1HB       ASP  15 -16.799   5.932   0.525
  113   2HB   ASP  15          2HB       ASP  15 -15.295   5.223   1.088
  114    H    GLY  16           H        GLY  16 -13.741   4.035  -0.655
  115   1HA   GLY  16          1HA       GLY  16 -11.402   4.286  -1.528
  116   2HA   GLY  16          2HA       GLY  16 -11.259   5.489  -0.251
  117    H    LEU  17           H        LEU  17  -9.816   4.450   0.969
  118    HA   LEU  17           HA       LEU  17 -10.426   1.710   1.863
  119   1HB   LEU  17          1HB       LEU  17  -7.915   3.225   2.411
  120   2HB   LEU  17          2HB       LEU  17  -8.182   1.494   2.430
  121    HG   LEU  17           HG       LEU  17  -8.091   3.262   0.053
  122   1HD1  LEU  17          11HD      LEU  17  -5.949   2.989   0.980
  123   2HD1  LEU  17          12HD      LEU  17  -6.033   1.965  -0.455
  124   3HD1  LEU  17          13HD      LEU  17  -6.167   1.252   1.151
  125   1HD2  LEU  17          21HD      LEU  17  -8.140   1.158  -1.271
  126   2HD2  LEU  17          22HD      LEU  17  -9.629   1.462  -0.383
  127   3HD2  LEU  17          23HD      LEU  17  -8.479   0.266   0.219
  128    H    GLY  18           H        GLY  18  -9.451   4.896   2.915
  129   1HA   GLY  18          1HA       GLY  18  -9.886   6.025   4.846
  130   2HA   GLY  18          2HA       GLY  18 -10.776   4.623   5.437
  131    H    ILE  19           H        ILE  19  -7.491   4.426   4.200
  132    HA   ILE  19           HA       ILE  19  -6.715   3.571   6.917
  133    HB   ILE  19           HB       ILE  19  -4.944   2.243   5.989
  134   1HG1  ILE  19          11HG      ILE  19  -5.709   3.317   3.260
  135   2HG1  ILE  19          12HG      ILE  19  -4.311   3.825   4.206
  136   1HG2  ILE  19          21HG      ILE  19  -7.182   1.255   5.957
  137   2HG2  ILE  19          22HG      ILE  19  -6.205   0.655   4.613
  138   3HG2  ILE  19          23HG      ILE  19  -7.439   1.885   4.335
  139   1HD1  ILE  19          11HD      ILE  19  -3.370   1.589   4.078
  140   2HD1  ILE  19          12HD      ILE  19  -3.689   2.215   2.461
  141   3HD1  ILE  19          13HD      ILE  19  -4.781   1.032   3.180
  142    H    SER  20           H        SER  20  -4.093   3.682   6.972
  143    HA   SER  20           HA       SER  20  -3.274   6.458   6.468
  144   1HB   SER  20          1HB       SER  20  -2.954   4.907   9.055
  145   2HB   SER  20          2HB       SER  20  -2.436   6.561   8.774
  146    HG   SER  20           HG       SER  20  -4.778   6.854   8.220
  147    H    ILE  21           H        ILE  21  -0.970   6.657   6.387
  148    HA   ILE  21           HA       ILE  21   0.485   4.144   5.925
  149    HB   ILE  21           HB       ILE  21   1.671   5.267   4.070
  150   1HG1  ILE  21          11HG      ILE  21   0.185   7.312   3.086
  151   2HG1  ILE  21          12HG      ILE  21  -0.154   7.507   4.778
  152   1HG2  ILE  21          21HG      ILE  21  -1.302   5.061   3.681
  153   2HG2  ILE  21          22HG      ILE  21  -0.122   3.760   3.533
  154   3HG2  ILE  21          23HG      ILE  21  -0.107   5.100   2.386
  155   1HD1  ILE  21          11HD      ILE  21   1.687   8.948   4.056
  156   2HD1  ILE  21          12HD      ILE  21   2.613   7.567   3.566
  157   3HD1  ILE  21          13HD      ILE  21   2.227   7.798   5.261
  158    H    ILE  22           H        ILE  22   2.863   4.494   6.085
  159    HA   ILE  22           HA       ILE  22   3.503   6.922   7.483
  160    HB   ILE  22           HB       ILE  22   3.215   5.315   9.241
  161   1HG1  ILE  22          11HG      ILE  22   6.160   5.886   8.834
  162   2HG1  ILE  22          12HG      ILE  22   4.991   7.019   9.486
  163   1HG2  ILE  22          21HG      ILE  22   4.629   3.316   9.473
  164   2HG2  ILE  22          22HG      ILE  22   5.308   3.652   7.876
  165   3HG2  ILE  22          23HG      ILE  22   3.593   3.259   8.040
  166   1HD1  ILE  22          11HD      ILE  22   5.814   4.412  10.739
  167   2HD1  ILE  22          12HD      ILE  22   4.657   5.562  11.417
  168   3HD1  ILE  22          13HD      ILE  22   6.350   6.014  11.232
  169    H    GLY  23           H        GLY  23   5.339   7.879   6.860
  170   1HA   GLY  23          1HA       GLY  23   6.691   6.647   4.626
  171   2HA   GLY  23          2HA       GLY  23   6.829   8.328   5.141
  172    H    MET  24           H        MET  24   8.223   5.309   5.119
  173    HA   MET  24           HA       MET  24  10.309   6.171   7.048
  174   1HB   MET  24          1HB       MET  24   9.434   3.332   6.442
  175   2HB   MET  24          2HB       MET  24  10.686   3.809   7.572
  176   1HG   MET  24          1HG       MET  24   7.738   4.392   7.848
  177   2HG   MET  24          2HG       MET  24   8.623   3.140   8.707
  178   1HE   MET  24          1HE       MET  24  11.324   4.533   9.531
  179   2HE   MET  24          2HE       MET  24  10.344   3.597  10.660
  180   3HE   MET  24          3HE       MET  24  10.914   5.207  11.110
  181    H    GLY  25           H        GLY  25  12.365   4.898   6.528
  182   1HA   GLY  25          1HA       GLY  25  12.583   4.889   3.592
  183   2HA   GLY  25          2HA       GLY  25  13.815   5.600   4.617
  184    H    VAL  26           H        VAL  26  12.567   2.770   3.254
  185    HA   VAL  26           HA       VAL  26  14.574   1.210   4.669
  186    HB   VAL  26           HB       VAL  26  12.345   0.177   4.649
  187   1HG1  VAL  26          11HG      VAL  26  11.463   1.042   2.582
  188   2HG1  VAL  26          12HG      VAL  26  11.305  -0.714   2.642
  189   3HG1  VAL  26          13HG      VAL  26  12.569   0.028   1.658
  190   1HG2  VAL  26          21HG      VAL  26  14.318  -1.374   2.998
  191   2HG2  VAL  26          22HG      VAL  26  12.931  -2.065   3.836
  192   3HG2  VAL  26          23HG      VAL  26  14.236  -1.316   4.759
  193    H    GLY  27           H        GLY  27  16.436   1.710   3.851
  194   1HA   GLY  27          1HA       GLY  27  16.732   1.689   0.958
  195   2HA   GLY  27          2HA       GLY  27  17.752   2.591   2.065
  196    H    ALA  28           H        ALA  28  19.635   1.771   2.501
  197    HA   ALA  28           HA       ALA  28  20.509  -0.499   1.050
  198   1HB   ALA  28          1HB       ALA  28  22.013   1.195   3.024
  199   2HB   ALA  28          2HB       ALA  28  21.861   1.515   1.296
  200   3HB   ALA  28          3HB       ALA  28  22.717   0.080   1.858
  201    H    ASP  29           H        ASP  29  19.489  -0.064   4.315
  202    HA   ASP  29           HA       ASP  29  20.990  -2.160   5.498
  203   1HB   ASP  29          1HB       ASP  29  19.898  -0.389   6.836
  204   2HB   ASP  29          2HB       ASP  29  18.325  -1.045   6.384
  205    H    ALA  30           H        ALA  30  18.069  -2.118   3.702
  206    HA   ALA  30           HA       ALA  30  17.739  -4.995   4.183
  207   1HB   ALA  30          1HB       ALA  30  15.862  -3.028   2.892
  208   2HB   ALA  30          2HB       ALA  30  15.731  -3.665   4.532
  209   3HB   ALA  30          3HB       ALA  30  15.525  -4.738   3.144
  210    H    GLY  31           H        GLY  31  18.751  -2.685   1.876
  211   1HA   GLY  31          1HA       GLY  31  19.984  -3.217  -0.092
  212   2HA   GLY  31          2HA       GLY  31  19.271  -4.834  -0.005
  213    H    LEU  32           H        LEU  32  17.295  -2.019   0.310
  214    HA   LEU  32           HA       LEU  32  16.057  -2.923  -2.171
  215   1HB   LEU  32          1HB       LEU  32  14.758  -1.539   0.144
  216   2HB   LEU  32          2HB       LEU  32  13.942  -2.162  -1.290
  217    HG   LEU  32           HG       LEU  32  15.173  -3.696   0.981
  218   1HD1  LEU  32          11HD      LEU  32  12.958  -2.917   1.403
  219   2HD1  LEU  32          12HD      LEU  32  12.948  -4.668   1.195
  220   3HD1  LEU  32          13HD      LEU  32  12.385  -3.620  -0.109
  221   1HD2  LEU  32          21HD      LEU  32  15.856  -4.876  -0.987
  222   2HD2  LEU  32          22HD      LEU  32  14.229  -4.790  -1.675
  223   3HD2  LEU  32          23HD      LEU  32  14.534  -5.776  -0.240
  224    H    GLU  33           H        GLU  33  16.113   0.091  -0.206
  225    HA   GLU  33           HA       GLU  33  16.244   2.262  -0.759
  226   1HB   GLU  33          1HB       GLU  33  17.695   1.221  -3.191
  227   2HB   GLU  33          2HB       GLU  33  17.596   2.926  -2.759
  228   1HG   GLU  33          1HG       GLU  33  18.726   2.399  -0.616
  229   2HG   GLU  33          2HG       GLU  33  18.894   0.734  -1.153
  230    H    LYS  34           H        LYS  34  13.980   0.908  -1.303
  231    HA   LYS  34           HA       LYS  34  12.904   2.534  -3.488
  232   1HB   LYS  34          1HB       LYS  34  10.949   0.943  -3.526
  233   2HB   LYS  34          2HB       LYS  34  12.461   0.201  -3.972
  234   1HG   LYS  34          1HG       LYS  34  12.615  -0.952  -1.902
  235   2HG   LYS  34          2HG       LYS  34  11.317   0.011  -1.210
  236   1HD   LYS  34          1HD       LYS  34  10.679  -2.339  -1.892
  237   2HD   LYS  34          2HD       LYS  34   9.669  -1.046  -2.529
  238   1HE   LYS  34          1HE       LYS  34  10.135  -2.734  -4.235
  239   2HE   LYS  34          2HE       LYS  34  10.822  -1.165  -4.649
  240   1HZ   LYS  34          1HZ       LYS  34  13.012  -2.004  -3.970
  241   2HZ   LYS  34          2HZ       LYS  34  12.339  -2.934  -5.158
  242   3HZ   LYS  34          3HZ       LYS  34  12.350  -3.506  -3.591
  243    H    LEU  35           H        LEU  35  10.250   2.334  -2.659
  244    HA   LEU  35           HA       LEU  35   9.912   4.447  -0.927
  245   1HB   LEU  35          1HB       LEU  35   7.591   3.775  -0.946
  246   2HB   LEU  35          2HB       LEU  35   8.267   3.600  -2.553
  247    HG   LEU  35           HG       LEU  35   8.664   1.134  -1.380
  248   1HD1  LEU  35          11HD      LEU  35   5.953   2.117  -0.593
  249   2HD1  LEU  35          12HD      LEU  35   7.267   1.548   0.448
  250   3HD1  LEU  35          13HD      LEU  35   6.455   0.433  -0.632
  251   1HD2  LEU  35          21HD      LEU  35   8.102   1.476  -3.669
  252   2HD2  LEU  35          22HD      LEU  35   6.451   1.975  -3.243
  253   3HD2  LEU  35          23HD      LEU  35   7.015   0.325  -2.933
  254    H    GLY  36           H        GLY  36   9.526   4.502   1.300
  255   1HA   GLY  36          1HA       GLY  36   9.635   1.911   2.682
  256   2HA   GLY  36          2HA       GLY  36  10.234   3.424   3.371
  257    H    ILE  37           H        ILE  37   7.313   3.026   1.530
  258    HA   ILE  37           HA       ILE  37   5.865   4.280   3.678
  259    HB   ILE  37           HB       ILE  37   4.789   3.366   1.005
  260   1HG1  ILE  37          11HG      ILE  37   6.650   5.061   0.857
  261   2HG1  ILE  37          12HG      ILE  37   5.118   5.628   0.171
  262   1HG2  ILE  37          21HG      ILE  37   3.692   5.273   3.079
  263   2HG2  ILE  37          22HG      ILE  37   3.071   3.676   2.714
  264   3HG2  ILE  37          23HG      ILE  37   2.956   4.962   1.505
  265   1HD1  ILE  37          11HD      ILE  37   4.791   6.827   2.344
  266   2HD1  ILE  37          12HD      ILE  37   6.126   7.390   1.353
  267   3HD1  ILE  37          13HD      ILE  37   6.447   6.356   2.758
  268    H    PHE  38           H        PHE  38   5.327   3.031   5.219
  269    HA   PHE  38           HA       PHE  38   4.291   0.351   4.648
  270   1HB   PHE  38          1HB       PHE  38   5.180   1.632   7.226
  271   2HB   PHE  38          2HB       PHE  38   4.460   0.030   7.137
  272    HD1  PHE  38           HD1      PHE  38   7.464   1.996   6.645
  273    HD2  PHE  38           HD2      PHE  38   5.678  -1.808   6.012
  274    HE1  PHE  38           HE1      PHE  38   9.689   1.027   6.233
  275    HE2  PHE  38           HE2      PHE  38   7.897  -2.787   5.599
  276    HZ   PHE  38           HZ       PHE  38   9.908  -1.370   5.711
  277    H    VAL  39           H        VAL  39   2.378  -0.285   5.866
  278    HA   VAL  39           HA       VAL  39   0.405   1.797   5.723
  279    HB   VAL  39           HB       VAL  39   0.158  -1.081   6.690
  280   1HG1  VAL  39          11HG      VAL  39  -1.667   0.318   7.508
  281   2HG1  VAL  39          12HG      VAL  39  -2.256  -0.798   6.274
  282   3HG1  VAL  39          13HG      VAL  39  -1.976   0.898   5.872
  283   1HG2  VAL  39          21HG      VAL  39   0.903  -0.962   4.359
  284   2HG2  VAL  39          22HG      VAL  39  -0.433   0.106   3.975
  285   3HG2  VAL  39          23HG      VAL  39  -0.753  -1.562   4.453
  286    H    LYS  40           H        LYS  40  -0.271   2.982   7.419
  287    HA   LYS  40           HA       LYS  40   1.152   2.508   9.896
  288   1HB   LYS  40          1HB       LYS  40   1.288   4.770   9.046
  289   2HB   LYS  40          2HB       LYS  40  -0.449   4.889   8.973
  290   1HG   LYS  40          1HG       LYS  40   0.267   6.215  10.805
  291   2HG   LYS  40          2HG       LYS  40  -0.504   4.793  11.476
  292   1HD   LYS  40          1HD       LYS  40   2.506   5.154  11.249
  293   2HD   LYS  40          2HD       LYS  40   1.572   5.565  12.680
  294   1HE   LYS  40          1HE       LYS  40   0.809   3.115  12.655
  295   2HE   LYS  40          2HE       LYS  40   2.075   2.893  11.453
  296   1HZ   LYS  40          1HZ       LYS  40   2.596   3.948  14.166
  297   2HZ   LYS  40          2HZ       LYS  40   3.742   3.500  13.001
  298   3HZ   LYS  40          3HZ       LYS  40   2.775   2.343  13.716
  299    H    THR  41           H        THR  41  -2.135   2.724   8.671
  300    HA   THR  41           HA       THR  41  -3.095   1.171  10.892
  301    HB   THR  41           HB       THR  41  -4.566   3.637  10.330
  302    HG1  THR  41           HG1      THR  41  -2.185   3.409  11.878
  303   1HG2  THR  41          21HG      THR  41  -4.231   1.996  12.841
  304   2HG2  THR  41          22HG      THR  41  -5.612   2.000  11.737
  305   3HG2  THR  41          23HG      THR  41  -5.259   3.426  12.715
  306    H    VAL  42           H        VAL  42  -5.319   0.581  10.387
  307    HA   VAL  42           HA       VAL  42  -6.015   1.086   7.618
  308    HB   VAL  42           HB       VAL  42  -6.813  -1.379   9.238
  309   1HG1  VAL  42          11HG      VAL  42  -8.314  -0.933   7.419
  310   2HG1  VAL  42          12HG      VAL  42  -7.356  -2.354   7.004
  311   3HG1  VAL  42          13HG      VAL  42  -6.964  -0.777   6.306
  312   1HG2  VAL  42          21HG      VAL  42  -4.387  -1.423   8.960
  313   2HG2  VAL  42          22HG      VAL  42  -4.571  -1.179   7.223
  314   3HG2  VAL  42          23HG      VAL  42  -5.146  -2.669   7.968
  315    H    THR  43           H        THR  43  -8.519   0.918   7.475
  316    HA   THR  43           HA       THR  43  -9.730   2.694   9.322
  317    HB   THR  43           HB       THR  43 -10.357   2.607   6.945
  318    HG1  THR  43           HG1      THR  43 -12.129   3.370   7.740
  319   1HG2  THR  43          21HG      THR  43 -11.639   0.720   6.040
  320   2HG2  THR  43          22HG      THR  43 -11.451  -0.137   7.577
  321   3HG2  THR  43          23HG      THR  43 -10.039   0.210   6.585
  322    H    GLU  44           H        GLU  44 -12.091   1.899  10.037
  323    HA   GLU  44           HA       GLU  44 -11.859   0.339  12.318
  324   1HB   GLU  44          1HB       GLU  44 -13.708   1.863  11.974
  325   2HB   GLU  44          2HB       GLU  44 -14.309   0.871  10.651
  326   1HG   GLU  44          1HG       GLU  44 -15.653   0.443  12.586
  327   2HG   GLU  44          2HG       GLU  44 -14.623  -0.956  12.234
  328    H    GLY  45           H        GLY  45 -13.650  -0.753   9.416
  329   1HA   GLY  45          1HA       GLY  45 -12.333  -3.118   9.136
  330   2HA   GLY  45          2HA       GLY  45 -13.539  -3.426  10.385
  331    H    GLY  46           H        GLY  46 -13.591  -1.530   7.355
  332   1HA   GLY  46          1HA       GLY  46 -15.897  -3.015   6.556
  333   2HA   GLY  46          2HA       GLY  46 -15.130  -1.694   5.668
  334    H    ALA  47           H        ALA  47 -14.913  -2.739   3.806
  335    HA   ALA  47           HA       ALA  47 -14.306  -5.441   3.464
  336   1HB   ALA  47          1HB       ALA  47 -14.092  -5.019   1.120
  337   2HB   ALA  47          2HB       ALA  47 -13.912  -3.289   1.412
  338   3HB   ALA  47          3HB       ALA  47 -15.433  -4.091   1.782
  339    H    ALA  48           H        ALA  48 -12.066  -3.052   4.276
  340    HA   ALA  48           HA       ALA  48  -9.780  -4.298   2.949
  341   1HB   ALA  48          1HB       ALA  48  -8.402  -2.728   4.273
  342   2HB   ALA  48          2HB       ALA  48  -9.849  -2.187   5.126
  343   3HB   ALA  48          3HB       ALA  48  -9.681  -1.899   3.394
  344    H    GLN  49           H        GLN  49 -10.511  -3.745   6.426
  345    HA   GLN  49           HA       GLN  49  -8.951  -5.979   7.122
  346   1HB   GLN  49          1HB       GLN  49 -10.796  -4.225   8.698
  347   2HB   GLN  49          2HB       GLN  49  -9.964  -5.586   9.461
  348   1HG   GLN  49          1HG       GLN  49  -7.817  -4.583   8.567
  349   2HG   GLN  49          2HG       GLN  49  -8.792  -3.195   8.103
  350   1HE2  GLN  49          21HE      GLN  49 -10.452  -3.264  10.519
  351   2HE2  GLN  49          22HE      GLN  49  -9.422  -2.707  11.753
  352    H    ARG  50           H        ARG  50 -12.152  -5.800   6.020
  353    HA   ARG  50           HA       ARG  50 -12.908  -8.320   7.144
  354   1HB   ARG  50          1HB       ARG  50 -14.117  -6.673   4.949
  355   2HB   ARG  50          2HB       ARG  50 -14.742  -8.255   5.377
  356   1HG   ARG  50          1HG       ARG  50 -14.478  -5.938   7.234
  357   2HG   ARG  50          2HG       ARG  50 -15.988  -6.378   6.408
  358   1HD   ARG  50          1HD       ARG  50 -15.848  -8.580   7.574
  359   2HD   ARG  50          2HD       ARG  50 -14.424  -7.984   8.426
  360    HE   ARG  50           HE       ARG  50 -16.880  -6.459   8.618
  361   1HH1  ARG  50          11HH      ARG  50 -14.541  -8.629  10.176
  362   2HH1  ARG  50          12HH      ARG  50 -15.174  -8.357  11.739
  363   1HH2  ARG  50          21HH      ARG  50 -17.732  -6.147  10.784
  364   2HH2  ARG  50          22HH      ARG  50 -16.995  -6.952  12.088
  365    H    ASP  51           H        ASP  51 -11.251  -7.153   4.301
  366    HA   ASP  51           HA       ASP  51 -11.451  -9.347   2.624
  367   1HB   ASP  51          1HB       ASP  51 -10.357  -7.308   1.927
  368   2HB   ASP  51          2HB       ASP  51  -9.046  -7.574   3.070
  369    H    GLY  52           H        GLY  52  -8.832  -8.805   4.961
  370   1HA   GLY  52          1HA       GLY  52  -8.243 -10.508   6.534
  371   2HA   GLY  52          2HA       GLY  52  -8.843 -11.703   5.401
  372    H    ARG  53           H        ARG  53  -7.178 -10.000   3.284
  373    HA   ARG  53           HA       ARG  53  -4.688 -11.473   3.810
  374   1HB   ARG  53          1HB       ARG  53  -5.930 -11.510   1.568
  375   2HB   ARG  53          2HB       ARG  53  -5.408  -9.853   1.378
  376   1HG   ARG  53          1HG       ARG  53  -3.465 -12.120   1.772
  377   2HG   ARG  53          2HG       ARG  53  -4.078 -11.681   0.189
  378   1HD   ARG  53          1HD       ARG  53  -2.190 -10.460   0.148
  379   2HD   ARG  53          2HD       ARG  53  -3.180  -9.277   0.989
  380    HE   ARG  53           HE       ARG  53  -1.510 -11.146   2.524
  381   1HH1  ARG  53          11HH      ARG  53  -2.091  -7.812   1.454
  382   2HH1  ARG  53          12HH      ARG  53  -1.009  -7.154   2.624
  383   1HH2  ARG  53          21HH      ARG  53   0.105 -10.154   3.990
  384   2HH2  ARG  53          22HH      ARG  53   0.291  -8.454   3.953
  385    H    ILE  54           H        ILE  54  -5.672  -8.204   2.850
  386    HA   ILE  54           HA       ILE  54  -3.072  -7.171   3.294
  387    HB   ILE  54           HB       ILE  54  -4.887  -6.095   1.813
  388   1HG1  ILE  54          11HG      ILE  54  -3.545  -4.208   3.775
  389   2HG1  ILE  54          12HG      ILE  54  -2.685  -5.015   2.472
  390   1HG2  ILE  54          21HG      ILE  54  -6.726  -6.070   3.399
  391   2HG2  ILE  54          22HG      ILE  54  -6.320  -4.388   3.009
  392   3HG2  ILE  54          23HG      ILE  54  -5.757  -5.122   4.522
  393   1HD1  ILE  54          11HD      ILE  54  -3.265  -2.716   1.911
  394   2HD1  ILE  54          12HD      ILE  54  -4.986  -3.098   2.099
  395   3HD1  ILE  54          13HD      ILE  54  -4.029  -3.868   0.831
  396    H    GLN  55           H        GLN  55  -2.215  -5.977   4.976
  397    HA   GLN  55           HA       GLN  55  -3.803  -5.813   7.368
  398   1HB   GLN  55          1HB       GLN  55  -1.760  -6.745   8.651
  399   2HB   GLN  55          2HB       GLN  55  -2.802  -7.880   7.799
  400   1HG   GLN  55          1HG       GLN  55  -1.267  -8.007   5.974
  401   2HG   GLN  55          2HG       GLN  55  -0.283  -6.725   6.662
  402   1HE2  GLN  55          21HE      GLN  55   1.431  -8.016   6.553
  403   2HE2  GLN  55          22HE      GLN  55   1.750  -9.301   7.677
  404    H    VAL  56           H        VAL  56  -2.378  -4.710   9.161
  405    HA   VAL  56           HA       VAL  56  -1.576  -2.146   8.121
  406    HB   VAL  56           HB       VAL  56  -2.801  -2.666  10.335
  407   1HG1  VAL  56          11HG      VAL  56   0.014  -3.118  11.307
  408   2HG1  VAL  56          12HG      VAL  56  -1.272  -4.301  11.248
  409   3HG1  VAL  56          13HG      VAL  56  -1.401  -2.916  12.341
  410   1HG2  VAL  56          21HG      VAL  56  -2.159  -0.417   9.750
  411   2HG2  VAL  56          22HG      VAL  56  -0.513  -0.710  10.308
  412   3HG2  VAL  56          23HG      VAL  56  -1.846  -0.691  11.461
  413    H    ASN  57           H        ASN  57   0.008  -5.002   8.522
  414    HA   ASN  57           HA       ASN  57   2.546  -3.834   9.325
  415   1HB   ASN  57          1HB       ASN  57   1.780  -5.963  10.357
  416   2HB   ASN  57          2HB       ASN  57   1.826  -6.727   8.774
  417   1HD2  ASN  57          21HD      ASN  57   3.711  -5.439  11.402
  418   2HD2  ASN  57          22HD      ASN  57   5.194  -6.197  10.936
  419    H    ASP  58           H        ASP  58   0.897  -4.109   6.537
  420    HA   ASP  58           HA       ASP  58   2.986  -5.147   4.851
  421   1HB   ASP  58          1HB       ASP  58   0.327  -3.925   4.158
  422   2HB   ASP  58          2HB       ASP  58   1.487  -4.534   2.988
  423    H    GLN  59           H        GLN  59   3.325  -3.883   2.779
  424    HA   GLN  59           HA       GLN  59   3.835  -1.062   3.302
  425   1HB   GLN  59          1HB       GLN  59   5.967  -2.171   3.530
  426   2HB   GLN  59          2HB       GLN  59   5.657  -3.132   2.086
  427   1HG   GLN  59          1HG       GLN  59   5.864  -1.214   0.688
  428   2HG   GLN  59          2HG       GLN  59   5.946  -0.141   2.078
  429   1HE2  GLN  59          21HE      GLN  59   7.825   0.027   3.188
  430   2HE2  GLN  59          22HE      GLN  59   9.332  -0.586   2.561
  431    H    ILE  60           H        ILE  60   2.993   0.187   1.748
  432    HA   ILE  60           HA       ILE  60   1.561  -1.059  -0.421
  433    HB   ILE  60           HB       ILE  60   2.046   1.896   0.061
  434   1HG1  ILE  60          11HG      ILE  60   0.832   0.958   1.987
  435   2HG1  ILE  60          12HG      ILE  60  -0.231   1.954   0.993
  436   1HG2  ILE  60          21HG      ILE  60   1.408   1.184  -2.223
  437   2HG2  ILE  60          22HG      ILE  60   0.239   2.271  -1.474
  438   3HG2  ILE  60          23HG      ILE  60  -0.083   0.534  -1.552
  439   1HD1  ILE  60          11HD      ILE  60  -0.133  -1.046   1.016
  440   2HD1  ILE  60          12HD      ILE  60  -1.182  -0.059  -0.002
  441   3HD1  ILE  60          13HD      ILE  60  -1.381  -0.037   1.751
  442    H    VAL  61           H        VAL  61   2.839  -1.779  -2.071
  443    HA   VAL  61           HA       VAL  61   5.263  -0.334  -2.710
  444    HB   VAL  61           HB       VAL  61   4.149  -2.929  -3.794
  445   1HG1  VAL  61          11HG      VAL  61   5.603  -1.933  -5.439
  446   2HG1  VAL  61          12HG      VAL  61   6.271  -3.396  -4.712
  447   3HG1  VAL  61          13HG      VAL  61   6.902  -1.807  -4.229
  448   1HG2  VAL  61          21HG      VAL  61   6.333  -2.427  -1.789
  449   2HG2  VAL  61          22HG      VAL  61   5.872  -4.001  -2.441
  450   3HG2  VAL  61          23HG      VAL  61   4.727  -3.082  -1.466
  451    H    GLU  62           H        GLU  62   2.332  -1.309  -4.362
  452    HA   GLU  62           HA       GLU  62   2.451   1.070  -6.042
  453   1HB   GLU  62          1HB       GLU  62   3.666  -0.610  -7.341
  454   2HB   GLU  62          2HB       GLU  62   2.330  -1.730  -7.171
  455   1HG   GLU  62          1HG       GLU  62   0.889  -0.104  -8.359
  456   2HG   GLU  62          2HG       GLU  62   2.324   0.878  -8.639
  457    H    VAL  63           H        VAL  63   0.411   1.837  -5.985
  458    HA   VAL  63           HA       VAL  63  -1.734  -0.115  -5.727
  459    HB   VAL  63           HB       VAL  63  -1.416   2.560  -4.381
  460   1HG1  VAL  63          11HG      VAL  63  -4.096   1.315  -5.070
  461   2HG1  VAL  63          12HG      VAL  63  -3.466   2.833  -5.728
  462   3HG1  VAL  63          13HG      VAL  63  -3.836   2.702  -4.001
  463   1HG2  VAL  63          21HG      VAL  63  -1.037   0.422  -3.274
  464   2HG2  VAL  63          22HG      VAL  63  -2.706  -0.031  -3.605
  465   3HG2  VAL  63          23HG      VAL  63  -2.358   1.342  -2.552
  466    H    ASP  64           H        ASP  64  -3.031  -0.303  -7.231
  467    HA   ASP  64           HA       ASP  64  -4.425   0.050  -8.921
  468   1HB   ASP  64          1HB       ASP  64  -5.038   2.187  -7.801
  469   2HB   ASP  64          2HB       ASP  64  -3.804   3.009  -8.742
  470    H    GLY  65           H        GLY  65  -1.344   0.580  -9.061
  471   1HA   GLY  65          1HA       GLY  65   0.075   0.018 -10.900
  472   2HA   GLY  65          2HA       GLY  65  -1.202   0.577 -11.985
  473    H    ILE  66           H        ILE  66  -0.801   2.644  -9.347
  474    HA   ILE  66           HA       ILE  66   0.075   4.796 -10.986
  475    HB   ILE  66           HB       ILE  66  -1.408   4.810  -8.760
  476   1HG1  ILE  66          11HG      ILE  66   0.638   6.961  -9.328
  477   2HG1  ILE  66          12HG      ILE  66  -0.843   6.724 -10.255
  478   1HG2  ILE  66          21HG      ILE  66   1.375   5.247  -7.679
  479   2HG2  ILE  66          22HG      ILE  66   0.314   3.889  -7.300
  480   3HG2  ILE  66          23HG      ILE  66  -0.133   5.529  -6.805
  481   1HD1  ILE  66          11HD      ILE  66  -0.618   7.436  -7.369
  482   2HD1  ILE  66          12HD      ILE  66  -2.138   7.153  -8.221
  483   3HD1  ILE  66          13HD      ILE  66  -1.108   8.524  -8.670
  484    H    SER  67           H        SER  67   1.715   2.465  -9.208
  485    HA   SER  67           HA       SER  67   3.802   2.123  -8.412
  486   1HB   SER  67          1HB       SER  67   5.643   2.642 -10.057
  487   2HB   SER  67          2HB       SER  67   4.263   1.785 -10.749
  488    HG   SER  67           HG       SER  67   4.004   4.488 -10.835
  489    H    LEU  68           H        LEU  68   3.876   3.147  -6.543
  490    HA   LEU  68           HA       LEU  68   4.685   5.949  -6.529
  491   1HB   LEU  68          1HB       LEU  68   3.899   5.918  -4.208
  492   2HB   LEU  68          2HB       LEU  68   2.659   5.430  -5.344
  493    HG   LEU  68           HG       LEU  68   3.890   3.081  -4.562
  494   1HD1  LEU  68          11HD      LEU  68   4.958   4.224  -2.747
  495   2HD1  LEU  68          12HD      LEU  68   3.745   3.094  -2.133
  496   3HD1  LEU  68          13HD      LEU  68   3.408   4.833  -2.169
  497   1HD2  LEU  68          21HD      LEU  68   1.611   3.395  -5.127
  498   2HD2  LEU  68          22HD      LEU  68   1.315   4.331  -3.649
  499   3HD2  LEU  68          23HD      LEU  68   1.744   2.609  -3.558
  500    H    VAL  69           H        VAL  69   6.213   3.432  -6.846
  501    HA   VAL  69           HA       VAL  69   7.977   3.024  -4.708
  502    HB   VAL  69           HB       VAL  69   8.676   2.665  -7.634
  503   1HG1  VAL  69          11HG      VAL  69   9.791   1.347  -5.171
  504   2HG1  VAL  69          12HG      VAL  69  10.613   2.542  -6.171
  505   3HG1  VAL  69          13HG      VAL  69  10.235   0.947  -6.828
  506   1HG2  VAL  69          21HG      VAL  69   7.343   0.707  -5.745
  507   2HG2  VAL  69          22HG      VAL  69   7.921   0.328  -7.369
  508   3HG2  VAL  69          23HG      VAL  69   6.605   1.477  -7.149
  509    H    GLY  70           H        GLY  70   8.774   4.808  -3.781
  510   1HA   GLY  70          1HA       GLY  70  10.948   5.942  -3.673
  511   2HA   GLY  70          2HA       GLY  70  10.721   6.352  -5.367
  512    H    VAL  71           H        VAL  71   7.800   6.601  -3.673
  513    HA   VAL  71           HA       VAL  71   8.086   9.488  -3.721
  514    HB   VAL  71           HB       VAL  71   5.713   9.652  -3.626
  515   1HG1  VAL  71          11HG      VAL  71   5.022   8.416  -5.603
  516   2HG1  VAL  71          12HG      VAL  71   6.456   7.409  -5.471
  517   3HG1  VAL  71          13HG      VAL  71   6.624   9.135  -5.807
  518   1HG2  VAL  71          21HG      VAL  71   5.276   7.918  -1.944
  519   2HG2  VAL  71          22HG      VAL  71   5.618   6.668  -3.134
  520   3HG2  VAL  71          23HG      VAL  71   4.222   7.733  -3.342
  521    H    THR  72           H        THR  72   6.706  10.622  -1.964
  522    HA   THR  72           HA       THR  72   7.644   9.712   0.640
  523    HB   THR  72           HB       THR  72   6.688  12.023   1.249
  524    HG1  THR  72           HG1      THR  72   7.160  12.718  -1.431
  525   1HG2  THR  72          21HG      THR  72   9.081  11.814  -0.617
  526   2HG2  THR  72          22HG      THR  72   9.112  11.531   1.121
  527   3HG2  THR  72          23HG      THR  72   8.774  13.143   0.499
  528    H    GLN  73           H        GLN  73   6.156  10.381   2.374
  529    HA   GLN  73           HA       GLN  73   3.974   8.704   2.334
  530   1HB   GLN  73          1HB       GLN  73   3.573   9.393   4.576
  531   2HB   GLN  73          2HB       GLN  73   5.290   9.496   4.312
  532   1HG   GLN  73          1HG       GLN  73   3.350  11.726   4.357
  533   2HG   GLN  73          2HG       GLN  73   4.464  11.326   5.667
  534   1HE2  GLN  73          21HE      GLN  73   6.795  11.405   5.029
  535   2HE2  GLN  73          22HE      GLN  73   7.250  12.634   3.941
  536    H    ASN  74           H        ASN  74   4.187  12.096   1.613
  537    HA   ASN  74           HA       ASN  74   1.411  12.529   1.752
  538   1HB   ASN  74          1HB       ASN  74   1.832  14.716   0.677
  539   2HB   ASN  74          2HB       ASN  74   2.917  14.427   2.026
  540   1HD2  ASN  74          21HD      ASN  74   5.093  14.262   1.628
  541   2HD2  ASN  74          22HD      ASN  74   5.794  14.593   0.095
  542    H    PHE  75           H        PHE  75   3.550  11.631  -0.869
  543    HA   PHE  75           HA       PHE  75   1.552  11.898  -2.876
  544   1HB   PHE  75          1HB       PHE  75   4.014  11.759  -3.387
  545   2HB   PHE  75          2HB       PHE  75   3.943  10.069  -2.899
  546    HD1  PHE  75           HD1      PHE  75   3.325  12.429  -5.566
  547    HD2  PHE  75           HD2      PHE  75   2.570   8.412  -4.303
  548    HE1  PHE  75           HE1      PHE  75   2.719  11.800  -7.867
  549    HE2  PHE  75           HE2      PHE  75   1.982   7.797  -6.587
  550    HZ   PHE  75           HZ       PHE  75   2.050   9.488  -8.381
  551    H    ALA  76           H        ALA  76   2.870   9.191  -0.984
  552    HA   ALA  76           HA       ALA  76   1.221   7.228  -2.064
  553   1HB   ALA  76          1HB       ALA  76   2.441   7.306   0.687
  554   2HB   ALA  76          2HB       ALA  76   3.232   6.760  -0.798
  555   3HB   ALA  76          3HB       ALA  76   1.841   5.877  -0.166
  556    H    ALA  77           H        ALA  77   0.744   9.262   0.828
  557    HA   ALA  77           HA       ALA  77  -1.638   8.193   1.753
  558   1HB   ALA  77          1HB       ALA  77  -0.788  11.085   1.725
  559   2HB   ALA  77          2HB       ALA  77  -0.390   9.902   2.972
  560   3HB   ALA  77          3HB       ALA  77  -2.063  10.408   2.730
  561    H    THR  78           H        THR  78  -1.075  10.627  -0.693
  562    HA   THR  78           HA       THR  78  -3.731  11.250  -1.334
  563    HB   THR  78           HB       THR  78  -1.211  11.300  -2.958
  564    HG1  THR  78           HG1      THR  78  -1.029  12.692  -1.253
  565   1HG2  THR  78          21HG      THR  78  -2.357  12.917  -4.443
  566   2HG2  THR  78          22HG      THR  78  -3.854  12.645  -3.540
  567   3HG2  THR  78          23HG      THR  78  -3.106  11.318  -4.441
  568    H    VAL  79           H        VAL  79  -1.550   8.781  -2.638
  569    HA   VAL  79           HA       VAL  79  -3.278   7.790  -4.624
  570    HB   VAL  79           HB       VAL  79  -1.210   6.198  -3.084
  571   1HG1  VAL  79          11HG      VAL  79  -2.773   4.810  -4.369
  572   2HG1  VAL  79          12HG      VAL  79  -1.164   4.751  -5.072
  573   3HG1  VAL  79          13HG      VAL  79  -2.419   5.730  -5.821
  574   1HG2  VAL  79          21HG      VAL  79   0.268   6.751  -5.016
  575   2HG2  VAL  79          22HG      VAL  79  -0.157   8.111  -3.985
  576   3HG2  VAL  79          23HG      VAL  79  -0.964   7.917  -5.534
  577    H    LEU  80           H        LEU  80  -2.678   6.628  -1.325
  578    HA   LEU  80           HA       LEU  80  -4.725   4.651  -1.370
  579   1HB   LEU  80          1HB       LEU  80  -3.238   5.916   0.936
  580   2HB   LEU  80          2HB       LEU  80  -4.466   4.701   1.177
  581    HG   LEU  80           HG       LEU  80  -2.363   3.626   1.381
  582   1HD1  LEU  80          11HD      LEU  80  -3.437   2.957  -1.328
  583   2HD1  LEU  80          12HD      LEU  80  -3.983   2.325   0.225
  584   3HD1  LEU  80          13HD      LEU  80  -2.359   1.956  -0.354
  585   1HD2  LEU  80          21HD      LEU  80  -0.620   3.623  -0.299
  586   2HD2  LEU  80          22HD      LEU  80  -0.959   5.269   0.241
  587   3HD2  LEU  80          23HD      LEU  80  -1.575   4.703  -1.309
  588    H    ARG  81           H        ARG  81  -4.961   7.884  -1.278
  589    HA   ARG  81           HA       ARG  81  -7.563   7.915   0.048
  590   1HB   ARG  81          1HB       ARG  81  -6.123   9.605   0.875
  591   2HB   ARG  81          2HB       ARG  81  -5.611  10.071  -0.725
  592   1HG   ARG  81          1HG       ARG  81  -8.467  10.440  -0.290
  593   2HG   ARG  81          2HG       ARG  81  -7.451  11.382   0.806
  594   1HD   ARG  81          1HD       ARG  81  -7.019  11.297  -2.170
  595   2HD   ARG  81          2HD       ARG  81  -8.015  12.542  -1.375
  596    HE   ARG  81           HE       ARG  81  -5.377  12.271  -0.310
  597   1HH1  ARG  81          11HH      ARG  81  -7.327  13.812  -2.833
  598   2HH1  ARG  81          12HH      ARG  81  -6.198  15.046  -3.150
  599   1HH2  ARG  81          21HH      ARG  81  -3.793  13.975  -0.781
  600   2HH2  ARG  81          22HH      ARG  81  -4.167  15.157  -1.935
  601    H    ASN  82           H        ASN  82  -6.116   8.025  -3.058
  602    HA   ASN  82           HA       ASN  82  -8.523   9.005  -4.359
  603   1HB   ASN  82          1HB       ASN  82  -5.757   8.475  -5.258
  604   2HB   ASN  82          2HB       ASN  82  -7.029   8.307  -6.464
  605   1HD2  ASN  82          21HD      ASN  82  -5.480  10.474  -4.242
  606   2HD2  ASN  82          22HD      ASN  82  -6.061  11.922  -4.995
  607    H    THR  83           H        THR  83  -7.617   6.206  -3.121
  608    HA   THR  83           HA       THR  83  -8.158   4.238  -4.984
  609    HB   THR  83           HB       THR  83  -8.737   2.924  -2.884
  610    HG1  THR  83           HG1      THR  83  -9.164   5.206  -1.935
  611   1HG2  THR  83          21HG      THR  83  -6.493   2.953  -3.909
  612   2HG2  THR  83          22HG      THR  83  -6.377   2.944  -2.152
  613   3HG2  THR  83          23HG      THR  83  -6.118   4.442  -3.045
  614    H    LYS  84           H        LYS  84  -9.961   2.885  -5.171
  615    HA   LYS  84           HA       LYS  84 -12.545   3.862  -4.358
  616   1HB   LYS  84          1HB       LYS  84 -13.304   3.191  -6.790
  617   2HB   LYS  84          2HB       LYS  84 -12.625   4.777  -6.510
  618   1HG   LYS  84          1HG       LYS  84 -11.762   3.929  -8.556
  619   2HG   LYS  84          2HG       LYS  84 -10.454   3.919  -7.377
  620   1HD   LYS  84          1HD       LYS  84 -10.801   1.492  -7.072
  621   2HD   LYS  84          2HD       LYS  84 -12.087   1.542  -8.280
  622   1HE   LYS  84          1HE       LYS  84  -9.209   2.317  -8.787
  623   2HE   LYS  84          2HE       LYS  84  -9.912   0.754  -9.193
  624   1HZ   LYS  84          1HZ       LYS  84  -9.801   2.295 -11.089
  625   2HZ   LYS  84          2HZ       LYS  84 -10.812   3.369 -10.312
  626   3HZ   LYS  84          3HZ       LYS  84 -11.385   1.849 -10.757
  627    H    GLY  85           H        GLY  85 -13.919   1.806  -5.818
  628   1HA   GLY  85          1HA       GLY  85 -13.890  -0.327  -4.121
  629   2HA   GLY  85          2HA       GLY  85 -14.423  -0.421  -5.787
  630    H    ASN  86           H        ASN  86 -12.785  -0.988  -7.397
  631    HA   ASN  86           HA       ASN  86 -11.205  -3.196  -6.415
  632   1HB   ASN  86          1HB       ASN  86 -11.562  -2.125  -9.216
  633   2HB   ASN  86          2HB       ASN  86 -10.618  -3.557  -8.818
  634   1HD2  ASN  86          21HD      ASN  86 -11.678  -5.487  -8.575
  635   2HD2  ASN  86          22HD      ASN  86 -13.385  -5.663  -8.613
  636    H    VAL  87           H        VAL  87  -9.436  -2.695  -5.401
  637    HA   VAL  87           HA       VAL  87  -7.574  -0.773  -6.636
  638    HB   VAL  87           HB       VAL  87  -7.661  -1.592  -3.755
  639   1HG1  VAL  87          11HG      VAL  87  -5.532  -0.983  -4.508
  640   2HG1  VAL  87          12HG      VAL  87  -6.153   0.314  -3.461
  641   3HG1  VAL  87          13HG      VAL  87  -6.125   0.518  -5.231
  642   1HG2  VAL  87          21HG      VAL  87  -8.664   0.917  -5.057
  643   2HG2  VAL  87          22HG      VAL  87  -8.543   0.623  -3.311
  644   3HG2  VAL  87          23HG      VAL  87  -9.631  -0.355  -4.304
  645    H    ARG  88           H        ARG  88  -5.875  -1.759  -7.534
  646    HA   ARG  88           HA       ARG  88  -5.020  -4.347  -6.529
  647   1HB   ARG  88          1HB       ARG  88  -3.959  -2.647  -8.757
  648   2HB   ARG  88          2HB       ARG  88  -3.181  -4.125  -8.209
  649   1HG   ARG  88          1HG       ARG  88  -4.374  -4.913  -9.922
  650   2HG   ARG  88          2HG       ARG  88  -5.515  -5.147  -8.624
  651   1HD   ARG  88          1HD       ARG  88  -6.605  -4.187 -10.603
  652   2HD   ARG  88          2HD       ARG  88  -6.715  -3.129  -9.192
  653    HE   ARG  88           HE       ARG  88  -4.782  -1.916 -10.207
  654   1HH1  ARG  88          11HH      ARG  88  -7.109  -3.622 -12.268
  655   2HH1  ARG  88          12HH      ARG  88  -6.781  -2.662 -13.638
  656   1HH2  ARG  88          21HH      ARG  88  -4.420  -0.538 -12.108
  657   2HH2  ARG  88          22HH      ARG  88  -5.277  -0.876 -13.532
  658    H    PHE  89           H        PHE  89  -4.144  -4.231  -4.674
  659    HA   PHE  89           HA       PHE  89  -2.081  -2.254  -4.129
  660   1HB   PHE  89          1HB       PHE  89  -3.174  -4.511  -2.437
  661   2HB   PHE  89          2HB       PHE  89  -1.952  -3.358  -1.939
  662    HD1  PHE  89           HD1      PHE  89  -2.543  -1.125  -1.359
  663    HD2  PHE  89           HD2      PHE  89  -5.484  -3.912  -2.591
  664    HE1  PHE  89           HE1      PHE  89  -4.291   0.333  -0.460
  665    HE2  PHE  89           HE2      PHE  89  -7.241  -2.451  -1.701
  666    HZ   PHE  89           HZ       PHE  89  -6.643  -0.339  -0.623
  667    H    VAL  90           H        VAL  90  -0.310  -2.853  -5.280
  668    HA   VAL  90           HA       VAL  90   0.402  -5.661  -5.196
  669    HB   VAL  90           HB       VAL  90   1.887  -3.406  -6.571
  670   1HG1  VAL  90          11HG      VAL  90   3.010  -5.196  -7.835
  671   2HG1  VAL  90          12HG      VAL  90   2.148  -6.394  -6.872
  672   3HG1  VAL  90          13HG      VAL  90   3.307  -5.314  -6.101
  673   1HG2  VAL  90          21HG      VAL  90   0.916  -4.212  -8.684
  674   2HG2  VAL  90          22HG      VAL  90  -0.325  -3.650  -7.562
  675   3HG2  VAL  90          23HG      VAL  90  -0.051  -5.379  -7.778
  676    H    ILE  91           H        ILE  91   0.713  -5.702  -3.099
  677    HA   ILE  91           HA       ILE  91   2.832  -4.157  -1.850
  678    HB   ILE  91           HB       ILE  91   0.539  -5.861  -0.926
  679   1HG1  ILE  91          11HG      ILE  91   1.206  -2.989  -0.389
  680   2HG1  ILE  91          12HG      ILE  91   0.069  -3.533  -1.613
  681   1HG2  ILE  91          21HG      ILE  91   2.416  -6.382   0.551
  682   2HG2  ILE  91          22HG      ILE  91   1.102  -5.552   1.368
  683   3HG2  ILE  91          23HG      ILE  91   2.573  -4.663   0.947
  684   1HD1  ILE  91          11HD      ILE  91  -1.275  -4.503   0.068
  685   2HD1  ILE  91          12HD      ILE  91  -1.023  -2.749   0.283
  686   3HD1  ILE  91          13HD      ILE  91  -0.168  -3.909   1.327
  687    H    GLY  92           H        GLY  92   4.395  -5.357  -0.648
  688   1HA   GLY  92          1HA       GLY  92   4.566  -8.122  -1.486
  689   2HA   GLY  92          2HA       GLY  92   5.995  -7.085  -1.557
  690    H    ARG  93           H        ARG  93   5.813  -9.447  -0.007
  691    HA   ARG  93           HA       ARG  93   6.128  -8.260   2.620
  692   1HB   ARG  93          1HB       ARG  93   4.356 -10.516   1.897
  693   2HB   ARG  93          2HB       ARG  93   5.250 -10.637   3.399
  694   1HG   ARG  93          1HG       ARG  93   3.774  -8.134   2.826
  695   2HG   ARG  93          2HG       ARG  93   2.851  -9.557   3.350
  696   1HD   ARG  93          1HD       ARG  93   5.223  -8.379   4.809
  697   2HD   ARG  93          2HD       ARG  93   3.537  -8.037   5.216
  698    HE   ARG  93           HE       ARG  93   3.542 -10.673   5.293
  699   1HH1  ARG  93          11HH      ARG  93   5.821  -8.425   6.811
  700   2HH1  ARG  93          12HH      ARG  93   6.210  -9.467   8.092
  701   1HH2  ARG  93          21HH      ARG  93   4.065 -12.089   7.116
  702   2HH2  ARG  93          22HH      ARG  93   5.193 -11.560   8.270
  703    H    GLU  94           H        GLU  94   7.451  -9.190   3.988
  704    HA   GLU  94           HA       GLU  94   9.127 -11.426   3.295
  705   1HB   GLU  94          1HB       GLU  94  10.047  -8.638   4.044
  706   2HB   GLU  94          2HB       GLU  94  11.039 -10.056   4.330
  707   1HG   GLU  94          1HG       GLU  94   9.961  -9.290   1.673
  708   2HG   GLU  94          2HG       GLU  94  11.545  -8.747   2.237
  Start of MODEL   15
    1   1H    GLY   1          1H        GLY   1  17.568  -7.319  -1.153
    2   2H    GLY   1          2H        GLY   1  16.570  -7.686  -2.479
    3   3H    GLY   1          3H        GLY   1  17.363  -8.916  -1.663
    4   1HA   GLY   1          1HA       GLY   1  16.040  -8.544   0.281
    5   2HA   GLY   1          2HA       GLY   1  15.245  -7.210  -0.543
    6    H    HIS   2           H        HIS   2  14.838 -10.299   0.316
    7    HA   HIS   2           HA       HIS   2  13.545 -11.217  -2.119
    8   1HB   HIS   2          1HB       HIS   2  13.750 -12.526   0.613
    9   2HB   HIS   2          2HB       HIS   2  13.078 -13.274  -0.826
   10    HD1  HIS   2           HD1      HIS   2  16.121 -13.166   1.069
   11    HD2  HIS   2           HD2      HIS   2  15.155 -13.379  -2.970
   12    HE1  HIS   2           HE1      HIS   2  18.160 -14.073  -0.097
   13    H    MET   3           H        MET   3  11.441 -10.903  -2.510
   14    HA   MET   3           HA       MET   3   9.566 -10.475  -0.329
   15   1HB   MET   3          1HB       MET   3  10.633  -8.250  -0.932
   16   2HB   MET   3          2HB       MET   3   9.993  -8.463  -2.545
   17   1HG   MET   3          1HG       MET   3   8.572  -6.964  -1.368
   18   2HG   MET   3          2HG       MET   3   7.716  -8.485  -1.599
   19   1HE   MET   3          1HE       MET   3   9.569  -7.201   2.437
   20   2HE   MET   3          2HE       MET   3   9.700  -6.242   0.961
   21   3HE   MET   3          3HE       MET   3  10.551  -7.781   1.096
   22    H    GLU   4           H        GLU   4   7.502 -11.129  -1.019
   23    HA   GLU   4           HA       GLU   4   7.333 -11.990  -3.814
   24   1HB   GLU   4          1HB       GLU   4   6.917 -13.775  -2.144
   25   2HB   GLU   4          2HB       GLU   4   5.641 -12.777  -1.450
   26   1HG   GLU   4          1HG       GLU   4   4.272 -13.013  -3.366
   27   2HG   GLU   4          2HG       GLU   4   5.583 -13.731  -4.296
   28    H    LEU   5           H        LEU   5   6.494 -10.496  -5.041
   29    HA   LEU   5           HA       LEU   5   4.729  -8.514  -3.900
   30   1HB   LEU   5          1HB       LEU   5   5.771  -8.733  -6.732
   31   2HB   LEU   5          2HB       LEU   5   4.905  -7.379  -6.050
   32    HG   LEU   5           HG       LEU   5   7.084  -6.689  -6.152
   33   1HD1  LEU   5          11HD      LEU   5   6.694  -7.611  -3.351
   34   2HD1  LEU   5          12HD      LEU   5   6.062  -6.131  -4.074
   35   3HD1  LEU   5          13HD      LEU   5   7.805  -6.341  -3.868
   36   1HD2  LEU   5          21HD      LEU   5   9.045  -7.921  -5.311
   37   2HD2  LEU   5          22HD      LEU   5   8.209  -8.812  -6.582
   38   3HD2  LEU   5          23HD      LEU   5   7.999  -9.277  -4.894
   39    H    PHE   6           H        PHE   6   2.572  -8.515  -4.131
   40    HA   PHE   6           HA       PHE   6   1.456 -10.071  -6.273
   41   1HB   PHE   6          1HB       PHE   6  -0.217 -10.948  -4.625
   42   2HB   PHE   6          2HB       PHE   6   1.344 -11.770  -4.648
   43    HD1  PHE   6           HD1      PHE   6   2.763 -11.464  -2.648
   44    HD2  PHE   6           HD2      PHE   6  -1.091  -9.740  -2.915
   45    HE1  PHE   6           HE1      PHE   6   2.777 -11.119  -0.249
   46    HE2  PHE   6           HE2      PHE   6  -1.107  -9.367  -0.471
   47    HZ   PHE   6           HZ       PHE   6   0.836 -10.063   0.873
   48    HA   PRO   7           HA       PRO   7  -1.454  -6.717  -6.286
   49   1HB   PRO   7          1HB       PRO   7  -3.153  -7.686  -8.006
   50   2HB   PRO   7          2HB       PRO   7  -1.554  -7.137  -8.503
   51   1HG   PRO   7          1HG       PRO   7  -2.508  -9.962  -8.056
   52   2HG   PRO   7          2HG       PRO   7  -1.449  -9.342  -9.349
   53   1HD   PRO   7          1HD       PRO   7  -0.618 -10.629  -7.075
   54   2HD   PRO   7          2HD       PRO   7   0.382  -9.492  -8.012
   55    H    VAL   8           H        VAL   8  -2.766  -6.444  -4.711
   56    HA   VAL   8           HA       VAL   8  -4.674  -8.516  -4.072
   57    HB   VAL   8           HB       VAL   8  -4.135  -5.955  -2.559
   58   1HG1  VAL   8          11HG      VAL   8  -5.280  -7.055  -0.682
   59   2HG1  VAL   8          12HG      VAL   8  -5.740  -8.360  -1.785
   60   3HG1  VAL   8          13HG      VAL   8  -6.306  -6.721  -2.074
   61   1HG2  VAL   8          21HG      VAL   8  -3.087  -8.716  -1.996
   62   2HG2  VAL   8          22HG      VAL   8  -2.898  -7.308  -0.937
   63   3HG2  VAL   8          23HG      VAL   8  -2.161  -7.318  -2.545
   64    H    GLU   9           H        GLU   9  -6.258  -8.243  -5.585
   65    HA   GLU   9           HA       GLU   9  -7.301  -5.632  -6.164
   66   1HB   GLU   9          1HB       GLU   9  -7.276  -7.530  -7.837
   67   2HB   GLU   9          2HB       GLU   9  -8.431  -8.370  -6.816
   68   1HG   GLU   9          1HG       GLU   9  -9.992  -6.427  -7.141
   69   2HG   GLU   9          2HG       GLU   9  -8.843  -5.809  -8.327
   70    H    LEU  10           H        LEU  10  -8.260  -4.721  -4.476
   71    HA   LEU  10           HA       LEU  10  -9.801  -6.368  -2.586
   72   1HB   LEU  10          1HB       LEU  10  -7.816  -4.596  -2.149
   73   2HB   LEU  10          2HB       LEU  10  -9.189  -3.509  -2.201
   74    HG   LEU  10           HG       LEU  10  -8.759  -3.916   0.060
   75   1HD1  LEU  10          11HD      LEU  10 -11.038  -5.709  -0.675
   76   2HD1  LEU  10          12HD      LEU  10 -11.112  -3.974  -0.407
   77   3HD1  LEU  10          13HD      LEU  10 -10.715  -5.058   0.930
   78   1HD2  LEU  10          21HD      LEU  10  -7.299  -5.811  -0.160
   79   2HD2  LEU  10          22HD      LEU  10  -8.667  -6.853  -0.554
   80   3HD2  LEU  10          23HD      LEU  10  -8.538  -6.129   1.051
   81    H    GLU  11           H        GLU  11 -11.992  -5.989  -2.595
   82    HA   GLU  11           HA       GLU  11 -12.938  -3.733  -4.188
   83   1HB   GLU  11          1HB       GLU  11 -13.837  -5.944  -4.840
   84   2HB   GLU  11          2HB       GLU  11 -14.479  -6.151  -3.216
   85   1HG   GLU  11          1HG       GLU  11 -15.964  -4.276  -3.526
   86   2HG   GLU  11          2HG       GLU  11 -15.276  -3.962  -5.116
   87    H    LYS  12           H        LYS  12 -12.859  -2.086  -2.900
   88    HA   LYS  12           HA       LYS  12 -13.642  -2.305  -0.174
   89   1HB   LYS  12          1HB       LYS  12 -12.240  -0.269  -1.759
   90   2HB   LYS  12          2HB       LYS  12 -13.009   0.308  -0.303
   91   1HG   LYS  12          1HG       LYS  12 -10.911  -1.864  -0.579
   92   2HG   LYS  12          2HG       LYS  12 -10.657  -0.253   0.100
   93   1HD   LYS  12          1HD       LYS  12 -12.781  -1.806   1.400
   94   2HD   LYS  12          2HD       LYS  12 -11.178  -2.543   1.556
   95   1HE   LYS  12          1HE       LYS  12 -11.768  -1.254   3.457
   96   2HE   LYS  12          2HE       LYS  12 -10.451  -0.427   2.673
   97   1HZ   LYS  12          1HZ       LYS  12 -12.218   1.084   1.643
   98   2HZ   LYS  12          2HZ       LYS  12 -12.124   1.180   3.315
   99   3HZ   LYS  12          3HZ       LYS  12 -13.348   0.273   2.615
  100    H    ASP  13           H        ASP  13 -14.605  -0.216   0.681
  101    HA   ASP  13           HA       ASP  13 -17.405  -0.389   0.186
  102   1HB   ASP  13          1HB       ASP  13 -15.974   1.528   2.014
  103   2HB   ASP  13          2HB       ASP  13 -17.576   0.837   2.194
  104    H    GLU  14           H        GLU  14 -18.478   1.922   0.554
  105    HA   GLU  14           HA       GLU  14 -17.949   3.544  -1.722
  106   1HB   GLU  14          1HB       GLU  14 -19.701   5.040  -0.779
  107   2HB   GLU  14          2HB       GLU  14 -20.214   3.363  -0.917
  108   1HG   GLU  14          1HG       GLU  14 -19.936   3.021   1.426
  109   2HG   GLU  14          2HG       GLU  14 -19.203   4.608   1.624
  110    H    ASP  15           H        ASP  15 -16.957   3.622   1.570
  111    HA   ASP  15           HA       ASP  15 -16.142   6.278   1.930
  112   1HB   ASP  15          1HB       ASP  15 -16.190   4.642   3.760
  113   2HB   ASP  15          2HB       ASP  15 -14.877   3.749   3.005
  114    H    GLY  16           H        GLY  16 -14.490   3.531   0.507
  115   1HA   GLY  16          1HA       GLY  16 -12.976   4.031  -1.345
  116   2HA   GLY  16          2HA       GLY  16 -12.323   5.321  -0.320
  117    H    LEU  17           H        LEU  17 -10.659   4.828   0.872
  118    HA   LEU  17           HA       LEU  17 -10.159   1.965   1.385
  119   1HB   LEU  17          1HB       LEU  17  -8.521   3.210  -0.197
  120   2HB   LEU  17          2HB       LEU  17  -8.088   4.106   1.233
  121    HG   LEU  17           HG       LEU  17  -7.040   2.310   2.200
  122   1HD1  LEU  17          11HD      LEU  17  -8.436   0.553   0.153
  123   2HD1  LEU  17          12HD      LEU  17  -8.771   0.594   1.889
  124   3HD1  LEU  17          13HD      LEU  17  -7.224   0.003   1.312
  125   1HD2  LEU  17          21HD      LEU  17  -6.656   2.064  -0.766
  126   2HD2  LEU  17          22HD      LEU  17  -5.533   1.556   0.504
  127   3HD2  LEU  17          23HD      LEU  17  -5.902   3.263   0.287
  128    H    GLY  18           H        GLY  18  -9.100   5.107   2.635
  129   1HA   GLY  18          1HA       GLY  18  -9.367   5.973   4.740
  130   2HA   GLY  18          2HA       GLY  18 -10.284   4.542   5.168
  131    H    ILE  19           H        ILE  19  -7.079   4.301   3.806
  132    HA   ILE  19           HA       ILE  19  -6.256   3.341   6.446
  133    HB   ILE  19           HB       ILE  19  -4.563   1.991   5.449
  134   1HG1  ILE  19          11HG      ILE  19  -5.340   3.229   2.785
  135   2HG1  ILE  19          12HG      ILE  19  -3.847   3.474   3.679
  136   1HG2  ILE  19          21HG      ILE  19  -7.189   1.718   4.001
  137   2HG2  ILE  19          22HG      ILE  19  -6.741   0.992   5.525
  138   3HG2  ILE  19          23HG      ILE  19  -5.936   0.479   4.035
  139   1HD1  ILE  19          11HD      ILE  19  -4.778   0.901   2.465
  140   2HD1  ILE  19          12HD      ILE  19  -3.273   1.109   3.377
  141   3HD1  ILE  19          13HD      ILE  19  -3.511   1.948   1.838
  142    H    SER  20           H        SER  20  -3.795   3.492   6.744
  143    HA   SER  20           HA       SER  20  -2.912   6.228   6.088
  144   1HB   SER  20          1HB       SER  20  -2.559   4.771   8.709
  145   2HB   SER  20          2HB       SER  20  -2.050   6.416   8.320
  146    HG   SER  20           HG       SER  20  -4.687   5.418   8.486
  147    H    ILE  21           H        ILE  21  -0.776   6.514   5.839
  148    HA   ILE  21           HA       ILE  21   0.779   4.068   5.370
  149    HB   ILE  21           HB       ILE  21   1.913   5.321   3.588
  150   1HG1  ILE  21          11HG      ILE  21   0.455   7.401   2.724
  151   2HG1  ILE  21          12HG      ILE  21   0.020   7.485   4.404
  152   1HG2  ILE  21          21HG      ILE  21  -1.067   5.103   3.219
  153   2HG2  ILE  21          22HG      ILE  21   0.126   3.828   2.974
  154   3HG2  ILE  21          23HG      ILE  21   0.112   5.238   1.915
  155   1HD1  ILE  21          11HD      ILE  21   2.332   7.795   5.038
  156   2HD1  ILE  21          12HD      ILE  21   1.841   8.993   3.847
  157   3HD1  ILE  21          13HD      ILE  21   2.832   7.647   3.363
  158    H    ILE  22           H        ILE  22   3.082   4.413   5.668
  159    HA   ILE  22           HA       ILE  22   3.649   6.794   7.198
  160    HB   ILE  22           HB       ILE  22   3.490   5.040   8.823
  161   1HG1  ILE  22          11HG      ILE  22   6.400   5.743   8.367
  162   2HG1  ILE  22          12HG      ILE  22   5.218   6.748   9.190
  163   1HG2  ILE  22          21HG      ILE  22   3.838   3.108   7.476
  164   2HG2  ILE  22          22HG      ILE  22   4.973   3.087   8.830
  165   3HG2  ILE  22          23HG      ILE  22   5.528   3.553   7.214
  166   1HD1  ILE  22          11HD      ILE  22   6.676   5.617  10.758
  167   2HD1  ILE  22          12HD      ILE  22   6.193   4.049  10.109
  168   3HD1  ILE  22          13HD      ILE  22   5.013   5.064  10.943
  169    H    GLY  23           H        GLY  23   5.452   7.858   6.696
  170   1HA   GLY  23          1HA       GLY  23   6.762   6.874   4.313
  171   2HA   GLY  23          2HA       GLY  23   6.806   8.529   4.911
  172    H    MET  24           H        MET  24   8.374   5.604   4.708
  173    HA   MET  24           HA       MET  24  10.374   6.485   6.675
  174   1HB   MET  24          1HB       MET  24   9.843   3.689   5.618
  175   2HB   MET  24          2HB       MET  24  11.080   4.120   6.783
  176   1HG   MET  24          1HG       MET  24   8.102   4.339   7.232
  177   2HG   MET  24          2HG       MET  24   9.132   3.039   7.808
  178   1HE   MET  24          1HE       MET  24  11.351   4.763  10.482
  179   2HE   MET  24          2HE       MET  24  11.759   4.492   8.790
  180   3HE   MET  24          3HE       MET  24  10.902   3.247   9.702
  181    H    GLY  25           H        GLY  25  12.561   6.216   5.953
  182   1HA   GLY  25          1HA       GLY  25  12.752   6.114   3.020
  183   2HA   GLY  25          2HA       GLY  25  13.860   7.021   4.042
  184    H    VAL  26           H        VAL  26  12.748   3.809   3.220
  185    HA   VAL  26           HA       VAL  26  14.983   2.680   4.608
  186    HB   VAL  26           HB       VAL  26  12.883   1.516   4.924
  187   1HG1  VAL  26          11HG      VAL  26  11.787   2.032   2.836
  188   2HG1  VAL  26          12HG      VAL  26  11.744   0.298   3.168
  189   3HG1  VAL  26          13HG      VAL  26  12.875   0.943   1.978
  190   1HG2  VAL  26          21HG      VAL  26  13.551  -0.767   4.373
  191   2HG2  VAL  26          22HG      VAL  26  14.885   0.186   5.031
  192   3HG2  VAL  26          23HG      VAL  26  14.793  -0.125   3.298
  193    H    GLY  27           H        GLY  27  16.762   3.078   3.660
  194   1HA   GLY  27          1HA       GLY  27  17.071   2.600   0.803
  195   2HA   GLY  27          2HA       GLY  27  18.234   3.385   1.868
  196    H    ALA  28           H        ALA  28  20.000   2.231   1.993
  197    HA   ALA  28           HA       ALA  28  19.827  -0.664   1.799
  198   1HB   ALA  28          1HB       ALA  28  22.244   1.138   1.836
  199   2HB   ALA  28          2HB       ALA  28  21.470   0.484   0.392
  200   3HB   ALA  28          3HB       ALA  28  22.259  -0.601   1.540
  201    H    ASP  29           H        ASP  29  19.217  -1.435   3.678
  202    HA   ASP  29           HA       ASP  29  20.997  -1.024   5.956
  203   1HB   ASP  29          1HB       ASP  29  19.052   0.511   6.273
  204   2HB   ASP  29          2HB       ASP  29  17.979  -0.881   6.177
  205    H    ALA  30           H        ALA  30  18.007  -2.696   5.043
  206    HA   ALA  30           HA       ALA  30  19.148  -5.200   6.018
  207   1HB   ALA  30          1HB       ALA  30  16.350  -4.600   5.072
  208   2HB   ALA  30          2HB       ALA  30  16.871  -4.613   6.759
  209   3HB   ALA  30          3HB       ALA  30  16.891  -6.106   5.815
  210    H    GLY  31           H        GLY  31  17.777  -3.704   3.154
  211   1HA   GLY  31          1HA       GLY  31  19.332  -4.498   1.161
  212   2HA   GLY  31          2HA       GLY  31  18.546  -6.022   1.581
  213    H    LEU  32           H        LEU  32  16.809  -3.008   1.783
  214    HA   LEU  32           HA       LEU  32  15.068  -4.102  -0.246
  215   1HB   LEU  32          1HB       LEU  32  14.634  -2.125   1.946
  216   2HB   LEU  32          2HB       LEU  32  13.480  -2.247   0.621
  217    HG   LEU  32           HG       LEU  32  12.632  -3.483   2.455
  218   1HD1  LEU  32          11HD      LEU  32  12.427  -5.735   1.605
  219   2HD1  LEU  32          12HD      LEU  32  13.786  -5.473   0.527
  220   3HD1  LEU  32          13HD      LEU  32  12.298  -4.543   0.310
  221   1HD2  LEU  32          21HD      LEU  32  15.284  -4.928   2.605
  222   2HD2  LEU  32          22HD      LEU  32  13.851  -5.339   3.549
  223   3HD2  LEU  32          23HD      LEU  32  14.644  -3.781   3.780
  224    H    GLU  33           H        GLU  33  16.298  -0.857   0.609
  225    HA   GLU  33           HA       GLU  33  16.761   0.958  -0.609
  226   1HB   GLU  33          1HB       GLU  33  17.570  -1.096  -2.666
  227   2HB   GLU  33          2HB       GLU  33  17.988   0.607  -2.735
  228   1HG   GLU  33          1HG       GLU  33  19.269   0.394  -0.690
  229   2HG   GLU  33          2HG       GLU  33  18.804  -1.302  -0.561
  230    H    LYS  34           H        LYS  34  14.413   1.340  -0.614
  231    HA   LYS  34           HA       LYS  34  13.455   1.981  -3.206
  232   1HB   LYS  34          1HB       LYS  34  11.595   0.461  -3.314
  233   2HB   LYS  34          2HB       LYS  34  13.085  -0.454  -3.113
  234   1HG   LYS  34          1HG       LYS  34  12.415  -0.502  -0.576
  235   2HG   LYS  34          2HG       LYS  34  10.829  -0.081  -1.185
  236   1HD   LYS  34          1HD       LYS  34  12.414  -2.490  -2.085
  237   2HD   LYS  34          2HD       LYS  34  11.066  -2.518  -0.955
  238   1HE   LYS  34          1HE       LYS  34   9.517  -1.900  -2.630
  239   2HE   LYS  34          2HE       LYS  34  10.783  -1.435  -3.757
  240   1HZ   LYS  34          1HZ       LYS  34   9.836  -3.566  -4.355
  241   2HZ   LYS  34          2HZ       LYS  34  10.232  -4.243  -2.868
  242   3HZ   LYS  34          3HZ       LYS  34  11.431  -3.757  -3.911
  243    H    LEU  35           H        LEU  35  10.837   2.221  -2.646
  244    HA   LEU  35           HA       LEU  35  10.545   4.499  -1.078
  245   1HB   LEU  35          1HB       LEU  35   8.196   4.102  -1.183
  246   2HB   LEU  35          2HB       LEU  35   8.887   3.555  -2.703
  247    HG   LEU  35           HG       LEU  35   8.591   1.525  -0.581
  248   1HD1  LEU  35          11HD      LEU  35   6.264   1.136  -1.173
  249   2HD1  LEU  35          12HD      LEU  35   6.261   2.621  -2.135
  250   3HD1  LEU  35          13HD      LEU  35   6.521   2.683  -0.382
  251   1HD2  LEU  35          21HD      LEU  35   9.502   0.952  -2.790
  252   2HD2  LEU  35          22HD      LEU  35   7.958   1.414  -3.530
  253   3HD2  LEU  35          23HD      LEU  35   8.031   0.070  -2.409
  254    H    GLY  36           H        GLY  36   9.753   4.716   1.103
  255   1HA   GLY  36          1HA       GLY  36   9.770   2.214   2.623
  256   2HA   GLY  36          2HA       GLY  36  10.268   3.780   3.279
  257    H    ILE  37           H        ILE  37   7.518   3.237   1.177
  258    HA   ILE  37           HA       ILE  37   5.898   4.370   3.272
  259    HB   ILE  37           HB       ILE  37   4.939   3.530   0.527
  260   1HG1  ILE  37          11HG      ILE  37   6.755   5.271   0.486
  261   2HG1  ILE  37          12HG      ILE  37   5.217   5.847  -0.185
  262   1HG2  ILE  37          21HG      ILE  37   3.769   5.314   2.654
  263   2HG2  ILE  37          22HG      ILE  37   3.200   3.712   2.218
  264   3HG2  ILE  37          23HG      ILE  37   3.060   5.044   1.061
  265   1HD1  ILE  37          11HD      ILE  37   6.244   7.549   1.129
  266   2HD1  ILE  37          12HD      ILE  37   6.475   6.433   2.472
  267   3HD1  ILE  37          13HD      ILE  37   4.840   6.950   2.025
  268    H    PHE  38           H        PHE  38   5.512   2.996   4.745
  269    HA   PHE  38           HA       PHE  38   4.644   0.297   4.051
  270   1HB   PHE  38          1HB       PHE  38   5.513   1.558   6.623
  271   2HB   PHE  38          2HB       PHE  38   4.882  -0.085   6.549
  272    HD1  PHE  38           HD1      PHE  38   7.740   2.070   5.867
  273    HD2  PHE  38           HD2      PHE  38   6.171  -1.854   5.425
  274    HE1  PHE  38           HE1      PHE  38   9.988   1.242   5.341
  275    HE2  PHE  38           HE2      PHE  38   8.422  -2.700   4.897
  276    HZ   PHE  38           HZ       PHE  38  10.336  -1.150   4.851
  277    H    VAL  39           H        VAL  39   2.793  -0.600   5.145
  278    HA   VAL  39           HA       VAL  39   0.658   1.304   5.186
  279    HB   VAL  39           HB       VAL  39   0.549  -1.613   6.037
  280   1HG1  VAL  39          11HG      VAL  39  -1.826  -1.427   5.494
  281   2HG1  VAL  39          12HG      VAL  39  -1.601   0.278   5.102
  282   3HG1  VAL  39          13HG      VAL  39  -1.351  -0.286   6.753
  283   1HG2  VAL  39          21HG      VAL  39   1.442  -1.426   3.748
  284   2HG2  VAL  39          22HG      VAL  39   0.070  -0.424   3.297
  285   3HG2  VAL  39          23HG      VAL  39  -0.182  -2.113   3.746
  286    H    LYS  40           H        LYS  40   0.252   2.447   6.837
  287    HA   LYS  40           HA       LYS  40   1.584   1.902   9.335
  288   1HB   LYS  40          1HB       LYS  40   1.795   4.094   8.488
  289   2HB   LYS  40          2HB       LYS  40   0.072   4.233   8.230
  290   1HG   LYS  40          1HG       LYS  40  -0.369   4.330  10.505
  291   2HG   LYS  40          2HG       LYS  40   1.323   3.987  10.947
  292   1HD   LYS  40          1HD       LYS  40   1.961   6.098   9.893
  293   2HD   LYS  40          2HD       LYS  40   0.273   6.377   9.448
  294   1HE   LYS  40          1HE       LYS  40  -0.346   6.340  11.775
  295   2HE   LYS  40          2HE       LYS  40   1.332   6.053  12.219
  296   1HZ   LYS  40          1HZ       LYS  40   1.950   8.181  11.316
  297   2HZ   LYS  40          2HZ       LYS  40   0.710   8.429  12.421
  298   3HZ   LYS  40          3HZ       LYS  40   0.391   8.469  10.765
  299    H    THR  41           H        THR  41  -1.700   2.560   8.190
  300    HA   THR  41           HA       THR  41  -2.702   1.016  10.430
  301    HB   THR  41           HB       THR  41  -4.194   3.387   9.643
  302    HG1  THR  41           HG1      THR  41  -1.952   3.415  11.472
  303   1HG2  THR  41          21HG      THR  41  -4.807   3.414  12.060
  304   2HG2  THR  41          22HG      THR  41  -3.732   2.032  12.296
  305   3HG2  THR  41          23HG      THR  41  -5.140   1.890  11.242
  306    H    VAL  42           H        VAL  42  -4.932   0.323   9.862
  307    HA   VAL  42           HA       VAL  42  -5.626   0.821   7.116
  308    HB   VAL  42           HB       VAL  42  -6.011  -1.848   8.562
  309   1HG1  VAL  42          11HG      VAL  42  -6.651  -1.072   5.718
  310   2HG1  VAL  42          12HG      VAL  42  -7.822  -1.357   6.991
  311   3HG1  VAL  42          13HG      VAL  42  -6.825  -2.693   6.395
  312   1HG2  VAL  42          21HG      VAL  42  -3.694  -1.517   7.907
  313   2HG2  VAL  42          22HG      VAL  42  -4.204  -1.153   6.257
  314   3HG2  VAL  42          23HG      VAL  42  -4.452  -2.769   6.921
  315    H    THR  43           H        THR  43  -7.998   0.896   6.893
  316    HA   THR  43           HA       THR  43  -9.345   2.021   9.069
  317    HB   THR  43           HB       THR  43  -9.973   2.503   6.711
  318    HG1  THR  43           HG1      THR  43 -11.929   2.849   7.339
  319   1HG2  THR  43          21HG      THR  43 -11.179   0.828   5.418
  320   2HG2  THR  43          22HG      THR  43 -11.013  -0.274   6.806
  321   3HG2  THR  43          23HG      THR  43  -9.576   0.216   5.907
  322    H    GLU  44           H        GLU  44 -10.839   1.205  10.345
  323    HA   GLU  44           HA       GLU  44 -10.752  -1.571  11.018
  324   1HB   GLU  44          1HB       GLU  44 -12.116  -0.852  12.876
  325   2HB   GLU  44          2HB       GLU  44 -10.795   0.293  12.669
  326   1HG   GLU  44          1HG       GLU  44 -12.374   1.642  11.292
  327   2HG   GLU  44          2HG       GLU  44 -13.627   0.557  11.849
  328    H    GLY  45           H        GLY  45 -12.718   0.636   9.240
  329   1HA   GLY  45          1HA       GLY  45 -14.800  -1.385   8.925
  330   2HA   GLY  45          2HA       GLY  45 -15.232   0.327   9.171
  331    H    GLY  46           H        GLY  46 -13.272  -1.789   7.285
  332   1HA   GLY  46          1HA       GLY  46 -14.526  -0.837   4.965
  333   2HA   GLY  46          2HA       GLY  46 -12.786  -0.542   5.111
  334    H    ALA  47           H        ALA  47 -14.114  -2.180   3.388
  335    HA   ALA  47           HA       ALA  47 -14.016  -4.870   4.012
  336   1HB   ALA  47          1HB       ALA  47 -13.530  -3.720   1.286
  337   2HB   ALA  47          2HB       ALA  47 -15.116  -3.951   2.027
  338   3HB   ALA  47          3HB       ALA  47 -14.090  -5.343   1.664
  339    H    ALA  48           H        ALA  48 -11.370  -2.977   4.100
  340    HA   ALA  48           HA       ALA  48  -9.435  -4.635   2.761
  341   1HB   ALA  48          1HB       ALA  48  -9.008  -2.234   3.042
  342   2HB   ALA  48          2HB       ALA  48  -7.750  -3.189   3.828
  343   3HB   ALA  48          3HB       ALA  48  -9.016  -2.432   4.794
  344    H    GLN  49           H        GLN  49 -10.122  -3.890   6.219
  345    HA   GLN  49           HA       GLN  49  -8.678  -6.184   7.004
  346   1HB   GLN  49          1HB       GLN  49 -10.314  -4.169   8.567
  347   2HB   GLN  49          2HB       GLN  49  -9.643  -5.594   9.342
  348   1HG   GLN  49          1HG       GLN  49  -7.393  -4.892   8.474
  349   2HG   GLN  49          2HG       GLN  49  -8.184  -3.421   7.901
  350   1HE2  GLN  49          21HE      GLN  49  -9.893  -3.144  10.151
  351   2HE2  GLN  49          22HE      GLN  49  -8.953  -2.626  11.481
  352    H    ARG  50           H        ARG  50 -11.656  -5.840   5.698
  353    HA   ARG  50           HA       ARG  50 -12.798  -8.159   6.993
  354   1HB   ARG  50          1HB       ARG  50 -13.723  -6.620   4.574
  355   2HB   ARG  50          2HB       ARG  50 -14.595  -7.947   5.296
  356   1HG   ARG  50          1HG       ARG  50 -13.868  -5.576   6.939
  357   2HG   ARG  50          2HG       ARG  50 -15.307  -5.538   5.913
  358   1HD   ARG  50          1HD       ARG  50 -15.849  -6.171   8.224
  359   2HD   ARG  50          2HD       ARG  50 -16.199  -7.469   7.102
  360    HE   ARG  50           HE       ARG  50 -14.257  -8.619   7.915
  361   1HH1  ARG  50          11HH      ARG  50 -15.241  -5.854   9.930
  362   2HH1  ARG  50          12HH      ARG  50 -14.586  -6.487  11.355
  363   1HH2  ARG  50          21HH      ARG  50 -13.359  -9.474   9.878
  364   2HH2  ARG  50          22HH      ARG  50 -13.475  -8.579  11.325
  365    H    ASP  51           H        ASP  51 -11.281  -7.244   3.915
  366    HA   ASP  51           HA       ASP  51 -11.425  -9.812   2.729
  367   1HB   ASP  51          1HB       ASP  51 -10.792  -7.609   1.571
  368   2HB   ASP  51          2HB       ASP  51  -9.195  -7.802   2.278
  369    H    GLY  52           H        GLY  52  -8.882  -8.228   4.637
  370   1HA   GLY  52          1HA       GLY  52  -7.584  -9.193   6.326
  371   2HA   GLY  52          2HA       GLY  52  -8.291 -10.747   5.935
  372    H    ARG  53           H        ARG  53  -7.435 -10.138   3.080
  373    HA   ARG  53           HA       ARG  53  -5.050 -11.661   2.822
  374   1HB   ARG  53          1HB       ARG  53  -6.927 -10.872   1.254
  375   2HB   ARG  53          2HB       ARG  53  -5.825  -9.537   0.973
  376   1HG   ARG  53          1HG       ARG  53  -4.083 -11.324   0.531
  377   2HG   ARG  53          2HG       ARG  53  -5.467 -12.424   0.394
  378   1HD   ARG  53          1HD       ARG  53  -4.802 -10.011  -1.139
  379   2HD   ARG  53          2HD       ARG  53  -5.090 -11.677  -1.713
  380    HE   ARG  53           HE       ARG  53  -7.407 -10.511  -0.442
  381   1HH1  ARG  53          11HH      ARG  53  -5.830 -10.844  -3.576
  382   2HH1  ARG  53          12HH      ARG  53  -7.158 -10.282  -4.469
  383   1HH2  ARG  53          21HH      ARG  53  -9.221  -9.700  -1.605
  384   2HH2  ARG  53          22HH      ARG  53  -9.157  -9.545  -3.295
  385    H    ILE  54           H        ILE  54  -5.730  -8.233   2.899
  386    HA   ILE  54           HA       ILE  54  -2.980  -7.497   2.416
  387    HB   ILE  54           HB       ILE  54  -5.093  -6.239   1.560
  388   1HG1  ILE  54          11HG      ILE  54  -2.925  -4.687   3.002
  389   2HG1  ILE  54          12HG      ILE  54  -2.828  -5.381   1.384
  390   1HG2  ILE  54          21HG      ILE  54  -5.047  -5.278   4.416
  391   2HG2  ILE  54          22HG      ILE  54  -6.360  -6.145   3.622
  392   3HG2  ILE  54          23HG      ILE  54  -5.963  -4.493   3.127
  393   1HD1  ILE  54          11HD      ILE  54  -4.678  -3.161   2.248
  394   2HD1  ILE  54          12HD      ILE  54  -4.621  -3.894   0.646
  395   3HD1  ILE  54          13HD      ILE  54  -3.224  -3.002   1.246
  396    H    GLN  55           H        GLN  55  -1.920  -5.947   4.104
  397    HA   GLN  55           HA       GLN  55  -2.866  -6.753   6.714
  398   1HB   GLN  55          1HB       GLN  55   0.024  -6.674   5.817
  399   2HB   GLN  55          2HB       GLN  55  -0.495  -6.922   7.470
  400   1HG   GLN  55          1HG       GLN  55  -0.349  -9.098   7.021
  401   2HG   GLN  55          2HG       GLN  55  -1.838  -8.893   6.112
  402   1HE2  GLN  55          21HE      GLN  55  -0.359  -7.321   3.939
  403   2HE2  GLN  55          22HE      GLN  55   0.460  -8.548   3.089
  404    H    VAL  56           H        VAL  56  -1.283  -5.444   8.312
  405    HA   VAL  56           HA       VAL  56  -1.269  -2.634   7.468
  406    HB   VAL  56           HB       VAL  56  -2.977  -3.240   9.238
  407   1HG1  VAL  56          11HG      VAL  56  -0.591  -3.793  10.967
  408   2HG1  VAL  56          12HG      VAL  56  -1.816  -4.949  10.447
  409   3HG1  VAL  56          13HG      VAL  56  -2.251  -3.634  11.540
  410   1HG2  VAL  56          21HG      VAL  56  -2.512  -1.320  10.701
  411   2HG2  VAL  56          22HG      VAL  56  -2.114  -0.935   9.018
  412   3HG2  VAL  56          23HG      VAL  56  -0.840  -1.327  10.149
  413    H    ASN  57           H        ASN  57   0.633  -4.972   7.442
  414    HA   ASN  57           HA       ASN  57   2.864  -3.779   8.922
  415   1HB   ASN  57          1HB       ASN  57   3.602  -5.956   9.762
  416   2HB   ASN  57          2HB       ASN  57   1.977  -5.555  10.317
  417   1HD2  ASN  57          21HD      ASN  57   1.534  -7.673  10.784
  418   2HD2  ASN  57          22HD      ASN  57   1.218  -8.881   9.592
  419    H    ASP  58           H        ASP  58   1.815  -4.147   6.170
  420    HA   ASP  58           HA       ASP  58   4.124  -5.342   4.906
  421   1HB   ASP  58          1HB       ASP  58   2.528  -5.574   2.930
  422   2HB   ASP  58          2HB       ASP  58   2.205  -6.619   4.302
  423    H    GLN  59           H        GLN  59   3.700  -4.230   2.385
  424    HA   GLN  59           HA       GLN  59   4.149  -1.383   2.932
  425   1HB   GLN  59          1HB       GLN  59   6.274  -2.693   2.844
  426   2HB   GLN  59          2HB       GLN  59   5.820  -3.145   1.198
  427   1HG   GLN  59          1HG       GLN  59   5.869  -0.812   0.531
  428   2HG   GLN  59          2HG       GLN  59   6.282  -0.343   2.174
  429   1HE2  GLN  59          21HE      GLN  59   8.122   0.574   1.668
  430   2HE2  GLN  59          22HE      GLN  59   9.531  -0.229   1.103
  431    H    ILE  60           H        ILE  60   3.179  -0.096   1.444
  432    HA   ILE  60           HA       ILE  60   1.648  -1.249  -0.692
  433    HB   ILE  60           HB       ILE  60   2.329   1.672  -0.228
  434   1HG1  ILE  60          11HG      ILE  60   1.081   0.777   1.710
  435   2HG1  ILE  60          12HG      ILE  60   0.101   1.894   0.764
  436   1HG2  ILE  60          21HG      ILE  60   0.144   0.406  -1.848
  437   2HG2  ILE  60          22HG      ILE  60   1.630   1.057  -2.501
  438   3HG2  ILE  60          23HG      ILE  60   0.465   2.140  -1.725
  439   1HD1  ILE  60          11HD      ILE  60  -1.230   0.013   1.474
  440   2HD1  ILE  60          12HD      ILE  60  -0.076  -1.099   0.752
  441   3HD1  ILE  60          13HD      ILE  60  -1.031  -0.034  -0.283
  442    H    VAL  61           H        VAL  61   2.845  -2.053  -2.369
  443    HA   VAL  61           HA       VAL  61   5.351  -0.773  -3.036
  444    HB   VAL  61           HB       VAL  61   4.014  -3.285  -4.094
  445   1HG1  VAL  61          11HG      VAL  61   5.465  -2.364  -5.812
  446   2HG1  VAL  61          12HG      VAL  61   6.053  -3.885  -5.126
  447   3HG1  VAL  61          13HG      VAL  61   6.818  -2.357  -4.655
  448   1HG2  VAL  61          21HG      VAL  61   4.718  -3.472  -1.791
  449   2HG2  VAL  61          22HG      VAL  61   6.344  -2.943  -2.218
  450   3HG2  VAL  61          23HG      VAL  61   5.727  -4.480  -2.826
  451    H    GLU  62           H        GLU  62   2.305  -1.530  -4.658
  452    HA   GLU  62           HA       GLU  62   2.533   0.877  -6.240
  453   1HB   GLU  62          1HB       GLU  62   3.801  -0.643  -7.624
  454   2HB   GLU  62          2HB       GLU  62   2.546  -1.859  -7.549
  455   1HG   GLU  62          1HG       GLU  62   1.046  -0.381  -8.779
  456   2HG   GLU  62          2HG       GLU  62   2.323   0.831  -8.852
  457    H    VAL  63           H        VAL  63   0.557   1.767  -6.004
  458    HA   VAL  63           HA       VAL  63  -1.687  -0.066  -6.017
  459    HB   VAL  63           HB       VAL  63  -1.254   2.532  -4.543
  460   1HG1  VAL  63          11HG      VAL  63  -3.648   2.751  -4.166
  461   2HG1  VAL  63          12HG      VAL  63  -3.964   1.418  -5.292
  462   3HG1  VAL  63          13HG      VAL  63  -3.252   2.929  -5.879
  463   1HG2  VAL  63          21HG      VAL  63  -0.915   0.319  -3.550
  464   2HG2  VAL  63          22HG      VAL  63  -2.597  -0.071  -3.903
  465   3HG2  VAL  63          23HG      VAL  63  -2.214   1.232  -2.778
  466    H    ASP  64           H        ASP  64  -3.070  -0.054  -7.537
  467    HA   ASP  64           HA       ASP  64  -4.329   0.449  -9.358
  468   1HB   ASP  64          1HB       ASP  64  -4.923   2.416  -7.857
  469   2HB   ASP  64          2HB       ASP  64  -3.745   3.363  -8.750
  470    H    GLY  65           H        GLY  65  -1.334   0.333  -9.466
  471   1HA   GLY  65          1HA       GLY  65   0.201   0.201 -11.179
  472   2HA   GLY  65          2HA       GLY  65  -1.014   0.858 -12.271
  473    H    ILE  66           H        ILE  66  -0.592   2.766  -9.495
  474    HA   ILE  66           HA       ILE  66   0.395   4.915 -11.075
  475    HB   ILE  66           HB       ILE  66  -1.212   4.954  -8.921
  476   1HG1  ILE  66          11HG      ILE  66   0.891   7.085  -9.333
  477   2HG1  ILE  66          12HG      ILE  66  -0.499   6.864 -10.392
  478   1HG2  ILE  66          21HG      ILE  66   1.514   5.308  -7.709
  479   2HG2  ILE  66          22HG      ILE  66   0.375   4.002  -7.370
  480   3HG2  ILE  66          23HG      ILE  66  -0.018   5.663  -6.908
  481   1HD1  ILE  66          11HD      ILE  66  -0.884   8.658  -8.811
  482   2HD1  ILE  66          12HD      ILE  66  -0.572   7.539  -7.477
  483   3HD1  ILE  66          13HD      ILE  66  -1.979   7.302  -8.512
  484    H    SER  67           H        SER  67   1.894   2.453  -9.476
  485    HA   SER  67           HA       SER  67   3.868   2.072  -8.440
  486   1HB   SER  67          1HB       SER  67   5.843   2.560 -10.049
  487   2HB   SER  67          2HB       SER  67   4.559   1.484 -10.589
  488    HG   SER  67           HG       SER  67   4.473   4.247 -11.151
  489    H    LEU  68           H        LEU  68   3.722   3.197  -6.626
  490    HA   LEU  68           HA       LEU  68   4.757   5.904  -6.595
  491   1HB   LEU  68          1HB       LEU  68   3.860   5.990  -4.327
  492   2HB   LEU  68          2HB       LEU  68   2.647   5.513  -5.490
  493    HG   LEU  68           HG       LEU  68   3.729   3.143  -4.554
  494   1HD1  LEU  68          11HD      LEU  68   3.493   3.291  -2.127
  495   2HD1  LEU  68          12HD      LEU  68   3.237   5.034  -2.272
  496   3HD1  LEU  68          13HD      LEU  68   4.781   4.331  -2.746
  497   1HD2  LEU  68          21HD      LEU  68   1.189   4.572  -3.821
  498   2HD2  LEU  68          22HD      LEU  68   1.514   2.844  -3.581
  499   3HD2  LEU  68          23HD      LEU  68   1.478   3.524  -5.213
  500    H    VAL  69           H        VAL  69   6.151   3.224  -6.701
  501    HA   VAL  69           HA       VAL  69   7.971   3.006  -4.588
  502    HB   VAL  69           HB       VAL  69   8.600   2.499  -7.517
  503   1HG1  VAL  69          11HG      VAL  69  10.261   0.891  -6.684
  504   2HG1  VAL  69          12HG      VAL  69   9.880   1.369  -5.030
  505   3HG1  VAL  69          13HG      VAL  69  10.596   2.535  -6.139
  506   1HG2  VAL  69          21HG      VAL  69   7.449   0.595  -5.475
  507   2HG2  VAL  69          22HG      VAL  69   7.959   0.160  -7.105
  508   3HG2  VAL  69          23HG      VAL  69   6.604   1.261  -6.872
  509    H    GLY  70           H        GLY  70   8.692   4.930  -3.845
  510   1HA   GLY  70          1HA       GLY  70  10.827   6.122  -3.888
  511   2HA   GLY  70          2HA       GLY  70  10.559   6.361  -5.609
  512    H    VAL  71           H        VAL  71   7.756   6.689  -3.621
  513    HA   VAL  71           HA       VAL  71   7.952   9.596  -3.946
  514    HB   VAL  71           HB       VAL  71   5.549   9.729  -3.789
  515   1HG1  VAL  71          11HG      VAL  71   6.425   9.192  -5.981
  516   2HG1  VAL  71          12HG      VAL  71   4.849   8.444  -5.729
  517   3HG1  VAL  71          13HG      VAL  71   6.313   7.469  -5.614
  518   1HG2  VAL  71          21HG      VAL  71   4.121   7.776  -3.449
  519   2HG2  VAL  71          22HG      VAL  71   5.198   8.017  -2.073
  520   3HG2  VAL  71          23HG      VAL  71   5.548   6.754  -3.253
  521    H    THR  72           H        THR  72   6.518  10.747  -2.173
  522    HA   THR  72           HA       THR  72   7.643   9.977   0.390
  523    HB   THR  72           HB       THR  72   6.591  12.222   1.021
  524    HG1  THR  72           HG1      THR  72   6.763  12.939  -1.666
  525   1HG2  THR  72          21HG      THR  72   8.484  13.489   0.025
  526   2HG2  THR  72          22HG      THR  72   8.803  12.119  -1.043
  527   3HG2  THR  72          23HG      THR  72   9.012  11.944   0.697
  528    H    GLN  73           H        GLN  73   6.089  10.730   2.160
  529    HA   GLN  73           HA       GLN  73   3.985   8.907   2.166
  530   1HB   GLN  73          1HB       GLN  73   3.629   9.564   4.438
  531   2HB   GLN  73          2HB       GLN  73   5.335   9.674   4.113
  532   1HG   GLN  73          1HG       GLN  73   3.397  11.884   4.248
  533   2HG   GLN  73          2HG       GLN  73   4.556  11.475   5.517
  534   1HE2  GLN  73          21HE      GLN  73   6.870  11.501   4.765
  535   2HE2  GLN  73          22HE      GLN  73   7.320  12.764   3.697
  536    H    ASN  74           H        ASN  74   4.143  12.331   1.544
  537    HA   ASN  74           HA       ASN  74   1.362  12.726   1.712
  538   1HB   ASN  74          1HB       ASN  74   1.738  14.951   0.739
  539   2HB   ASN  74          2HB       ASN  74   2.897  14.625   2.014
  540   1HD2  ASN  74          21HD      ASN  74   5.059  14.501   1.494
  541   2HD2  ASN  74          22HD      ASN  74   5.664  14.908  -0.068
  542    H    PHE  75           H        PHE  75   3.415  11.666  -0.838
  543    HA   PHE  75           HA       PHE  75   1.423  12.009  -2.862
  544   1HB   PHE  75          1HB       PHE  75   3.885  11.776  -3.357
  545   2HB   PHE  75          2HB       PHE  75   3.761  10.093  -2.851
  546    HD1  PHE  75           HD1      PHE  75   3.211  12.454  -5.516
  547    HD2  PHE  75           HD2      PHE  75   2.345   8.482  -4.214
  548    HE1  PHE  75           HE1      PHE  75   2.549  11.837  -7.797
  549    HE2  PHE  75           HE2      PHE  75   1.678   7.877  -6.465
  550    HZ   PHE  75           HZ       PHE  75   1.790   9.545  -8.285
  551    H    ALA  76           H        ALA  76   2.702   9.292  -0.993
  552    HA   ALA  76           HA       ALA  76   0.947   7.349  -1.933
  553   1HB   ALA  76          1HB       ALA  76   1.599   6.036  -0.021
  554   2HB   ALA  76          2HB       ALA  76   2.257   7.479   0.765
  555   3HB   ALA  76          3HB       ALA  76   2.990   6.865  -0.720
  556    H    ALA  77           H        ALA  77   0.608   9.476   0.905
  557    HA   ALA  77           HA       ALA  77  -1.811   8.398   1.893
  558   1HB   ALA  77          1HB       ALA  77  -1.982  10.451   3.199
  559   2HB   ALA  77          2HB       ALA  77  -0.754  11.200   2.183
  560   3HB   ALA  77          3HB       ALA  77  -0.323   9.841   3.222
  561    H    THR  78           H        THR  78  -1.212  10.189  -0.859
  562    HA   THR  78           HA       THR  78  -3.923  11.170  -1.014
  563    HB   THR  78           HB       THR  78  -1.541  11.462  -2.851
  564    HG1  THR  78           HG1      THR  78  -1.116  12.815  -1.320
  565   1HG2  THR  78          21HG      THR  78  -3.619  11.518  -4.132
  566   2HG2  THR  78          22HG      THR  78  -2.913  13.138  -4.063
  567   3HG2  THR  78          23HG      THR  78  -4.292  12.722  -3.035
  568    H    VAL  79           H        VAL  79  -1.756   8.936  -2.783
  569    HA   VAL  79           HA       VAL  79  -3.676   8.030  -4.588
  570    HB   VAL  79           HB       VAL  79  -1.425   6.311  -3.465
  571   1HG1  VAL  79          11HG      VAL  79  -2.858   6.168  -6.096
  572   2HG1  VAL  79          12HG      VAL  79  -3.086   5.098  -4.716
  573   3HG1  VAL  79          13HG      VAL  79  -1.535   5.126  -5.551
  574   1HG2  VAL  79          21HG      VAL  79  -0.539   8.435  -4.216
  575   2HG2  VAL  79          22HG      VAL  79  -1.410   8.283  -5.734
  576   3HG2  VAL  79          23HG      VAL  79  -0.103   7.153  -5.344
  577    H    LEU  80           H        LEU  80  -2.663   6.608  -1.493
  578    HA   LEU  80           HA       LEU  80  -4.594   4.536  -1.466
  579   1HB   LEU  80          1HB       LEU  80  -2.901   5.735   0.721
  580   2HB   LEU  80          2HB       LEU  80  -4.016   4.434   1.035
  581    HG   LEU  80           HG       LEU  80  -1.838   3.500   0.873
  582   1HD1  LEU  80          11HD      LEU  80  -3.215   2.916  -1.717
  583   2HD1  LEU  80          12HD      LEU  80  -3.630   2.236  -0.149
  584   3HD1  LEU  80          13HD      LEU  80  -2.050   1.894  -0.859
  585   1HD2  LEU  80          21HD      LEU  80  -0.740   5.310  -0.371
  586   2HD2  LEU  80          22HD      LEU  80  -1.534   4.760  -1.848
  587   3HD2  LEU  80          23HD      LEU  80  -0.363   3.724  -1.028
  588    H    ARG  81           H        ARG  81  -5.160   7.662  -1.289
  589    HA   ARG  81           HA       ARG  81  -7.473   7.518   0.541
  590   1HB   ARG  81          1HB       ARG  81  -5.832   9.270   0.882
  591   2HB   ARG  81          2HB       ARG  81  -6.020   9.767  -0.784
  592   1HG   ARG  81          1HG       ARG  81  -8.456  10.170  -0.195
  593   2HG   ARG  81          2HG       ARG  81  -7.912  10.078   1.491
  594   1HD   ARG  81          1HD       ARG  81  -6.825  11.806  -0.652
  595   2HD   ARG  81          2HD       ARG  81  -7.852  12.369   0.684
  596    HE   ARG  81           HE       ARG  81  -5.260  11.081   1.226
  597   1HH1  ARG  81          11HH      ARG  81  -7.306  13.976   1.503
  598   2HH1  ARG  81          12HH      ARG  81  -6.143  14.851   2.383
  599   1HH2  ARG  81          21HH      ARG  81  -3.727  12.290   2.489
  600   2HH2  ARG  81          22HH      ARG  81  -4.112  13.889   2.961
  601    H    ASN  82           H        ASN  82  -6.330   8.323  -2.679
  602    HA   ASN  82           HA       ASN  82  -8.890   9.172  -3.649
  603   1HB   ASN  82          1HB       ASN  82  -6.162   9.005  -4.891
  604   2HB   ASN  82          2HB       ASN  82  -7.570   9.295  -5.877
  605   1HD2  ASN  82          21HD      ASN  82  -6.677  10.524  -2.711
  606   2HD2  ASN  82          22HD      ASN  82  -6.743  12.213  -3.122
  607    H    THR  83           H        THR  83  -7.526   6.237  -3.211
  608    HA   THR  83           HA       THR  83  -8.145   4.745  -5.451
  609    HB   THR  83           HB       THR  83  -8.404   2.904  -3.686
  610    HG1  THR  83           HG1      THR  83  -8.887   4.550  -2.059
  611   1HG2  THR  83          21HG      THR  83  -6.326   3.310  -4.942
  612   2HG2  THR  83          22HG      THR  83  -5.974   2.889  -3.265
  613   3HG2  THR  83          23HG      THR  83  -5.879   4.568  -3.793
  614    H    LYS  84           H        LYS  84  -9.914   3.501  -5.988
  615    HA   LYS  84           HA       LYS  84 -12.411   4.217  -4.684
  616   1HB   LYS  84          1HB       LYS  84 -13.432   3.353  -6.941
  617   2HB   LYS  84          2HB       LYS  84 -12.739   4.954  -6.866
  618   1HG   LYS  84          1HG       LYS  84 -12.091   3.917  -8.930
  619   2HG   LYS  84          2HG       LYS  84 -10.672   4.070  -7.901
  620   1HD   LYS  84          1HD       LYS  84 -10.908   1.699  -7.271
  621   2HD   LYS  84          2HD       LYS  84 -12.296   1.571  -8.343
  622   1HE   LYS  84          1HE       LYS  84  -9.486   2.303  -9.212
  623   2HE   LYS  84          2HE       LYS  84 -10.215   0.713  -9.382
  624   1HZ   LYS  84          1HZ       LYS  84 -11.853   1.666 -10.881
  625   2HZ   LYS  84          2HZ       LYS  84 -10.289   1.986 -11.421
  626   3HZ   LYS  84          3HZ       LYS  84 -11.169   3.208 -10.693
  627    H    GLY  85           H        GLY  85 -14.068   2.251  -5.440
  628   1HA   GLY  85          1HA       GLY  85 -13.961   0.256  -3.700
  629   2HA   GLY  85          2HA       GLY  85 -14.675   0.036  -5.281
  630    H    ASN  86           H        ASN  86 -13.050  -0.681  -7.022
  631    HA   ASN  86           HA       ASN  86 -11.558  -2.868  -5.831
  632   1HB   ASN  86          1HB       ASN  86 -12.198  -2.253  -8.713
  633   2HB   ASN  86          2HB       ASN  86 -11.028  -3.481  -8.268
  634   1HD2  ASN  86          21HD      ASN  86 -14.392  -2.602  -8.244
  635   2HD2  ASN  86          22HD      ASN  86 -14.994  -4.176  -7.892
  636    H    VAL  87           H        VAL  87  -9.750  -2.442  -5.044
  637    HA   VAL  87           HA       VAL  87  -7.965  -0.559  -6.413
  638    HB   VAL  87           HB       VAL  87  -7.314  -1.745  -3.783
  639   1HG1  VAL  87          11HG      VAL  87  -6.770   0.944  -4.987
  640   2HG1  VAL  87          12HG      VAL  87  -5.674  -0.428  -4.924
  641   3HG1  VAL  87          13HG      VAL  87  -6.173   0.367  -3.424
  642   1HG2  VAL  87          21HG      VAL  87  -9.567  -1.061  -3.446
  643   2HG2  VAL  87          22HG      VAL  87  -9.251   0.544  -4.122
  644   3HG2  VAL  87          23HG      VAL  87  -8.501   0.054  -2.589
  645    H    ARG  88           H        ARG  88  -6.022  -1.246  -7.085
  646    HA   ARG  88           HA       ARG  88  -5.368  -4.071  -6.750
  647   1HB   ARG  88          1HB       ARG  88  -4.555  -2.024  -8.790
  648   2HB   ARG  88          2HB       ARG  88  -3.788  -3.602  -8.651
  649   1HG   ARG  88          1HG       ARG  88  -5.679  -4.729  -9.266
  650   2HG   ARG  88          2HG       ARG  88  -6.750  -3.359  -8.938
  651   1HD   ARG  88          1HD       ARG  88  -6.491  -3.662 -11.292
  652   2HD   ARG  88          2HD       ARG  88  -5.738  -2.153 -10.761
  653    HE   ARG  88           HE       ARG  88  -3.989  -4.467 -11.024
  654   1HH1  ARG  88          11HH      ARG  88  -5.070  -1.381 -12.459
  655   2HH1  ARG  88          12HH      ARG  88  -3.795  -1.355 -13.596
  656   1HH2  ARG  88          21HH      ARG  88  -2.302  -4.374 -12.592
  657   2HH2  ARG  88          22HH      ARG  88  -2.194  -3.047 -13.664
  658    H    PHE  89           H        PHE  89  -4.367  -4.048  -4.824
  659    HA   PHE  89           HA       PHE  89  -2.202  -2.143  -4.356
  660   1HB   PHE  89          1HB       PHE  89  -3.131  -4.401  -2.575
  661   2HB   PHE  89          2HB       PHE  89  -2.007  -3.137  -2.176
  662    HD1  PHE  89           HD1      PHE  89  -5.493  -4.015  -2.573
  663    HD2  PHE  89           HD2      PHE  89  -2.734  -0.925  -1.694
  664    HE1  PHE  89           HE1      PHE  89  -7.306  -2.663  -1.620
  665    HE2  PHE  89           HE2      PHE  89  -4.519   0.420  -0.753
  666    HZ   PHE  89           HZ       PHE  89  -6.824  -0.453  -0.706
  667    H    VAL  90           H        VAL  90  -0.429  -2.800  -5.542
  668    HA   VAL  90           HA       VAL  90   0.192  -5.612  -5.436
  669    HB   VAL  90           HB       VAL  90   1.783  -3.326  -6.636
  670   1HG1  VAL  90          11HG      VAL  90   2.148  -6.317  -6.921
  671   2HG1  VAL  90          12HG      VAL  90   3.200  -5.229  -6.019
  672   3HG1  VAL  90          13HG      VAL  90   3.086  -5.090  -7.774
  673   1HG2  VAL  90          21HG      VAL  90  -0.325  -3.667  -7.798
  674   2HG2  VAL  90          22HG      VAL  90   0.049  -5.381  -7.997
  675   3HG2  VAL  90          23HG      VAL  90   1.031  -4.161  -8.811
  676    H    ILE  91           H        ILE  91   0.532  -5.889  -3.350
  677    HA   ILE  91           HA       ILE  91   2.713  -4.432  -2.074
  678    HB   ILE  91           HB       ILE  91   0.301  -5.926  -1.070
  679   1HG1  ILE  91          11HG      ILE  91   1.174  -3.099  -0.664
  680   2HG1  ILE  91          12HG      ILE  91   0.001  -3.616  -1.870
  681   1HG2  ILE  91          21HG      ILE  91   2.121  -6.512   0.428
  682   2HG2  ILE  91          22HG      ILE  91   0.976  -5.432   1.227
  683   3HG2  ILE  91          23HG      ILE  91   2.516  -4.804   0.638
  684   1HD1  ILE  91          11HD      ILE  91  -1.067  -2.719   0.025
  685   2HD1  ILE  91          12HD      ILE  91  -0.215  -3.887   1.072
  686   3HD1  ILE  91          13HD      ILE  91  -1.373  -4.458  -0.176
  687    H    GLY  92           H        GLY  92   4.175  -5.754  -0.911
  688   1HA   GLY  92          1HA       GLY  92   4.090  -8.484  -1.855
  689   2HA   GLY  92          2HA       GLY  92   5.620  -7.627  -1.673
  690    H    ARG  93           H        ARG  93   5.074  -9.992  -0.418
  691    HA   ARG  93           HA       ARG  93   5.110  -9.203   2.432
  692   1HB   ARG  93          1HB       ARG  93   2.984 -10.347   1.872
  693   2HB   ARG  93          2HB       ARG  93   3.912 -11.668   1.190
  694   1HG   ARG  93          1HG       ARG  93   2.973 -12.301   3.319
  695   2HG   ARG  93          2HG       ARG  93   4.728 -12.265   3.415
  696   1HD   ARG  93          1HD       ARG  93   3.116  -9.890   4.266
  697   2HD   ARG  93          2HD       ARG  93   3.279 -11.271   5.342
  698    HE   ARG  93           HE       ARG  93   5.794 -10.862   4.826
  699   1HH1  ARG  93          11HH      ARG  93   3.299  -8.402   5.534
  700   2HH1  ARG  93          12HH      ARG  93   4.358  -7.330   6.305
  701   1HH2  ARG  93          21HH      ARG  93   7.232  -9.389   5.941
  702   2HH2  ARG  93          22HH      ARG  93   6.671  -7.894   6.510
  703    H    GLU  94           H        GLU  94   7.076  -9.637   3.197
  704    HA   GLU  94           HA       GLU  94   8.662 -11.686   1.988
  705   1HB   GLU  94          1HB       GLU  94  10.413 -11.094   3.638
  706   2HB   GLU  94          2HB       GLU  94   9.817  -9.646   2.851
  707   1HG   GLU  94          1HG       GLU  94   8.493  -9.109   4.796
  708   2HG   GLU  94          2HG       GLU  94   9.015 -10.595   5.592
  Start of MODEL   16
    1   1H    GLY   1          1H        GLY   1  14.358 -15.014   1.439
    2   2H    GLY   1          2H        GLY   1  13.005 -15.830   1.995
    3   3H    GLY   1          3H        GLY   1  13.053 -14.125   2.017
    4   1HA   GLY   1          1HA       GLY   1  13.107 -15.813  -0.396
    5   2HA   GLY   1          2HA       GLY   1  11.694 -14.947   0.190
    6    H    HIS   2           H        HIS   2  11.809 -13.918  -1.945
    7    HA   HIS   2           HA       HIS   2  13.886 -11.815  -2.101
    8   1HB   HIS   2          1HB       HIS   2  12.227 -13.031  -4.319
    9   2HB   HIS   2          2HB       HIS   2  13.392 -11.735  -4.530
   10    HD1  HIS   2           HD1      HIS   2  13.110 -15.255  -4.957
   11    HD2  HIS   2           HD2      HIS   2  16.089 -12.692  -3.612
   12    HE1  HIS   2           HE1      HIS   2  15.278 -16.531  -5.172
   13    H    MET   3           H        MET   3  11.204 -11.910  -0.694
   14    HA   MET   3           HA       MET   3   9.443 -10.657  -0.213
   15   1HB   MET   3          1HB       MET   3  10.941  -8.747  -0.513
   16   2HB   MET   3          2HB       MET   3  10.543  -8.689  -2.219
   17   1HG   MET   3          1HG       MET   3   8.208  -8.176  -1.674
   18   2HG   MET   3          2HG       MET   3   8.585  -8.211   0.046
   19   1HE   MET   3          1HE       MET   3   7.701  -5.803   0.569
   20   2HE   MET   3          2HE       MET   3   7.109  -5.702  -1.089
   21   3HE   MET   3          3HE       MET   3   8.066  -4.385  -0.412
   22    H    GLU   4           H        GLU   4   7.557 -11.316  -0.742
   23    HA   GLU   4           HA       GLU   4   7.041 -12.090  -3.488
   24   1HB   GLU   4          1HB       GLU   4   6.453 -13.559  -1.527
   25   2HB   GLU   4          2HB       GLU   4   5.317 -12.296  -1.053
   26   1HG   GLU   4          1HG       GLU   4   4.003 -12.648  -3.035
   27   2HG   GLU   4          2HG       GLU   4   5.190 -13.782  -3.656
   28    H    LEU   5           H        LEU   5   6.438 -10.433  -4.772
   29    HA   LEU   5           HA       LEU   5   4.722  -8.365  -3.701
   30   1HB   LEU   5          1HB       LEU   5   5.812  -8.688  -6.502
   31   2HB   LEU   5          2HB       LEU   5   4.983  -7.279  -5.874
   32    HG   LEU   5           HG       LEU   5   7.160  -6.649  -5.953
   33   1HD1  LEU   5          11HD      LEU   5   6.225  -6.114  -3.815
   34   2HD1  LEU   5          12HD      LEU   5   7.970  -6.384  -3.702
   35   3HD1  LEU   5          13HD      LEU   5   6.847  -7.644  -3.183
   36   1HD2  LEU   5          21HD      LEU   5   8.192  -8.781  -6.461
   37   2HD2  LEU   5          22HD      LEU   5   8.036  -9.276  -4.777
   38   3HD2  LEU   5          23HD      LEU   5   9.099  -7.936  -5.208
   39    H    PHE   6           H        PHE   6   2.596  -8.506  -3.863
   40    HA   PHE   6           HA       PHE   6   1.476 -10.315  -5.837
   41   1HB   PHE   6          1HB       PHE   6  -0.182 -10.911  -4.000
   42   2HB   PHE   6          2HB       PHE   6   1.386 -11.711  -3.948
   43    HD1  PHE   6           HD1      PHE   6   2.788 -11.303  -2.027
   44    HD2  PHE   6           HD2      PHE   6  -0.799  -9.145  -2.557
   45    HE1  PHE   6           HE1      PHE   6   2.986 -10.474   0.263
   46    HE2  PHE   6           HE2      PHE   6  -0.635  -8.278  -0.238
   47    HZ   PHE   6           HZ       PHE   6   1.271  -8.945   1.172
   48    HA   PRO   7           HA       PRO   7  -1.499  -7.000  -6.288
   49   1HB   PRO   7          1HB       PRO   7  -3.138  -8.182  -7.921
   50   2HB   PRO   7          2HB       PRO   7  -1.504  -7.759  -8.431
   51   1HG   PRO   7          1HG       PRO   7  -2.535 -10.455  -7.537
   52   2HG   PRO   7          2HG       PRO   7  -1.500 -10.085  -8.944
   53   1HD   PRO   7          1HD       PRO   7  -0.627 -10.976  -6.482
   54   2HD   PRO   7          2HD       PRO   7   0.365 -10.016  -7.619
   55    H    VAL   8           H        VAL   8  -2.941  -6.506  -4.830
   56    HA   VAL   8           HA       VAL   8  -4.918  -8.531  -4.114
   57    HB   VAL   8           HB       VAL   8  -4.257  -6.056  -2.525
   58   1HG1  VAL   8          11HG      VAL   8  -6.478  -6.890  -2.092
   59   2HG1  VAL   8          12HG      VAL   8  -5.456  -7.187  -0.684
   60   3HG1  VAL   8          13HG      VAL   8  -5.845  -8.506  -1.787
   61   1HG2  VAL   8          21HG      VAL   8  -3.247  -8.855  -2.093
   62   2HG2  VAL   8          22HG      VAL   8  -3.065  -7.530  -0.936
   63   3HG2  VAL   8          23HG      VAL   8  -2.304  -7.433  -2.529
   64    H    GLU   9           H        GLU   9  -6.596  -8.129  -5.422
   65    HA   GLU   9           HA       GLU   9  -7.233  -5.354  -5.991
   66   1HB   GLU   9          1HB       GLU   9  -7.188  -6.992  -7.878
   67   2HB   GLU   9          2HB       GLU   9  -8.545  -7.831  -7.139
   68   1HG   GLU   9          1HG       GLU   9  -9.972  -5.934  -7.453
   69   2HG   GLU   9          2HG       GLU   9  -8.613  -4.948  -7.997
   70    H    LEU  10           H        LEU  10  -8.277  -4.417  -4.496
   71    HA   LEU  10           HA       LEU  10  -9.991  -5.881  -2.658
   72   1HB   LEU  10          1HB       LEU  10  -8.100  -4.000  -2.354
   73   2HB   LEU  10          2HB       LEU  10  -9.488  -2.960  -2.540
   74    HG   LEU  10           HG       LEU  10  -9.084  -3.176  -0.228
   75   1HD1  LEU  10          11HD      LEU  10 -11.429  -3.283  -0.780
   76   2HD1  LEU  10          12HD      LEU  10 -11.072  -4.193   0.684
   77   3HD1  LEU  10          13HD      LEU  10 -11.343  -5.039  -0.840
   78   1HD2  LEU  10          21HD      LEU  10  -8.893  -5.318   0.928
   79   2HD2  LEU  10          22HD      LEU  10  -7.627  -5.090  -0.279
   80   3HD2  LEU  10          23HD      LEU  10  -8.991  -6.152  -0.621
   81    H    GLU  11           H        GLU  11 -12.194  -5.455  -2.604
   82    HA   GLU  11           HA       GLU  11 -13.170  -3.367  -4.390
   83   1HB   GLU  11          1HB       GLU  11 -14.035  -5.564  -5.044
   84   2HB   GLU  11          2HB       GLU  11 -14.579  -5.867  -3.401
   85   1HG   GLU  11          1HG       GLU  11 -16.227  -4.106  -3.587
   86   2HG   GLU  11          2HG       GLU  11 -15.635  -3.694  -5.196
   87    H    LYS  12           H        LYS  12 -12.733  -1.795  -2.867
   88    HA   LYS  12           HA       LYS  12 -13.686  -1.968  -0.276
   89   1HB   LYS  12          1HB       LYS  12 -12.014  -0.202  -1.786
   90   2HB   LYS  12          2HB       LYS  12 -13.163   0.724  -0.853
   91   1HG   LYS  12          1HG       LYS  12 -11.524  -1.483   0.238
   92   2HG   LYS  12          2HG       LYS  12 -10.984   0.213   0.329
   93   1HD   LYS  12          1HD       LYS  12 -13.261   0.690   1.462
   94   2HD   LYS  12          2HD       LYS  12 -13.431  -1.050   1.601
   95   1HE   LYS  12          1HE       LYS  12 -11.947  -1.196   3.317
   96   2HE   LYS  12          2HE       LYS  12 -11.032   0.235   2.838
   97   1HZ   LYS  12          1HZ       LYS  12 -12.498   0.663   4.834
   98   2HZ   LYS  12          2HZ       LYS  12 -13.856   0.378   3.814
   99   3HZ   LYS  12          3HZ       LYS  12 -12.830   1.614   3.498
  100    H    ASP  13           H        ASP  13 -14.930  -0.188   0.688
  101    HA   ASP  13           HA       ASP  13 -17.565  -0.259  -0.410
  102   1HB   ASP  13          1HB       ASP  13 -18.133   0.708   1.846
  103   2HB   ASP  13          2HB       ASP  13 -17.360  -0.874   1.877
  104    H    GLU  14           H        GLU  14 -18.732   1.965   0.530
  105    HA   GLU  14           HA       GLU  14 -17.862   3.754  -1.524
  106   1HB   GLU  14          1HB       GLU  14 -19.881   5.007  -1.125
  107   2HB   GLU  14          2HB       GLU  14 -20.206   3.290  -1.317
  108   1HG   GLU  14          1HG       GLU  14 -20.504   3.092   1.098
  109   2HG   GLU  14          2HG       GLU  14 -20.142   4.809   1.281
  110    H    ASP  15           H        ASP  15 -17.075   3.563   1.697
  111    HA   ASP  15           HA       ASP  15 -16.764   6.408   2.113
  112   1HB   ASP  15          1HB       ASP  15 -17.008   4.988   4.088
  113   2HB   ASP  15          2HB       ASP  15 -15.596   4.052   3.616
  114    H    GLY  16           H        GLY  16 -14.749   3.687   1.310
  115   1HA   GLY  16          1HA       GLY  16 -13.054   4.202  -0.435
  116   2HA   GLY  16          2HA       GLY  16 -12.569   5.539   0.632
  117    H    LEU  17           H        LEU  17 -10.478   4.489   0.744
  118    HA   LEU  17           HA       LEU  17 -10.364   1.813   1.775
  119   1HB   LEU  17          1HB       LEU  17  -8.051   3.709   1.929
  120   2HB   LEU  17          2HB       LEU  17  -8.048   1.970   1.769
  121    HG   LEU  17           HG       LEU  17  -8.658   4.002  -0.277
  122   1HD1  LEU  17          11HD      LEU  17  -6.336   3.725   0.117
  123   2HD1  LEU  17          12HD      LEU  17  -6.712   2.951  -1.424
  124   3HD1  LEU  17          13HD      LEU  17  -6.473   1.973   0.026
  125   1HD2  LEU  17          21HD      LEU  17  -8.955   2.162  -1.888
  126   2HD2  LEU  17          22HD      LEU  17 -10.188   2.145  -0.628
  127   3HD2  LEU  17          23HD      LEU  17  -8.845   1.000  -0.562
  128    H    GLY  18           H        GLY  18  -9.641   5.012   2.988
  129   1HA   GLY  18          1HA       GLY  18  -9.549   5.871   5.106
  130   2HA   GLY  18          2HA       GLY  18 -10.451   4.454   5.641
  131    H    ILE  19           H        ILE  19  -7.455   4.180   3.911
  132    HA   ILE  19           HA       ILE  19  -6.349   3.001   6.347
  133    HB   ILE  19           HB       ILE  19  -4.819   1.708   5.046
  134   1HG1  ILE  19          11HG      ILE  19  -5.777   3.164   2.582
  135   2HG1  ILE  19          12HG      ILE  19  -4.243   3.488   3.387
  136   1HG2  ILE  19          21HG      ILE  19  -7.078   0.811   5.097
  137   2HG2  ILE  19          22HG      ILE  19  -6.333   0.452   3.535
  138   3HG2  ILE  19          23HG      ILE  19  -7.502   1.763   3.683
  139   1HD1  ILE  19          11HD      ILE  19  -5.057   0.897   2.075
  140   2HD1  ILE  19          12HD      ILE  19  -3.566   1.154   2.973
  141   3HD1  ILE  19          13HD      ILE  19  -3.854   2.049   1.486
  142    H    SER  20           H        SER  20  -3.838   3.186   6.418
  143    HA   SER  20           HA       SER  20  -3.078   5.964   5.853
  144   1HB   SER  20          1HB       SER  20  -2.662   4.529   8.490
  145   2HB   SER  20          2HB       SER  20  -2.232   6.197   8.131
  146    HG   SER  20           HG       SER  20  -4.356   5.488   9.258
  147    H    ILE  21           H        ILE  21  -0.913   6.244   5.574
  148    HA   ILE  21           HA       ILE  21   0.710   3.801   5.272
  149    HB   ILE  21           HB       ILE  21   1.954   5.005   3.550
  150   1HG1  ILE  21          11HG      ILE  21   0.485   7.156   2.678
  151   2HG1  ILE  21          12HG      ILE  21   0.233   7.238   4.392
  152   1HG2  ILE  21          21HG      ILE  21   0.266   5.024   1.781
  153   2HG2  ILE  21          22HG      ILE  21  -1.002   4.948   3.005
  154   3HG2  ILE  21          23HG      ILE  21   0.135   3.607   2.825
  155   1HD1  ILE  21          11HD      ILE  21   2.598   7.410   4.840
  156   2HD1  ILE  21          12HD      ILE  21   2.138   8.651   3.687
  157   3HD1  ILE  21          13HD      ILE  21   2.971   7.217   3.140
  158    H    ILE  22           H        ILE  22   3.013   4.139   5.696
  159    HA   ILE  22           HA       ILE  22   3.487   6.512   7.273
  160    HB   ILE  22           HB       ILE  22   3.212   4.736   8.853
  161   1HG1  ILE  22          11HG      ILE  22   6.141   5.482   8.665
  162   2HG1  ILE  22          12HG      ILE  22   4.877   6.470   9.380
  163   1HG2  ILE  22          21HG      ILE  22   3.705   2.815   7.543
  164   2HG2  ILE  22          22HG      ILE  22   4.729   2.799   8.981
  165   3HG2  ILE  22          23HG      ILE  22   5.401   3.289   7.420
  166   1HD1  ILE  22          11HD      ILE  22   4.542   4.774  11.113
  167   2HD1  ILE  22          12HD      ILE  22   6.200   5.364  11.084
  168   3HD1  ILE  22          13HD      ILE  22   5.814   3.791  10.387
  169    H    GLY  23           H        GLY  23   5.340   7.581   6.863
  170   1HA   GLY  23          1HA       GLY  23   6.814   6.601   4.564
  171   2HA   GLY  23          2HA       GLY  23   6.869   8.249   5.157
  172    H    MET  24           H        MET  24   8.204   5.161   5.214
  173    HA   MET  24           HA       MET  24  10.228   5.933   7.252
  174   1HB   MET  24          1HB       MET  24   9.424   3.189   6.244
  175   2HB   MET  24          2HB       MET  24  10.672   3.507   7.430
  176   1HG   MET  24          1HG       MET  24   7.727   4.067   7.798
  177   2HG   MET  24          2HG       MET  24   8.594   2.672   8.415
  178   1HE   MET  24          1HE       MET  24  10.356   2.718  10.350
  179   2HE   MET  24          2HE       MET  24  10.995   4.204  11.055
  180   3HE   MET  24          3HE       MET  24  11.352   3.805   9.378
  181    H    GLY  25           H        GLY  25  12.246   4.578   6.690
  182   1HA   GLY  25          1HA       GLY  25  12.717   4.482   3.795
  183   2HA   GLY  25          2HA       GLY  25  13.848   5.371   4.816
  184    H    VAL  26           H        VAL  26  12.612   2.235   3.963
  185    HA   VAL  26           HA       VAL  26  14.340   1.003   5.915
  186    HB   VAL  26           HB       VAL  26  12.061   0.122   5.784
  187   1HG1  VAL  26          11HG      VAL  26  11.555   0.506   3.453
  188   2HG1  VAL  26          12HG      VAL  26  11.270  -1.182   3.875
  189   3HG1  VAL  26          13HG      VAL  26  12.716  -0.731   2.977
  190   1HG2  VAL  26          21HG      VAL  26  14.129  -1.874   4.866
  191   2HG2  VAL  26          22HG      VAL  26  12.581  -2.280   5.602
  192   3HG2  VAL  26          23HG      VAL  26  13.793  -1.397   6.532
  193    H    GLY  27           H        GLY  27  16.261   0.429   5.511
  194   1HA   GLY  27          1HA       GLY  27  18.055  -0.490   4.524
  195   2HA   GLY  27          2HA       GLY  27  16.993  -1.114   3.270
  196    H    ALA  28           H        ALA  28  17.057   2.251   3.878
  197    HA   ALA  28           HA       ALA  28  17.727   2.896   1.211
  198   1HB   ALA  28          1HB       ALA  28  17.752   5.215   1.974
  199   2HB   ALA  28          2HB       ALA  28  17.757   4.675   3.652
  200   3HB   ALA  28          3HB       ALA  28  16.356   4.357   2.627
  201    H    ASP  29           H        ASP  29  19.552   2.830   4.167
  202    HA   ASP  29           HA       ASP  29  22.001   3.363   2.605
  203   1HB   ASP  29          1HB       ASP  29  21.500   3.833   5.554
  204   2HB   ASP  29          2HB       ASP  29  23.050   4.061   4.755
  205    H    ALA  30           H        ALA  30  20.385   0.888   3.416
  206    HA   ALA  30           HA       ALA  30  22.586  -0.569   4.715
  207   1HB   ALA  30          1HB       ALA  30  19.721  -1.468   4.608
  208   2HB   ALA  30          2HB       ALA  30  20.397  -0.503   5.920
  209   3HB   ALA  30          3HB       ALA  30  21.017  -2.123   5.609
  210    H    GLY  31           H        GLY  31  21.663  -0.039   1.715
  211   1HA   GLY  31          1HA       GLY  31  22.692  -1.248  -0.057
  212   2HA   GLY  31          2HA       GLY  31  22.589  -2.691   0.927
  213    H    LEU  32           H        LEU  32  19.670  -0.964   0.935
  214    HA   LEU  32           HA       LEU  32  18.624  -2.892  -1.013
  215   1HB   LEU  32          1HB       LEU  32  17.232  -1.507   1.275
  216   2HB   LEU  32          2HB       LEU  32  16.375  -2.376   0.036
  217    HG   LEU  32           HG       LEU  32  17.547  -4.472   0.777
  218   1HD1  LEU  32          11HD      LEU  32  18.599  -4.531   2.970
  219   2HD1  LEU  32          12HD      LEU  32  18.457  -2.777   3.096
  220   3HD1  LEU  32          13HD      LEU  32  19.494  -3.489   1.862
  221   1HD2  LEU  32          21HD      LEU  32  16.183  -4.757   2.779
  222   2HD2  LEU  32          22HD      LEU  32  15.287  -3.962   1.485
  223   3HD2  LEU  32          23HD      LEU  32  15.907  -3.018   2.839
  224    H    GLU  33           H        GLU  33  17.895   0.338   0.208
  225    HA   GLU  33           HA       GLU  33  16.821   2.076  -0.622
  226   1HB   GLU  33          1HB       GLU  33  18.344   1.371  -3.119
  227   2HB   GLU  33          2HB       GLU  33  17.374   2.823  -2.955
  228   1HG   GLU  33          1HG       GLU  33  18.782   3.398  -0.961
  229   2HG   GLU  33          2HG       GLU  33  19.839   2.066  -1.441
  230    H    LYS  34           H        LYS  34  14.837   1.357  -0.314
  231    HA   LYS  34           HA       LYS  34  13.344   1.010  -2.751
  232   1HB   LYS  34          1HB       LYS  34  12.260  -0.970  -2.102
  233   2HB   LYS  34          2HB       LYS  34  13.913  -1.288  -1.615
  234   1HG   LYS  34          1HG       LYS  34  13.023  -0.355   0.745
  235   2HG   LYS  34          2HG       LYS  34  11.508  -0.728   0.026
  236   1HD   LYS  34          1HD       LYS  34  13.698  -2.773   0.250
  237   2HD   LYS  34          2HD       LYS  34  12.350  -2.612   1.374
  238   1HE   LYS  34          1HE       LYS  34  10.777  -3.048  -0.434
  239   2HE   LYS  34          2HE       LYS  34  12.114  -3.143  -1.579
  240   1HZ   LYS  34          1HZ       LYS  34  12.948  -5.056  -0.384
  241   2HZ   LYS  34          2HZ       LYS  34  11.357  -5.323  -0.890
  242   3HZ   LYS  34          3HZ       LYS  34  11.675  -4.971   0.723
  243    H    LEU  35           H        LEU  35  11.023   1.138  -2.043
  244    HA   LEU  35           HA       LEU  35  10.441   3.552  -0.834
  245   1HB   LEU  35          1HB       LEU  35   8.171   2.844  -0.808
  246   2HB   LEU  35          2HB       LEU  35   8.926   2.282  -2.290
  247    HG   LEU  35           HG       LEU  35   8.644   0.475   0.095
  248   1HD1  LEU  35          11HD      LEU  35   6.682   0.916  -2.104
  249   2HD1  LEU  35          12HD      LEU  35   6.500   1.290  -0.366
  250   3HD1  LEU  35          13HD      LEU  35   6.667  -0.386  -0.901
  251   1HD2  LEU  35          21HD      LEU  35   8.942  -0.013  -2.847
  252   2HD2  LEU  35          22HD      LEU  35   8.584  -1.274  -1.668
  253   3HD2  LEU  35          23HD      LEU  35  10.114  -0.402  -1.581
  254    H    GLY  36           H        GLY  36   9.839   4.093   1.232
  255   1HA   GLY  36          1HA       GLY  36  10.074   1.995   3.261
  256   2HA   GLY  36          2HA       GLY  36  10.349   3.715   3.544
  257    H    ILE  37           H        ILE  37   7.729   2.854   1.527
  258    HA   ILE  37           HA       ILE  37   5.977   4.011   3.502
  259    HB   ILE  37           HB       ILE  37   5.283   3.081   0.708
  260   1HG1  ILE  37          11HG      ILE  37   7.002   4.891   0.838
  261   2HG1  ILE  37          12HG      ILE  37   5.514   5.415   0.020
  262   1HG2  ILE  37          21HG      ILE  37   3.351   3.185   2.187
  263   2HG2  ILE  37          22HG      ILE  37   3.279   4.551   1.061
  264   3HG2  ILE  37          23HG      ILE  37   3.825   4.786   2.725
  265   1HD1  ILE  37          11HD      ILE  37   6.363   7.140   1.451
  266   2HD1  ILE  37          12HD      ILE  37   6.480   5.999   2.790
  267   3HD1  ILE  37          13HD      ILE  37   4.893   6.483   2.188
  268    H    PHE  38           H        PHE  38   5.413   2.698   4.987
  269    HA   PHE  38           HA       PHE  38   4.579  -0.025   4.291
  270   1HB   PHE  38          1HB       PHE  38   5.245   1.255   6.922
  271   2HB   PHE  38          2HB       PHE  38   4.596  -0.370   6.788
  272    HD1  PHE  38           HD1      PHE  38   5.935  -2.129   5.715
  273    HD2  PHE  38           HD2      PHE  38   7.522   1.723   6.492
  274    HE1  PHE  38           HE1      PHE  38   8.196  -3.032   5.487
  275    HE2  PHE  38           HE2      PHE  38   9.805   0.840   6.262
  276    HZ   PHE  38           HZ       PHE  38  10.145  -1.548   5.759
  277    H    VAL  39           H        VAL  39   2.639  -0.837   5.385
  278    HA   VAL  39           HA       VAL  39   0.536   1.100   5.205
  279    HB   VAL  39           HB       VAL  39   0.412  -1.779   6.197
  280   1HG1  VAL  39          11HG      VAL  39  -1.979  -1.627   5.644
  281   2HG1  VAL  39          12HG      VAL  39  -1.757   0.064   5.200
  282   3HG1  VAL  39          13HG      VAL  39  -1.511  -0.445   6.870
  283   1HG2  VAL  39          21HG      VAL  39  -0.363  -2.365   3.940
  284   2HG2  VAL  39          22HG      VAL  39   1.270  -1.700   3.909
  285   3HG2  VAL  39          23HG      VAL  39  -0.097  -0.701   3.425
  286    H    LYS  40           H        LYS  40   0.087   2.385   6.803
  287    HA   LYS  40           HA       LYS  40   1.267   1.951   9.389
  288   1HB   LYS  40          1HB       LYS  40   1.369   4.176   8.437
  289   2HB   LYS  40          2HB       LYS  40  -0.355   4.214   8.237
  290   1HG   LYS  40          1HG       LYS  40   0.171   5.675  10.031
  291   2HG   LYS  40          2HG       LYS  40  -0.588   4.252  10.724
  292   1HD   LYS  40          1HD       LYS  40   2.418   4.655  10.675
  293   2HD   LYS  40          2HD       LYS  40   1.397   5.237  11.975
  294   1HE   LYS  40          1HE       LYS  40   0.613   2.875  12.290
  295   2HE   LYS  40          2HE       LYS  40   1.810   2.405  11.103
  296   1HZ   LYS  40          1HZ       LYS  40   2.546   3.852  13.577
  297   2HZ   LYS  40          2HZ       LYS  40   3.600   3.029  12.544
  298   3HZ   LYS  40          3HZ       LYS  40   2.491   2.201  13.488
  299    H    THR  41           H        THR  41  -1.902   2.076   7.895
  300    HA   THR  41           HA       THR  41  -3.079   0.555  10.051
  301    HB   THR  41           HB       THR  41  -4.495   2.911   9.139
  302    HG1  THR  41           HG1      THR  41  -2.417   2.900  11.122
  303   1HG2  THR  41          21HG      THR  41  -5.481   2.869  11.430
  304   2HG2  THR  41          22HG      THR  41  -4.452   1.480  11.784
  305   3HG2  THR  41          23HG      THR  41  -5.682   1.373  10.517
  306    H    VAL  42           H        VAL  42  -5.165  -0.183   9.256
  307    HA   VAL  42           HA       VAL  42  -5.744   0.482   6.535
  308    HB   VAL  42           HB       VAL  42  -4.452  -1.494   6.142
  309   1HG1  VAL  42          11HG      VAL  42  -4.498  -2.378   8.356
  310   2HG1  VAL  42          12HG      VAL  42  -4.960  -3.649   7.197
  311   3HG1  VAL  42          13HG      VAL  42  -6.195  -2.810   8.172
  312   1HG2  VAL  42          21HG      VAL  42  -6.072  -2.966   5.055
  313   2HG2  VAL  42          22HG      VAL  42  -6.522  -1.255   4.866
  314   3HG2  VAL  42          23HG      VAL  42  -7.372  -2.255   6.025
  315    H    THR  43           H        THR  43  -7.448   1.440   6.876
  316    HA   THR  43           HA       THR  43  -9.523   2.095   7.349
  317    HB   THR  43           HB       THR  43  -9.944   0.408   5.555
  318    HG1  THR  43           HG1      THR  43 -11.683   1.670   6.548
  319   1HG2  THR  43          21HG      THR  43 -10.712  -1.403   7.821
  320   2HG2  THR  43          22HG      THR  43  -9.366  -1.631   6.699
  321   3HG2  THR  43          23HG      THR  43 -11.034  -1.727   6.117
  322    H    GLU  44           H        GLU  44 -11.576   1.863   8.727
  323    HA   GLU  44           HA       GLU  44 -10.926   1.334  11.415
  324   1HB   GLU  44          1HB       GLU  44 -13.298   1.803  11.776
  325   2HB   GLU  44          2HB       GLU  44 -12.559   3.035  10.756
  326   1HG   GLU  44          1HG       GLU  44 -13.556   2.116   8.822
  327   2HG   GLU  44          2HG       GLU  44 -14.065   0.686   9.710
  328    H    GLY  45           H        GLY  45 -12.328  -0.304   8.811
  329   1HA   GLY  45          1HA       GLY  45 -11.942  -2.804   9.137
  330   2HA   GLY  45          2HA       GLY  45 -13.162  -2.616  10.419
  331    H    GLY  46           H        GLY  46 -12.985  -0.981   7.234
  332   1HA   GLY  46          1HA       GLY  46 -15.565  -2.002   6.613
  333   2HA   GLY  46          2HA       GLY  46 -14.586  -0.876   5.669
  334    H    ALA  47           H        ALA  47 -14.840  -1.985   3.834
  335    HA   ALA  47           HA       ALA  47 -14.650  -4.767   3.568
  336   1HB   ALA  47          1HB       ALA  47 -14.740  -4.476   1.193
  337   2HB   ALA  47          2HB       ALA  47 -14.268  -2.788   1.357
  338   3HB   ALA  47          3HB       ALA  47 -15.824  -3.328   1.981
  339    H    ALA  48           H        ALA  48 -12.066  -2.750   4.047
  340    HA   ALA  48           HA       ALA  48 -10.135  -4.247   2.444
  341   1HB   ALA  48          1HB       ALA  48  -9.600  -2.127   4.535
  342   2HB   ALA  48          2HB       ALA  48  -9.748  -1.839   2.802
  343   3HB   ALA  48          3HB       ALA  48  -8.415  -2.811   3.423
  344    H    GLN  49           H        GLN  49 -10.416  -3.643   5.973
  345    HA   GLN  49           HA       GLN  49  -8.942  -5.939   6.612
  346   1HB   GLN  49          1HB       GLN  49 -10.940  -4.397   8.242
  347   2HB   GLN  49          2HB       GLN  49 -10.126  -5.819   8.884
  348   1HG   GLN  49          1HG       GLN  49  -7.960  -4.681   8.374
  349   2HG   GLN  49          2HG       GLN  49  -8.898  -3.235   7.985
  350   1HE2  GLN  49          21HE      GLN  49  -9.866  -2.091   9.654
  351   2HE2  GLN  49          22HE      GLN  49  -9.512  -2.416  11.304
  352    H    ARG  50           H        ARG  50 -12.328  -5.612   5.809
  353    HA   ARG  50           HA       ARG  50 -13.106  -8.154   6.703
  354   1HB   ARG  50          1HB       ARG  50 -14.243  -6.505   4.463
  355   2HB   ARG  50          2HB       ARG  50 -14.984  -7.964   5.097
  356   1HG   ARG  50          1HG       ARG  50 -14.349  -5.556   6.711
  357   2HG   ARG  50          2HG       ARG  50 -15.959  -5.863   6.012
  358   1HD   ARG  50          1HD       ARG  50 -14.459  -7.487   8.077
  359   2HD   ARG  50          2HD       ARG  50 -15.871  -6.476   8.356
  360    HE   ARG  50           HE       ARG  50 -16.800  -8.181   6.555
  361   1HH1  ARG  50          11HH      ARG  50 -14.986  -8.713   9.556
  362   2HH1  ARG  50          12HH      ARG  50 -15.659 -10.235   9.873
  363   1HH2  ARG  50          21HH      ARG  50 -17.743 -10.319   6.993
  364   2HH2  ARG  50          22HH      ARG  50 -17.240 -11.172   8.380
  365    H    ASP  51           H        ASP  51 -11.644  -6.996   3.725
  366    HA   ASP  51           HA       ASP  51 -11.823  -9.249   2.097
  367   1HB   ASP  51          1HB       ASP  51 -10.980  -7.184   1.199
  368   2HB   ASP  51          2HB       ASP  51  -9.659  -7.165   2.356
  369    H    GLY  52           H        GLY  52  -9.194  -8.378   4.290
  370   1HA   GLY  52          1HA       GLY  52  -8.121  -9.779   5.808
  371   2HA   GLY  52          2HA       GLY  52  -8.977 -11.138   5.113
  372    H    ARG  53           H        ARG  53  -7.674  -9.764   2.437
  373    HA   ARG  53           HA       ARG  53  -5.425 -11.595   2.577
  374   1HB   ARG  53          1HB       ARG  53  -7.050 -11.228   0.542
  375   2HB   ARG  53          2HB       ARG  53  -6.110  -9.782   0.250
  376   1HG   ARG  53          1HG       ARG  53  -5.067 -12.618   0.232
  377   2HG   ARG  53          2HG       ARG  53  -5.411 -11.632  -1.180
  378   1HD   ARG  53          1HD       ARG  53  -3.669 -10.059  -0.494
  379   2HD   ARG  53          2HD       ARG  53  -3.340 -11.046   0.923
  380    HE   ARG  53           HE       ARG  53  -3.090 -12.140  -1.767
  381   1HH1  ARG  53          11HH      ARG  53  -1.554 -11.313   1.357
  382   2HH1  ARG  53          12HH      ARG  53  -0.120 -12.154   1.005
  383   1HH2  ARG  53          21HH      ARG  53  -1.057 -13.275  -2.201
  384   2HH2  ARG  53          22HH      ARG  53   0.167 -13.270  -1.029
  385    H    ILE  54           H        ILE  54  -6.155  -8.188   2.195
  386    HA   ILE  54           HA       ILE  54  -3.386  -7.376   2.305
  387    HB   ILE  54           HB       ILE  54  -5.223  -6.029   1.116
  388   1HG1  ILE  54          11HG      ILE  54  -3.665  -4.527   3.245
  389   2HG1  ILE  54          12HG      ILE  54  -3.000  -5.060   1.709
  390   1HG2  ILE  54          21HG      ILE  54  -5.942  -5.383   3.963
  391   2HG2  ILE  54          22HG      ILE  54  -6.977  -6.201   2.785
  392   3HG2  ILE  54          23HG      ILE  54  -6.561  -4.493   2.568
  393   1HD1  ILE  54          11HD      ILE  54  -5.233  -3.063   2.059
  394   2HD1  ILE  54          12HD      ILE  54  -4.531  -3.590   0.523
  395   3HD1  ILE  54          13HD      ILE  54  -3.549  -2.698   1.670
  396    H    GLN  55           H        GLN  55  -2.441  -6.194   4.134
  397    HA   GLN  55           HA       GLN  55  -3.908  -6.488   6.610
  398   1HB   GLN  55          1HB       GLN  55  -1.080  -7.397   6.153
  399   2HB   GLN  55          2HB       GLN  55  -1.847  -7.318   7.721
  400   1HG   GLN  55          1HG       GLN  55  -3.362  -9.091   7.143
  401   2HG   GLN  55          2HG       GLN  55  -2.809  -9.069   5.470
  402   1HE2  GLN  55          21HE      GLN  55  -0.006  -8.817   6.001
  403   2HE2  GLN  55          22HE      GLN  55   0.527 -10.283   6.700
  404    H    VAL  56           H        VAL  56  -2.668  -5.317   8.385
  405    HA   VAL  56           HA       VAL  56  -1.651  -2.741   7.517
  406    HB   VAL  56           HB       VAL  56  -3.153  -3.122   9.554
  407   1HG1  VAL  56          11HG      VAL  56  -2.179  -5.095  10.471
  408   2HG1  VAL  56          12HG      VAL  56  -2.098  -3.797  11.665
  409   3HG1  VAL  56          13HG      VAL  56  -0.655  -4.262  10.760
  410   1HG2  VAL  56          21HG      VAL  56  -2.007  -1.468  10.980
  411   2HG2  VAL  56          22HG      VAL  56  -1.982  -1.014   9.279
  412   3HG2  VAL  56          23HG      VAL  56  -0.538  -1.696  10.030
  413    H    ASN  57           H        ASN  57  -0.450  -5.738   7.968
  414    HA   ASN  57           HA       ASN  57   2.020  -5.027   9.254
  415   1HB   ASN  57          1HB       ASN  57   0.724  -7.083   9.820
  416   2HB   ASN  57          2HB       ASN  57   1.065  -7.700   8.216
  417   1HD2  ASN  57          21HD      ASN  57   3.274  -5.988  10.385
  418   2HD2  ASN  57          22HD      ASN  57   4.368  -7.308  10.559
  419    H    ASP  58           H        ASP  58   0.993  -4.664   6.235
  420    HA   ASP  58           HA       ASP  58   3.392  -5.758   4.977
  421   1HB   ASP  58          1HB       ASP  58   0.638  -5.278   3.863
  422   2HB   ASP  58          2HB       ASP  58   2.024  -5.670   2.856
  423    H    GLN  59           H        GLN  59   3.244  -4.395   2.540
  424    HA   GLN  59           HA       GLN  59   3.720  -1.599   3.240
  425   1HB   GLN  59          1HB       GLN  59   5.881  -2.527   3.419
  426   2HB   GLN  59          2HB       GLN  59   5.586  -3.604   2.061
  427   1HG   GLN  59          1HG       GLN  59   5.869  -1.884   0.496
  428   2HG   GLN  59          2HG       GLN  59   5.774  -0.634   1.734
  429   1HE2  GLN  59          21HE      GLN  59   7.535  -0.165   2.904
  430   2HE2  GLN  59          22HE      GLN  59   9.129  -0.736   2.524
  431    H    ILE  60           H        ILE  60   2.916  -0.183   1.696
  432    HA   ILE  60           HA       ILE  60   1.448  -1.240  -0.544
  433    HB   ILE  60           HB       ILE  60   2.151   1.656  -0.008
  434   1HG1  ILE  60          11HG      ILE  60   0.849   0.821   1.918
  435   2HG1  ILE  60          12HG      ILE  60  -0.102   1.903   0.894
  436   1HG2  ILE  60          21HG      ILE  60   0.295   2.157  -1.498
  437   2HG2  ILE  60          22HG      ILE  60  -0.041   0.436  -1.648
  438   3HG2  ILE  60          23HG      ILE  60   1.455   1.082  -2.304
  439   1HD1  ILE  60          11HD      ILE  60  -1.432   0.021   1.658
  440   2HD1  ILE  60          12HD      ILE  60  -0.282  -1.087   0.920
  441   3HD1  ILE  60          13HD      ILE  60  -1.237  -0.001  -0.098
  442    H    VAL  61           H        VAL  61   2.607  -1.943  -2.259
  443    HA   VAL  61           HA       VAL  61   5.126  -0.620  -2.939
  444    HB   VAL  61           HB       VAL  61   3.829  -3.142  -4.009
  445   1HG1  VAL  61          11HG      VAL  61   5.231  -2.161  -5.705
  446   2HG1  VAL  61          12HG      VAL  61   5.875  -3.674  -5.068
  447   3HG1  VAL  61          13HG      VAL  61   6.601  -2.131  -4.572
  448   1HG2  VAL  61          21HG      VAL  61   5.579  -4.321  -2.788
  449   2HG2  VAL  61          22HG      VAL  61   4.525  -3.392  -1.729
  450   3HG2  VAL  61          23HG      VAL  61   6.140  -2.787  -2.118
  451    H    GLU  62           H        GLU  62   2.092  -1.497  -4.524
  452    HA   GLU  62           HA       GLU  62   2.292   0.868  -6.237
  453   1HB   GLU  62          1HB       GLU  62   3.309  -0.916  -7.545
  454   2HB   GLU  62          2HB       GLU  62   1.929  -1.950  -7.246
  455   1HG   GLU  62          1HG       GLU  62   0.498  -0.340  -8.447
  456   2HG   GLU  62          2HG       GLU  62   1.942   0.609  -8.779
  457    H    VAL  63           H        VAL  63   0.351   1.825  -6.160
  458    HA   VAL  63           HA       VAL  63  -1.911   0.069  -5.787
  459    HB   VAL  63           HB       VAL  63  -1.351   2.718  -4.455
  460   1HG1  VAL  63          11HG      VAL  63  -3.328   3.162  -5.815
  461   2HG1  VAL  63          12HG      VAL  63  -3.715   3.111  -4.092
  462   3HG1  VAL  63          13HG      VAL  63  -4.128   1.741  -5.140
  463   1HG2  VAL  63          21HG      VAL  63  -2.858   0.244  -3.704
  464   2HG2  VAL  63          22HG      VAL  63  -2.398   1.573  -2.641
  465   3HG2  VAL  63          23HG      VAL  63  -1.158   0.533  -3.362
  466    H    ASP  64           H        ASP  64  -3.252  -0.053  -7.263
  467    HA   ASP  64           HA       ASP  64  -4.653   0.352  -8.947
  468   1HB   ASP  64          1HB       ASP  64  -5.211   2.477  -7.831
  469   2HB   ASP  64          2HB       ASP  64  -3.892   3.270  -8.671
  470    H    GLY  65           H        GLY  65  -1.557   0.895  -9.158
  471   1HA   GLY  65          1HA       GLY  65  -0.271   0.120 -11.070
  472   2HA   GLY  65          2HA       GLY  65  -1.523   0.844 -12.095
  473    H    ILE  66           H        ILE  66  -0.825   2.776  -9.438
  474    HA   ILE  66           HA       ILE  66   0.363   4.784 -11.075
  475    HB   ILE  66           HB       ILE  66  -1.201   5.033  -8.909
  476   1HG1  ILE  66          11HG      ILE  66   1.155   6.877  -9.356
  477   2HG1  ILE  66          12HG      ILE  66  -0.276   6.843 -10.383
  478   1HG2  ILE  66          21HG      ILE  66   0.276   3.887  -7.369
  479   2HG2  ILE  66          22HG      ILE  66   0.097   5.586  -6.899
  480   3HG2  ILE  66          23HG      ILE  66   1.563   5.041  -7.716
  481   1HD1  ILE  66          11HD      ILE  66  -0.172   7.531  -7.475
  482   2HD1  ILE  66          12HD      ILE  66  -1.635   7.458  -8.454
  483   3HD1  ILE  66          13HD      ILE  66  -0.394   8.669  -8.809
  484    H    SER  67           H        SER  67   1.565   2.212  -9.370
  485    HA   SER  67           HA       SER  67   3.541   1.524  -8.421
  486   1HB   SER  67          1HB       SER  67   4.393   3.086 -10.746
  487   2HB   SER  67          2HB       SER  67   5.434   1.837  -9.984
  488    HG   SER  67           HG       SER  67   3.599   0.335 -10.628
  489    H    LEU  68           H        LEU  68   3.537   2.557  -6.485
  490    HA   LEU  68           HA       LEU  68   4.876   5.143  -6.402
  491   1HB   LEU  68          1HB       LEU  68   3.797   5.450  -4.246
  492   2HB   LEU  68          2HB       LEU  68   2.626   5.104  -5.496
  493    HG   LEU  68           HG       LEU  68   3.178   2.637  -4.440
  494   1HD1  LEU  68          11HD      LEU  68   2.913   2.880  -2.018
  495   2HD1  LEU  68          12HD      LEU  68   3.041   4.637  -2.194
  496   3HD1  LEU  68          13HD      LEU  68   4.407   3.614  -2.609
  497   1HD2  LEU  68          21HD      LEU  68   0.928   2.834  -3.506
  498   2HD2  LEU  68          22HD      LEU  68   1.091   3.425  -5.164
  499   3HD2  LEU  68          23HD      LEU  68   0.976   4.583  -3.828
  500    H    VAL  69           H        VAL  69   5.731   2.299  -6.452
  501    HA   VAL  69           HA       VAL  69   7.244   1.700  -4.182
  502    HB   VAL  69           HB       VAL  69   6.722  -0.010  -5.808
  503   1HG1  VAL  69          11HG      VAL  69   8.477   1.427  -7.761
  504   2HG1  VAL  69          12HG      VAL  69   6.724   1.242  -7.837
  505   3HG1  VAL  69          13HG      VAL  69   7.769  -0.172  -8.001
  506   1HG2  VAL  69          21HG      VAL  69   9.677   0.434  -5.467
  507   2HG2  VAL  69          22HG      VAL  69   9.015  -1.000  -6.242
  508   3HG2  VAL  69          23HG      VAL  69   8.599  -0.658  -4.570
  509    H    GLY  70           H        GLY  70   8.047   3.674  -3.631
  510   1HA   GLY  70          1HA       GLY  70  10.390   4.444  -3.235
  511   2HA   GLY  70          2HA       GLY  70  10.540   4.486  -4.992
  512    H    VAL  71           H        VAL  71   7.952   5.630  -2.804
  513    HA   VAL  71           HA       VAL  71   8.448   8.338  -3.788
  514    HB   VAL  71           HB       VAL  71   6.050   8.851  -3.731
  515   1HG1  VAL  71          11HG      VAL  71   6.937   8.104  -5.842
  516   2HG1  VAL  71          12HG      VAL  71   5.278   7.540  -5.636
  517   3HG1  VAL  71          13HG      VAL  71   6.624   6.424  -5.409
  518   1HG2  VAL  71          21HG      VAL  71   4.363   7.144  -3.352
  519   2HG2  VAL  71          22HG      VAL  71   5.419   7.280  -1.949
  520   3HG2  VAL  71          23HG      VAL  71   5.617   5.934  -3.072
  521    H    THR  72           H        THR  72   7.062   9.874  -2.236
  522    HA   THR  72           HA       THR  72   8.062   9.312   0.414
  523    HB   THR  72           HB       THR  72   7.196  11.663   0.788
  524    HG1  THR  72           HG1      THR  72   7.305  11.944  -2.016
  525   1HG2  THR  72          21HG      THR  72   9.554  11.158   0.475
  526   2HG2  THR  72          22HG      THR  72   9.152  12.648  -0.385
  527   3HG2  THR  72          23HG      THR  72   9.348  11.136  -1.276
  528    H    GLN  73           H        GLN  73   6.608  10.207   2.182
  529    HA   GLN  73           HA       GLN  73   4.327   8.575   2.272
  530   1HB   GLN  73          1HB       GLN  73   4.067   9.172   4.515
  531   2HB   GLN  73          2HB       GLN  73   5.758   9.547   4.262
  532   1HG   GLN  73          1HG       GLN  73   3.521  11.540   4.192
  533   2HG   GLN  73          2HG       GLN  73   4.545  11.246   5.592
  534   1HE2  GLN  73          21HE      GLN  73   6.986  10.949   4.010
  535   2HE2  GLN  73          22HE      GLN  73   7.360  12.525   3.458
  536    H    ASN  74           H        ASN  74   4.785  11.932   1.473
  537    HA   ASN  74           HA       ASN  74   2.024  12.574   1.604
  538   1HB   ASN  74          1HB       ASN  74   2.582  14.696   0.469
  539   2HB   ASN  74          2HB       ASN  74   3.670  14.389   1.813
  540   1HD2  ASN  74          21HD      ASN  74   5.838  14.227   1.415
  541   2HD2  ASN  74          22HD      ASN  74   6.518  14.389  -0.158
  542    H    PHE  75           H        PHE  75   4.090  11.292  -0.880
  543    HA   PHE  75           HA       PHE  75   2.219  11.683  -2.985
  544   1HB   PHE  75          1HB       PHE  75   4.672  11.204  -3.344
  545   2HB   PHE  75          2HB       PHE  75   4.354   9.555  -2.820
  546    HD1  PHE  75           HD1      PHE  75   4.252  11.862  -5.561
  547    HD2  PHE  75           HD2      PHE  75   2.739   8.115  -4.211
  548    HE1  PHE  75           HE1      PHE  75   3.613  11.276  -7.865
  549    HE2  PHE  75           HE2      PHE  75   2.108   7.533  -6.482
  550    HZ   PHE  75           HZ       PHE  75   2.547   9.109  -8.334
  551    H    ALA  76           H        ALA  76   3.160   8.893  -1.026
  552    HA   ALA  76           HA       ALA  76   1.300   7.092  -2.033
  553   1HB   ALA  76          1HB       ALA  76   1.733   5.757  -0.068
  554   2HB   ALA  76          2HB       ALA  76   2.464   7.149   0.740
  555   3HB   ALA  76          3HB       ALA  76   3.228   6.453  -0.695
  556    H    ALA  77           H        ALA  77   1.008   9.198   0.835
  557    HA   ALA  77           HA       ALA  77  -1.505   8.306   1.655
  558   1HB   ALA  77          1HB       ALA  77  -0.341  11.063   2.009
  559   2HB   ALA  77          2HB       ALA  77   0.013   9.670   3.027
  560   3HB   ALA  77          3HB       ALA  77  -1.619  10.330   2.983
  561    H    THR  78           H        THR  78  -0.628  10.455  -0.898
  562    HA   THR  78           HA       THR  78  -3.230  11.564  -1.287
  563    HB   THR  78           HB       THR  78  -0.764  11.474  -3.023
  564    HG1  THR  78           HG1      THR  78  -0.224  12.920  -1.631
  565   1HG2  THR  78          21HG      THR  78  -3.309  13.070  -3.434
  566   2HG2  THR  78          22HG      THR  78  -2.737  11.720  -4.417
  567   3HG2  THR  78          23HG      THR  78  -1.824  13.230  -4.387
  568    H    VAL  79           H        VAL  79  -1.340   8.975  -2.797
  569    HA   VAL  79           HA       VAL  79  -3.217   8.245  -4.768
  570    HB   VAL  79           HB       VAL  79  -1.318   6.317  -3.383
  571   1HG1  VAL  79          11HG      VAL  79  -3.005   5.263  -4.769
  572   2HG1  VAL  79          12HG      VAL  79  -1.402   5.075  -5.457
  573   3HG1  VAL  79          13HG      VAL  79  -2.519   6.253  -6.141
  574   1HG2  VAL  79          21HG      VAL  79  -0.059   8.236  -4.109
  575   2HG2  VAL  79          22HG      VAL  79  -0.833   8.181  -5.686
  576   3HG2  VAL  79          23HG      VAL  79   0.261   6.877  -5.190
  577    H    LEU  80           H        LEU  80  -2.635   6.892  -1.535
  578    HA   LEU  80           HA       LEU  80  -4.792   5.069  -1.627
  579   1HB   LEU  80          1HB       LEU  80  -3.159   6.135   0.666
  580   2HB   LEU  80          2HB       LEU  80  -4.468   5.008   0.921
  581    HG   LEU  80           HG       LEU  80  -2.476   3.746   0.966
  582   1HD1  LEU  80          11HD      LEU  80  -3.568   3.330  -1.784
  583   2HD1  LEU  80          12HD      LEU  80  -4.342   2.805  -0.303
  584   3HD1  LEU  80          13HD      LEU  80  -2.757   2.152  -0.739
  585   1HD2  LEU  80          21HD      LEU  80  -0.964   5.324  -0.129
  586   2HD2  LEU  80          22HD      LEU  80  -1.691   4.929  -1.688
  587   3HD2  LEU  80          23HD      LEU  80  -0.804   3.698  -0.788
  588    H    ARG  81           H        ARG  81  -4.903   8.341  -1.404
  589    HA   ARG  81           HA       ARG  81  -7.362   8.549   0.190
  590   1HB   ARG  81          1HB       ARG  81  -5.586  10.282   0.367
  591   2HB   ARG  81          2HB       ARG  81  -5.777  10.620  -1.343
  592   1HG   ARG  81          1HG       ARG  81  -8.236  11.131  -0.713
  593   2HG   ARG  81          2HG       ARG  81  -7.604  11.261   0.925
  594   1HD   ARG  81          1HD       ARG  81  -5.929  12.900   0.132
  595   2HD   ARG  81          2HD       ARG  81  -6.637  12.792  -1.475
  596    HE   ARG  81           HE       ARG  81  -8.389  13.573   0.728
  597   1HH1  ARG  81          11HH      ARG  81  -6.614  14.615  -2.163
  598   2HH1  ARG  81          12HH      ARG  81  -7.428  16.092  -2.294
  599   1HH2  ARG  81          21HH      ARG  81  -9.479  15.642   0.540
  600   2HH2  ARG  81          22HH      ARG  81  -9.056  16.711  -0.710
  601    H    ASN  82           H        ASN  82  -6.087   8.801  -3.039
  602    HA   ASN  82           HA       ASN  82  -8.518   9.810  -4.193
  603   1HB   ASN  82          1HB       ASN  82  -5.728   9.545  -5.055
  604   2HB   ASN  82          2HB       ASN  82  -6.959   9.664  -6.300
  605   1HD2  ASN  82          21HD      ASN  82  -5.385  11.238  -3.660
  606   2HD2  ASN  82          22HD      ASN  82  -6.033  12.817  -3.994
  607    H    THR  83           H        THR  83  -7.682   6.856  -3.427
  608    HA   THR  83           HA       THR  83  -8.057   5.353  -5.785
  609    HB   THR  83           HB       THR  83  -8.438   3.571  -3.893
  610    HG1  THR  83           HG1      THR  83  -8.644   4.782  -2.102
  611   1HG2  THR  83          21HG      THR  83  -5.996   3.406  -3.636
  612   2HG2  THR  83          22HG      THR  83  -5.818   5.040  -4.268
  613   3HG2  THR  83          23HG      THR  83  -6.421   3.754  -5.311
  614    H    LYS  84           H        LYS  84  -9.820   3.975  -6.246
  615    HA   LYS  84           HA       LYS  84 -12.363   4.776  -5.077
  616   1HB   LYS  84          1HB       LYS  84 -13.364   3.918  -7.323
  617   2HB   LYS  84          2HB       LYS  84 -12.560   5.470  -7.310
  618   1HG   LYS  84          1HG       LYS  84 -11.916   4.360  -9.309
  619   2HG   LYS  84          2HG       LYS  84 -10.529   4.323  -8.227
  620   1HD   LYS  84          1HD       LYS  84 -11.097   2.000  -7.620
  621   2HD   LYS  84          2HD       LYS  84 -12.458   2.062  -8.736
  622   1HE   LYS  84          1HE       LYS  84  -9.553   2.387  -9.493
  623   2HE   LYS  84          2HE       LYS  84 -10.502   0.926  -9.710
  624   1HZ   LYS  84          1HZ       LYS  84 -10.992   3.536 -11.078
  625   2HZ   LYS  84          2HZ       LYS  84 -11.942   2.144 -11.240
  626   3HZ   LYS  84          3HZ       LYS  84 -10.351   2.121 -11.745
  627    H    GLY  85           H        GLY  85 -13.989   2.667  -5.972
  628   1HA   GLY  85          1HA       GLY  85 -13.777   0.858  -3.930
  629   2HA   GLY  85          2HA       GLY  85 -14.657   0.569  -5.413
  630    H    ASN  86           H        ASN  86 -13.008  -0.058  -7.284
  631    HA   ASN  86           HA       ASN  86 -11.680  -2.424  -6.274
  632   1HB   ASN  86          1HB       ASN  86 -11.962  -1.430  -9.106
  633   2HB   ASN  86          2HB       ASN  86 -11.157  -2.936  -8.666
  634   1HD2  ASN  86          21HD      ASN  86 -12.451  -4.652  -7.831
  635   2HD2  ASN  86          22HD      ASN  86 -14.150  -4.691  -8.136
  636    H    VAL  87           H        VAL  87  -9.840  -2.191  -5.370
  637    HA   VAL  87           HA       VAL  87  -7.883  -0.317  -6.551
  638    HB   VAL  87           HB       VAL  87  -7.533  -1.436  -3.848
  639   1HG1  VAL  87          11HG      VAL  87  -6.807   1.193  -5.091
  640   2HG1  VAL  87          12HG      VAL  87  -5.751  -0.191  -4.796
  641   3HG1  VAL  87          13HG      VAL  87  -6.435   0.700  -3.435
  642   1HG2  VAL  87          21HG      VAL  87  -9.342   0.887  -4.441
  643   2HG2  VAL  87          22HG      VAL  87  -8.799   0.351  -2.831
  644   3HG2  VAL  87          23HG      VAL  87  -9.799  -0.708  -3.833
  645    H    ARG  88           H        ARG  88  -6.157  -1.272  -7.430
  646    HA   ARG  88           HA       ARG  88  -5.492  -3.983  -6.560
  647   1HB   ARG  88          1HB       ARG  88  -4.386  -2.346  -8.816
  648   2HB   ARG  88          2HB       ARG  88  -3.634  -3.834  -8.268
  649   1HG   ARG  88          1HG       ARG  88  -4.886  -4.603  -9.955
  650   2HG   ARG  88          2HG       ARG  88  -5.975  -4.830  -8.620
  651   1HD   ARG  88          1HD       ARG  88  -7.168  -3.818 -10.518
  652   2HD   ARG  88          2HD       ARG  88  -7.166  -2.776  -9.096
  653    HE   ARG  88           HE       ARG  88  -5.003  -1.973 -10.540
  654   1HH1  ARG  88          11HH      ARG  88  -8.444  -2.297 -11.289
  655   2HH1  ARG  88          12HH      ARG  88  -8.472  -0.985 -12.365
  656   1HH2  ARG  88          21HH      ARG  88  -5.077  -0.083 -11.976
  657   2HH2  ARG  88          22HH      ARG  88  -6.544   0.282 -12.750
  658    H    PHE  89           H        PHE  89  -4.561  -3.951  -4.723
  659    HA   PHE  89           HA       PHE  89  -2.380  -2.078  -4.225
  660   1HB   PHE  89          1HB       PHE  89  -3.527  -4.246  -2.437
  661   2HB   PHE  89          2HB       PHE  89  -2.288  -3.086  -2.010
  662    HD1  PHE  89           HD1      PHE  89  -2.854  -0.792  -1.542
  663    HD2  PHE  89           HD2      PHE  89  -5.832  -3.649  -2.505
  664    HE1  PHE  89           HE1      PHE  89  -4.575   0.725  -0.657
  665    HE2  PHE  89           HE2      PHE  89  -7.564  -2.132  -1.628
  666    HZ   PHE  89           HZ       PHE  89  -6.924   0.055  -0.691
  667    H    VAL  90           H        VAL  90  -0.675  -2.810  -5.390
  668    HA   VAL  90           HA       VAL  90  -0.174  -5.669  -5.290
  669    HB   VAL  90           HB       VAL  90   1.424  -3.604  -6.822
  670   1HG1  VAL  90          11HG      VAL  90   1.326  -6.601  -7.080
  671   2HG1  VAL  90          12HG      VAL  90   2.644  -5.649  -6.401
  672   3HG1  VAL  90          13HG      VAL  90   2.255  -5.517  -8.117
  673   1HG2  VAL  90          21HG      VAL  90  -0.809  -5.348  -7.859
  674   2HG2  VAL  90          22HG      VAL  90   0.219  -4.305  -8.847
  675   3HG2  VAL  90          23HG      VAL  90  -0.869  -3.597  -7.652
  676    H    ILE  91           H        ILE  91   0.237  -5.651  -3.232
  677    HA   ILE  91           HA       ILE  91   2.434  -4.172  -2.072
  678    HB   ILE  91           HB       ILE  91   0.131  -5.827  -1.112
  679   1HG1  ILE  91          11HG      ILE  91   0.920  -3.002  -0.609
  680   2HG1  ILE  91          12HG      ILE  91  -0.299  -3.517  -1.768
  681   1HG2  ILE  91          21HG      ILE  91   1.924  -6.463   0.371
  682   2HG2  ILE  91          22HG      ILE  91   0.748  -5.451   1.206
  683   3HG2  ILE  91          23HG      ILE  91   2.290  -4.765   0.689
  684   1HD1  ILE  91          11HD      ILE  91  -1.300  -2.695   0.199
  685   2HD1  ILE  91          12HD      ILE  91  -0.344  -3.828   1.183
  686   3HD1  ILE  91          13HD      ILE  91  -1.570  -4.443   0.034
  687    H    GLY  92           H        GLY  92   3.985  -5.385  -0.841
  688   1HA   GLY  92          1HA       GLY  92   4.096  -8.162  -1.612
  689   2HA   GLY  92          2HA       GLY  92   5.543  -7.184  -1.802
  690    H    ARG  93           H        ARG  93   5.087  -9.462  -0.143
  691    HA   ARG  93           HA       ARG  93   5.551  -8.238   2.481
  692   1HB   ARG  93          1HB       ARG  93   3.562  -9.604   2.565
  693   2HB   ARG  93          2HB       ARG  93   4.391 -10.935   1.778
  694   1HG   ARG  93          1HG       ARG  93   4.117 -11.395   4.132
  695   2HG   ARG  93          2HG       ARG  93   5.825 -11.204   3.747
  696   1HD   ARG  93          1HD       ARG  93   5.632  -8.831   4.571
  697   2HD   ARG  93          2HD       ARG  93   4.008  -9.238   5.137
  698    HE   ARG  93           HE       ARG  93   5.853 -11.134   6.073
  699   1HH1  ARG  93          11HH      ARG  93   4.753  -7.836   6.766
  700   2HH1  ARG  93          12HH      ARG  93   5.374  -7.851   8.352
  701   1HH2  ARG  93          21HH      ARG  93   6.725 -11.091   8.201
  702   2HH2  ARG  93          22HH      ARG  93   6.533  -9.707   9.179
  703    H    GLU  94           H        GLU  94   7.631  -8.278   3.039
  704    HA   GLU  94           HA       GLU  94   9.180 -10.545   2.195
  705   1HB   GLU  94          1HB       GLU  94  11.182  -9.147   2.605
  706   2HB   GLU  94          2HB       GLU  94  10.095  -8.477   1.400
  707   1HG   GLU  94          1HG       GLU  94   9.307  -6.826   2.950
  708   2HG   GLU  94          2HG       GLU  94  10.270  -7.542   4.246
  Start of MODEL   17
    1   1H    GLY   1          1H        GLY   1  16.074 -12.977   2.120
    2   2H    GLY   1          2H        GLY   1  15.911 -12.746   3.788
    3   3H    GLY   1          3H        GLY   1  16.065 -11.408   2.752
    4   1HA   GLY   1          1HA       GLY   1  13.808 -13.309   2.817
    5   2HA   GLY   1          2HA       GLY   1  13.789 -11.660   3.424
    6    H    HIS   2           H        HIS   2  13.424 -13.677   0.723
    7    HA   HIS   2           HA       HIS   2  13.640 -11.583  -1.224
    8   1HB   HIS   2          1HB       HIS   2  12.558 -14.413  -1.446
    9   2HB   HIS   2          2HB       HIS   2  12.728 -13.303  -2.794
   10    HD1  HIS   2           HD1      HIS   2  14.833 -15.325  -0.372
   11    HD2  HIS   2           HD2      HIS   2  15.226 -13.146  -3.890
   12    HE1  HIS   2           HE1      HIS   2  17.140 -15.817  -1.243
   13    H    MET   3           H        MET   3  12.122 -10.117  -1.393
   14    HA   MET   3           HA       MET   3   9.580 -10.522  -0.127
   15   1HB   MET   3          1HB       MET   3  10.684  -8.318   0.001
   16   2HB   MET   3          2HB       MET   3  10.544  -8.153  -1.741
   17   1HG   MET   3          1HG       MET   3   8.155  -8.114  -1.615
   18   2HG   MET   3          2HG       MET   3   8.189  -8.442   0.112
   19   1HE   MET   3          1HE       MET   3  10.587  -6.518   1.078
   20   2HE   MET   3          2HE       MET   3   9.051  -6.706   1.922
   21   3HE   MET   3          3HE       MET   3   9.654  -5.094   1.538
   22    H    GLU   4           H        GLU   4   8.033 -11.564  -0.984
   23    HA   GLU   4           HA       GLU   4   7.798 -11.953  -3.823
   24   1HB   GLU   4          1HB       GLU   4   7.327 -13.782  -2.264
   25   2HB   GLU   4          2HB       GLU   4   6.112 -12.765  -1.485
   26   1HG   GLU   4          1HG       GLU   4   4.737 -12.807  -3.458
   27   2HG   GLU   4          2HG       GLU   4   5.966 -13.720  -4.325
   28    H    LEU   5           H        LEU   5   6.950 -10.308  -4.948
   29    HA   LEU   5           HA       LEU   5   5.048  -8.525  -3.711
   30   1HB   LEU   5          1HB       LEU   5   6.077  -8.556  -6.550
   31   2HB   LEU   5          2HB       LEU   5   5.106  -7.298  -5.826
   32    HG   LEU   5           HG       LEU   5   7.208  -6.398  -5.861
   33   1HD1  LEU   5          11HD      LEU   5   7.976  -6.179  -3.597
   34   2HD1  LEU   5          12HD      LEU   5   7.040  -7.611  -3.175
   35   3HD1  LEU   5          13HD      LEU   5   6.204  -6.145  -3.702
   36   1HD2  LEU   5          21HD      LEU   5   9.283  -7.504  -5.204
   37   2HD2  LEU   5          22HD      LEU   5   8.473  -8.378  -6.510
   38   3HD2  LEU   5          23HD      LEU   5   8.383  -8.978  -4.853
   39    H    PHE   6           H        PHE   6   2.900  -8.644  -3.949
   40    HA   PHE   6           HA       PHE   6   1.897 -10.224  -6.126
   41   1HB   PHE   6          1HB       PHE   6   0.199 -11.137  -4.490
   42   2HB   PHE   6          2HB       PHE   6   1.767 -11.928  -4.525
   43    HD1  PHE   6           HD1      PHE   6  -0.635  -9.894  -2.765
   44    HD2  PHE   6           HD2      PHE   6   3.196 -11.655  -2.528
   45    HE1  PHE   6           HE1      PHE   6  -0.613  -9.497  -0.313
   46    HE2  PHE   6           HE2      PHE   6   3.255 -11.283  -0.116
   47    HZ   PHE   6           HZ       PHE   6   1.345 -10.192   1.009
   48    HA   PRO   7           HA       PRO   7  -1.027  -6.927  -6.250
   49   1HB   PRO   7          1HB       PRO   7  -2.606  -7.870  -8.088
   50   2HB   PRO   7          2HB       PRO   7  -0.972  -7.322  -8.466
   51   1HG   PRO   7          1HG       PRO   7  -1.963 -10.159  -8.113
   52   2HG   PRO   7          2HG       PRO   7  -0.812  -9.542  -9.331
   53   1HD   PRO   7          1HD       PRO   7  -0.182 -10.832  -6.962
   54   2HD   PRO   7          2HD       PRO   7   0.910  -9.743  -7.857
   55    H    VAL   8           H        VAL   8  -2.485  -6.664  -4.743
   56    HA   VAL   8           HA       VAL   8  -4.495  -8.737  -4.363
   57    HB   VAL   8           HB       VAL   8  -3.827  -6.459  -2.484
   58   1HG1  VAL   8          11HG      VAL   8  -5.588  -8.867  -2.057
   59   2HG1  VAL   8          12HG      VAL   8  -6.122  -7.197  -2.255
   60   3HG1  VAL   8          13HG      VAL   8  -5.181  -7.659  -0.837
   61   1HG2  VAL   8          21HG      VAL   8  -2.004  -7.986  -2.626
   62   2HG2  VAL   8          22HG      VAL   8  -3.089  -9.353  -2.296
   63   3HG2  VAL   8          23HG      VAL   8  -2.798  -8.130  -1.048
   64    H    GLU   9           H        GLU   9  -6.128  -8.222  -5.707
   65    HA   GLU   9           HA       GLU   9  -6.884  -5.454  -5.934
   66   1HB   GLU   9          1HB       GLU   9  -7.027  -6.942  -7.925
   67   2HB   GLU   9          2HB       GLU   9  -8.257  -7.884  -7.088
   68   1HG   GLU   9          1HG       GLU   9  -9.706  -5.916  -6.994
   69   2HG   GLU   9          2HG       GLU   9  -8.458  -4.984  -7.826
   70    H    LEU  10           H        LEU  10  -7.852  -4.664  -4.297
   71    HA   LEU  10           HA       LEU  10  -9.470  -6.375  -2.578
   72   1HB   LEU  10          1HB       LEU  10  -7.585  -4.765  -1.844
   73   2HB   LEU  10          2HB       LEU  10  -8.741  -3.512  -2.255
   74    HG   LEU  10           HG       LEU  10 -10.294  -4.526  -0.580
   75   1HD1  LEU  10          11HD      LEU  10  -9.332  -5.957   1.128
   76   2HD1  LEU  10          12HD      LEU  10  -7.835  -6.055   0.197
   77   3HD1  LEU  10          13HD      LEU  10  -9.324  -6.732  -0.455
   78   1HD2  LEU  10          21HD      LEU  10  -7.662  -3.516   0.448
   79   2HD2  LEU  10          22HD      LEU  10  -9.235  -3.459   1.279
   80   3HD2  LEU  10          23HD      LEU  10  -8.981  -2.544  -0.199
   81    H    GLU  11           H        GLU  11 -11.637  -5.680  -2.170
   82    HA   GLU  11           HA       GLU  11 -12.608  -3.734  -4.122
   83   1HB   GLU  11          1HB       GLU  11 -13.477  -6.014  -4.540
   84   2HB   GLU  11          2HB       GLU  11 -14.132  -6.048  -2.908
   85   1HG   GLU  11          1HG       GLU  11 -15.514  -4.056  -3.500
   86   2HG   GLU  11          2HG       GLU  11 -14.956  -4.231  -5.160
   87    H    LYS  12           H        LYS  12 -12.379  -2.015  -2.833
   88    HA   LYS  12           HA       LYS  12 -13.516  -2.100  -0.236
   89   1HB   LYS  12          1HB       LYS  12 -11.898  -0.119  -1.690
   90   2HB   LYS  12          2HB       LYS  12 -12.851   0.487  -0.355
   91   1HG   LYS  12          1HG       LYS  12 -10.844  -1.755  -0.273
   92   2HG   LYS  12          2HG       LYS  12 -10.534  -0.115   0.344
   93   1HD   LYS  12          1HD       LYS  12 -12.908  -1.404   1.459
   94   2HD   LYS  12          2HD       LYS  12 -11.442  -2.334   1.776
   95   1HE   LYS  12          1HE       LYS  12 -11.900  -0.924   3.646
   96   2HE   LYS  12          2HE       LYS  12 -10.519  -0.227   2.852
   97   1HZ   LYS  12          1HZ       LYS  12 -12.079   1.370   1.743
   98   2HZ   LYS  12          2HZ       LYS  12 -12.098   1.517   3.402
   99   3HZ   LYS  12          3HZ       LYS  12 -13.341   0.706   2.619
  100    H    ASP  13           H        ASP  13 -14.589   0.026   0.377
  101    HA   ASP  13           HA       ASP  13 -17.153   0.079  -0.902
  102   1HB   ASP  13          1HB       ASP  13 -17.583   1.527   1.175
  103   2HB   ASP  13          2HB       ASP  13 -17.264  -0.183   1.429
  104    H    GLU  14           H        GLU  14 -18.135   2.321  -0.801
  105    HA   GLU  14           HA       GLU  14 -16.835   3.811  -2.813
  106   1HB   GLU  14          1HB       GLU  14 -18.678   5.424  -2.609
  107   2HB   GLU  14          2HB       GLU  14 -19.200   3.755  -2.763
  108   1HG   GLU  14          1HG       GLU  14 -19.771   3.640  -0.449
  109   2HG   GLU  14          2HG       GLU  14 -19.033   5.212  -0.139
  110    H    ASP  15           H        ASP  15 -16.538   4.058   0.559
  111    HA   ASP  15           HA       ASP  15 -15.843   6.810   0.789
  112   1HB   ASP  15          1HB       ASP  15 -16.489   5.550   2.728
  113   2HB   ASP  15          2HB       ASP  15 -15.189   4.411   2.479
  114    H    GLY  16           H        GLY  16 -14.152   3.914   0.042
  115   1HA   GLY  16          1HA       GLY  16 -12.243   4.226  -1.505
  116   2HA   GLY  16          2HA       GLY  16 -11.700   5.495  -0.404
  117    H    LEU  17           H        LEU  17 -10.067   4.809   0.799
  118    HA   LEU  17           HA       LEU  17 -10.139   1.969   1.583
  119   1HB   LEU  17          1HB       LEU  17  -7.801   3.806   1.920
  120   2HB   LEU  17          2HB       LEU  17  -7.838   2.064   2.092
  121    HG   LEU  17           HG       LEU  17  -8.052   3.701  -0.313
  122   1HD1  LEU  17          11HD      LEU  17  -6.050   1.656   0.599
  123   2HD1  LEU  17          12HD      LEU  17  -5.817   3.402   0.460
  124   3HD1  LEU  17          13HD      LEU  17  -6.023   2.419  -0.990
  125   1HD2  LEU  17          21HD      LEU  17  -8.407   0.714  -0.118
  126   2HD2  LEU  17          22HD      LEU  17  -8.166   1.610  -1.624
  127   3HD2  LEU  17          23HD      LEU  17  -9.604   1.901  -0.650
  128    H    GLY  18           H        GLY  18  -9.415   5.180   2.783
  129   1HA   GLY  18          1HA       GLY  18  -9.613   6.062   4.843
  130   2HA   GLY  18          2HA       GLY  18 -10.661   4.702   5.262
  131    H    ILE  19           H        ILE  19  -7.477   4.128   4.015
  132    HA   ILE  19           HA       ILE  19  -6.750   3.119   6.675
  133    HB   ILE  19           HB       ILE  19  -5.097   1.689   5.632
  134   1HG1  ILE  19          11HG      ILE  19  -5.848   2.953   2.985
  135   2HG1  ILE  19          12HG      ILE  19  -4.375   3.303   3.882
  136   1HG2  ILE  19          21HG      ILE  19  -7.682   1.631   4.082
  137   2HG2  ILE  19          22HG      ILE  19  -7.381   0.850   5.625
  138   3HG2  ILE  19          23HG      ILE  19  -6.529   0.301   4.176
  139   1HD1  ILE  19          11HD      ILE  19  -3.942   1.736   2.065
  140   2HD1  ILE  19          12HD      ILE  19  -5.137   0.624   2.730
  141   3HD1  ILE  19          13HD      ILE  19  -3.662   0.975   3.631
  142    H    SER  20           H        SER  20  -4.146   3.192   6.863
  143    HA   SER  20           HA       SER  20  -3.292   5.934   6.218
  144   1HB   SER  20          1HB       SER  20  -3.088   4.551   8.901
  145   2HB   SER  20          2HB       SER  20  -2.543   6.182   8.539
  146    HG   SER  20           HG       SER  20  -4.605   6.833   8.280
  147    H    ILE  21           H        ILE  21  -1.096   6.189   6.061
  148    HA   ILE  21           HA       ILE  21   0.474   3.708   5.909
  149    HB   ILE  21           HB       ILE  21   1.764   4.791   4.102
  150   1HG1  ILE  21          11HG      ILE  21   0.268   6.684   2.905
  151   2HG1  ILE  21          12HG      ILE  21  -0.201   6.976   4.548
  152   1HG2  ILE  21          21HG      ILE  21   0.114   4.465   2.309
  153   2HG2  ILE  21          22HG      ILE  21  -1.168   4.446   3.520
  154   3HG2  ILE  21          23HG      ILE  21   0.067   3.184   3.522
  155   1HD1  ILE  21          11HD      ILE  21   2.650   7.092   3.533
  156   2HD1  ILE  21          12HD      ILE  21   2.139   7.393   5.183
  157   3HD1  ILE  21          13HD      ILE  21   1.636   8.471   3.900
  158    H    ILE  22           H        ILE  22   2.833   4.170   6.108
  159    HA   ILE  22           HA       ILE  22   3.239   6.556   7.642
  160    HB   ILE  22           HB       ILE  22   2.979   4.858   9.299
  161   1HG1  ILE  22          11HG      ILE  22   5.921   5.522   9.059
  162   2HG1  ILE  22          12HG      ILE  22   4.686   6.545   9.782
  163   1HG2  ILE  22          21HG      ILE  22   5.146   3.317   7.924
  164   2HG2  ILE  22          22HG      ILE  22   3.430   2.896   8.002
  165   3HG2  ILE  22          23HG      ILE  22   4.411   2.883   9.471
  166   1HD1  ILE  22          11HD      ILE  22   4.303   4.835  11.496
  167   2HD1  ILE  22          12HD      ILE  22   5.951   5.448  11.480
  168   3HD1  ILE  22          13HD      ILE  22   5.598   3.864  10.786
  169    H    GLY  23           H        GLY  23   5.105   7.634   7.245
  170   1HA   GLY  23          1HA       GLY  23   6.613   6.702   4.965
  171   2HA   GLY  23          2HA       GLY  23   6.658   8.322   5.645
  172    H    MET  24           H        MET  24   8.100   5.281   5.503
  173    HA   MET  24           HA       MET  24  10.090   6.073   7.541
  174   1HB   MET  24          1HB       MET  24   9.375   3.292   6.556
  175   2HB   MET  24          2HB       MET  24  10.622   3.664   7.731
  176   1HG   MET  24          1HG       MET  24   7.666   4.127   8.106
  177   2HG   MET  24          2HG       MET  24   8.578   2.765   8.749
  178   1HE   MET  24          1HE       MET  24  11.296   4.090   9.701
  179   2HE   MET  24          2HE       MET  24  10.371   2.953  10.679
  180   3HE   MET  24          3HE       MET  24  10.908   4.480  11.375
  181    H    GLY  25           H        GLY  25  12.252   5.017   6.939
  182   1HA   GLY  25          1HA       GLY  25  12.556   5.285   4.039
  183   2HA   GLY  25          2HA       GLY  25  13.721   5.985   5.134
  184    H    VAL  26           H        VAL  26  12.464   3.043   3.775
  185    HA   VAL  26           HA       VAL  26  14.874   1.641   4.658
  186    HB   VAL  26           HB       VAL  26  12.781   0.832   5.769
  187   1HG1  VAL  26          11HG      VAL  26  11.945   0.099   2.991
  188   2HG1  VAL  26          12HG      VAL  26  11.167   1.222   4.118
  189   3HG1  VAL  26          13HG      VAL  26  11.174  -0.509   4.463
  190   1HG2  VAL  26          21HG      VAL  26  14.079  -1.170   3.928
  191   2HG2  VAL  26          22HG      VAL  26  13.141  -1.575   5.370
  192   3HG2  VAL  26          23HG      VAL  26  14.663  -0.687   5.518
  193    H    GLY  27           H        GLY  27  15.702   0.124   3.060
  194   1HA   GLY  27          1HA       GLY  27  15.247  -0.897   0.864
  195   2HA   GLY  27          2HA       GLY  27  14.643   0.680   0.373
  196    H    ALA  28           H        ALA  28  16.634   2.216   1.684
  197    HA   ALA  28           HA       ALA  28  18.671   2.035  -0.339
  198   1HB   ALA  28          1HB       ALA  28  18.511   3.862   2.078
  199   2HB   ALA  28          2HB       ALA  28  17.891   4.236   0.473
  200   3HB   ALA  28          3HB       ALA  28  19.623   4.034   0.721
  201    H    ASP  29           H        ASP  29  18.240   1.202   2.974
  202    HA   ASP  29           HA       ASP  29  20.902   0.496   3.619
  203   1HB   ASP  29          1HB       ASP  29  19.906  -0.669   5.518
  204   2HB   ASP  29          2HB       ASP  29  19.068   0.858   5.300
  205    H    ALA  30           H        ALA  30  18.161  -1.150   2.292
  206    HA   ALA  30           HA       ALA  30  19.239  -3.752   2.076
  207   1HB   ALA  30          1HB       ALA  30  16.836  -3.266   2.091
  208   2HB   ALA  30          2HB       ALA  30  17.306  -4.225   0.689
  209   3HB   ALA  30          3HB       ALA  30  16.991  -2.501   0.511
  210    H    GLY  31           H        GLY  31  19.518  -0.934   0.091
  211   1HA   GLY  31          1HA       GLY  31  21.092  -0.623  -1.615
  212   2HA   GLY  31          2HA       GLY  31  21.289  -2.368  -1.709
  213    H    LEU  32           H        LEU  32  18.079  -1.641  -1.660
  214    HA   LEU  32           HA       LEU  32  17.890  -1.954  -4.582
  215   1HB   LEU  32          1HB       LEU  32  15.889  -2.528  -2.396
  216   2HB   LEU  32          2HB       LEU  32  15.433  -2.461  -4.077
  217    HG   LEU  32           HG       LEU  32  16.995  -4.371  -4.512
  218   1HD1  LEU  32          11HD      LEU  32  17.739  -5.739  -2.647
  219   2HD1  LEU  32          12HD      LEU  32  17.152  -4.522  -1.516
  220   3HD1  LEU  32          13HD      LEU  32  18.481  -4.138  -2.611
  221   1HD2  LEU  32          21HD      LEU  32  15.514  -6.063  -3.529
  222   2HD2  LEU  32          22HD      LEU  32  14.633  -4.743  -4.288
  223   3HD2  LEU  32          23HD      LEU  32  14.775  -4.808  -2.531
  224    H    GLU  33           H        GLU  33  17.189   0.137  -1.977
  225    HA   GLU  33           HA       GLU  33  16.173   2.077  -1.682
  226   1HB   GLU  33          1HB       GLU  33  17.057   2.554  -4.530
  227   2HB   GLU  33          2HB       GLU  33  16.409   3.804  -3.483
  228   1HG   GLU  33          1HG       GLU  33  18.262   3.410  -1.917
  229   2HG   GLU  33          2HG       GLU  33  18.933   2.230  -3.048
  230    H    LYS  34           H        LYS  34  14.142   1.520  -1.257
  231    HA   LYS  34           HA       LYS  34  12.315   1.945  -3.452
  232   1HB   LYS  34          1HB       LYS  34  10.856   0.177  -2.631
  233   2HB   LYS  34          2HB       LYS  34  12.423  -0.492  -3.046
  234   1HG   LYS  34          1HG       LYS  34  13.020  -0.566  -0.666
  235   2HG   LYS  34          2HG       LYS  34  11.455   0.126  -0.252
  236   1HD   LYS  34          1HD       LYS  34  11.851  -2.502  -1.690
  237   2HD   LYS  34          2HD       LYS  34  11.537  -2.347   0.037
  238   1HE   LYS  34          1HE       LYS  34   9.362  -1.336  -0.432
  239   2HE   LYS  34          2HE       LYS  34   9.681  -1.388  -2.160
  240   1HZ   LYS  34          1HZ       LYS  34   9.404  -3.770  -0.388
  241   2HZ   LYS  34          2HZ       LYS  34   9.744  -3.796  -2.032
  242   3HZ   LYS  34          3HZ       LYS  34   8.271  -3.217  -1.508
  243    H    LEU  35           H        LEU  35  10.074   1.876  -2.130
  244    HA   LEU  35           HA       LEU  35  10.017   4.292  -0.636
  245   1HB   LEU  35          1HB       LEU  35   7.645   3.740  -0.473
  246   2HB   LEU  35          2HB       LEU  35   8.231   3.594  -2.119
  247    HG   LEU  35           HG       LEU  35   8.581   1.073  -1.113
  248   1HD1  LEU  35          11HD      LEU  35   5.998   2.060  -0.026
  249   2HD1  LEU  35          12HD      LEU  35   7.417   1.497   0.873
  250   3HD1  LEU  35          13HD      LEU  35   6.507   0.374  -0.138
  251   1HD2  LEU  35          21HD      LEU  35   7.838   1.417  -3.264
  252   2HD2  LEU  35          22HD      LEU  35   6.341   2.205  -2.741
  253   3HD2  LEU  35          23HD      LEU  35   6.598   0.474  -2.457
  254    H    GLY  36           H        GLY  36   9.676   4.480   1.617
  255   1HA   GLY  36          1HA       GLY  36   9.759   1.967   3.083
  256   2HA   GLY  36          2HA       GLY  36  10.288   3.531   3.737
  257    H    ILE  37           H        ILE  37   7.483   3.130   1.801
  258    HA   ILE  37           HA       ILE  37   5.875   4.200   3.922
  259    HB   ILE  37           HB       ILE  37   5.014   3.363   1.148
  260   1HG1  ILE  37          11HG      ILE  37   6.798   5.099   1.161
  261   2HG1  ILE  37          12HG      ILE  37   5.280   5.697   0.467
  262   1HG2  ILE  37          21HG      ILE  37   3.186   3.512   2.728
  263   2HG2  ILE  37          22HG      ILE  37   3.099   4.846   1.575
  264   3HG2  ILE  37          23HG      ILE  37   3.711   5.123   3.208
  265   1HD1  ILE  37          11HD      ILE  37   4.879   6.739   2.724
  266   2HD1  ILE  37          12HD      ILE  37   6.225   7.387   1.801
  267   3HD1  ILE  37          13HD      ILE  37   6.535   6.254   3.127
  268    H    PHE  38           H        PHE  38   5.425   2.793   5.389
  269    HA   PHE  38           HA       PHE  38   4.478   0.111   4.660
  270   1HB   PHE  38          1HB       PHE  38   5.196   1.358   7.303
  271   2HB   PHE  38          2HB       PHE  38   4.502  -0.247   7.159
  272    HD1  PHE  38           HD1      PHE  38   7.496   1.775   6.761
  273    HD2  PHE  38           HD2      PHE  38   5.799  -2.081   6.207
  274    HE1  PHE  38           HE1      PHE  38   9.752   0.823   6.511
  275    HE2  PHE  38           HE2      PHE  38   8.048  -3.044   5.950
  276    HZ   PHE  38           HZ       PHE  38  10.028  -1.592   6.102
  277    H    VAL  39           H        VAL  39   2.565  -0.640   5.945
  278    HA   VAL  39           HA       VAL  39   0.518   1.374   5.764
  279    HB   VAL  39           HB       VAL  39   0.255  -1.504   6.718
  280   1HG1  VAL  39          11HG      VAL  39  -1.592  -0.079   7.385
  281   2HG1  VAL  39          12HG      VAL  39  -2.114  -1.217   6.139
  282   3HG1  VAL  39          13HG      VAL  39  -1.795   0.467   5.722
  283   1HG2  VAL  39          21HG      VAL  39  -0.179  -0.384   3.950
  284   2HG2  VAL  39          22HG      VAL  39  -0.550  -2.030   4.461
  285   3HG2  VAL  39          23HG      VAL  39   1.123  -1.469   4.438
  286    H    LYS  40           H        LYS  40  -0.268   2.434   7.434
  287    HA   LYS  40           HA       LYS  40   1.060   2.106  10.013
  288   1HB   LYS  40          1HB       LYS  40   1.114   4.322   9.058
  289   2HB   LYS  40          2HB       LYS  40  -0.617   4.309   8.832
  290   1HG   LYS  40          1HG       LYS  40   0.037   5.720  10.681
  291   2HG   LYS  40          2HG       LYS  40  -0.964   4.373  11.216
  292   1HD   LYS  40          1HD       LYS  40   1.057   3.193  11.956
  293   2HD   LYS  40          2HD       LYS  40   2.039   4.572  11.444
  294   1HE   LYS  40          1HE       LYS  40   0.846   6.006  12.924
  295   2HE   LYS  40          2HE       LYS  40  -0.195   4.667  13.426
  296   1HZ   LYS  40          1HZ       LYS  40   1.561   5.081  15.047
  297   2HZ   LYS  40          2HZ       LYS  40   2.748   4.877  13.884
  298   3HZ   LYS  40          3HZ       LYS  40   1.782   3.568  14.349
  299    H    THR  41           H        THR  41  -2.173   2.370   8.605
  300    HA   THR  41           HA       THR  41  -3.271   0.772  10.750
  301    HB   THR  41           HB       THR  41  -4.705   3.217   9.986
  302    HG1  THR  41           HG1      THR  41  -3.600   4.510  11.477
  303   1HG2  THR  41          21HG      THR  41  -5.881   1.612  11.329
  304   2HG2  THR  41          22HG      THR  41  -5.618   3.071  12.292
  305   3HG2  THR  41          23HG      THR  41  -4.602   1.649  12.552
  306    H    VAL  42           H        VAL  42  -5.519   0.175  10.066
  307    HA   VAL  42           HA       VAL  42  -6.128   0.656   7.309
  308    HB   VAL  42           HB       VAL  42  -6.248  -2.121   8.579
  309   1HG1  VAL  42          11HG      VAL  42  -6.864  -2.873   6.353
  310   2HG1  VAL  42          12HG      VAL  42  -6.690  -1.213   5.767
  311   3HG1  VAL  42          13HG      VAL  42  -7.962  -1.598   6.918
  312   1HG2  VAL  42          21HG      VAL  42  -4.367  -1.132   6.448
  313   2HG2  VAL  42          22HG      VAL  42  -4.495  -2.799   7.017
  314   3HG2  VAL  42          23HG      VAL  42  -3.921  -1.533   8.106
  315    H    THR  43           H        THR  43  -8.423   0.746   7.149
  316    HA   THR  43           HA       THR  43  -9.631   1.141   9.678
  317    HB   THR  43           HB       THR  43 -10.062   2.681   7.755
  318    HG1  THR  43           HG1      THR  43 -11.828   3.109   8.769
  319   1HG2  THR  43          21HG      THR  43 -10.142   0.993   6.052
  320   2HG2  THR  43          22HG      THR  43 -11.619   1.980   6.013
  321   3HG2  THR  43          23HG      THR  43 -11.636   0.351   6.731
  322    H    GLU  44           H        GLU  44 -11.450  -0.022  10.420
  323    HA   GLU  44           HA       GLU  44 -11.857  -2.701   9.339
  324   1HB   GLU  44          1HB       GLU  44 -11.555  -2.264  11.792
  325   2HB   GLU  44          2HB       GLU  44 -13.072  -1.378  11.765
  326   1HG   GLU  44          1HG       GLU  44 -13.537  -3.563  12.557
  327   2HG   GLU  44          2HG       GLU  44 -14.161  -3.346  10.907
  328    H    GLY  45           H        GLY  45 -13.088   0.380   9.438
  329   1HA   GLY  45          1HA       GLY  45 -15.865  -0.153   8.799
  330   2HA   GLY  45          2HA       GLY  45 -15.056   1.428   8.785
  331    H    GLY  46           H        GLY  46 -13.781  -1.217   7.010
  332   1HA   GLY  46          1HA       GLY  46 -15.117  -0.517   4.658
  333   2HA   GLY  46          2HA       GLY  46 -13.407  -0.080   4.717
  334    H    ALA  47           H        ALA  47 -14.454  -1.856   3.103
  335    HA   ALA  47           HA       ALA  47 -14.327  -4.603   3.803
  336   1HB   ALA  47          1HB       ALA  47 -13.915  -3.413   1.103
  337   2HB   ALA  47          2HB       ALA  47 -15.493  -3.666   1.860
  338   3HB   ALA  47          3HB       ALA  47 -14.462  -5.049   1.465
  339    H    ALA  48           H        ALA  48 -11.874  -3.173   4.547
  340    HA   ALA  48           HA       ALA  48  -9.807  -4.442   2.864
  341   1HB   ALA  48          1HB       ALA  48  -9.473  -2.061   3.316
  342   2HB   ALA  48          2HB       ALA  48  -8.194  -3.017   4.061
  343   3HB   ALA  48          3HB       ALA  48  -9.507  -2.376   5.050
  344    H    GLN  49           H        GLN  49 -10.275  -3.834   6.336
  345    HA   GLN  49           HA       GLN  49  -8.878  -6.246   7.014
  346   1HB   GLN  49          1HB       GLN  49 -10.488  -4.296   8.603
  347   2HB   GLN  49          2HB       GLN  49  -9.719  -5.700   9.355
  348   1HG   GLN  49          1HG       GLN  49  -7.544  -4.839   8.493
  349   2HG   GLN  49          2HG       GLN  49  -8.407  -3.409   7.932
  350   1HE2  GLN  49          21HE      GLN  49 -10.155  -3.449  10.265
  351   2HE2  GLN  49          22HE      GLN  49  -9.230  -2.841  11.582
  352    H    ARG  50           H        ARG  50 -12.119  -5.234   6.597
  353    HA   ARG  50           HA       ARG  50 -13.482  -7.513   7.477
  354   1HB   ARG  50          1HB       ARG  50 -14.007  -5.423   5.418
  355   2HB   ARG  50          2HB       ARG  50 -15.180  -6.712   5.703
  356   1HG   ARG  50          1HG       ARG  50 -14.171  -4.907   7.890
  357   2HG   ARG  50          2HG       ARG  50 -15.549  -4.475   6.875
  358   1HD   ARG  50          1HD       ARG  50 -15.329  -6.999   8.519
  359   2HD   ARG  50          2HD       ARG  50 -16.234  -5.555   8.989
  360    HE   ARG  50           HE       ARG  50 -17.374  -5.937   6.734
  361   1HH1  ARG  50          11HH      ARG  50 -16.443  -8.553   8.953
  362   2HH1  ARG  50          12HH      ARG  50 -17.618  -9.628   8.374
  363   1HH2  ARG  50          21HH      ARG  50 -18.965  -7.447   5.950
  364   2HH2  ARG  50          22HH      ARG  50 -19.075  -8.995   6.641
  365    H    ASP  51           H        ASP  51 -11.762  -6.781   4.480
  366    HA   ASP  51           HA       ASP  51 -12.491  -9.199   3.133
  367   1HB   ASP  51          1HB       ASP  51 -11.560  -7.308   1.871
  368   2HB   ASP  51          2HB       ASP  51 -10.056  -7.425   2.774
  369    H    GLY  52           H        GLY  52  -9.394  -8.205   4.555
  370   1HA   GLY  52          1HA       GLY  52  -8.420  -9.450   6.350
  371   2HA   GLY  52          2HA       GLY  52  -9.211 -10.882   5.728
  372    H    ARG  53           H        ARG  53  -8.118  -9.894   2.904
  373    HA   ARG  53           HA       ARG  53  -5.752 -11.542   3.177
  374   1HB   ARG  53          1HB       ARG  53  -7.476 -11.258   1.124
  375   2HB   ARG  53          2HB       ARG  53  -6.316 -10.029   0.654
  376   1HG   ARG  53          1HG       ARG  53  -5.573 -12.904   1.164
  377   2HG   ARG  53          2HG       ARG  53  -5.988 -12.269  -0.419
  378   1HD   ARG  53          1HD       ARG  53  -4.102 -10.760  -0.331
  379   2HD   ARG  53          2HD       ARG  53  -3.744 -11.269   1.321
  380    HE   ARG  53           HE       ARG  53  -3.706 -13.220  -0.856
  381   1HH1  ARG  53          11HH      ARG  53  -1.961 -11.416   1.682
  382   2HH1  ARG  53          12HH      ARG  53  -0.544 -12.329   1.530
  383   1HH2  ARG  53          21HH      ARG  53  -1.681 -14.486  -1.013
  384   2HH2  ARG  53          22HH      ARG  53  -0.362 -14.064  -0.039
  385    H    ILE  54           H        ILE  54  -6.484  -8.212   3.136
  386    HA   ILE  54           HA       ILE  54  -3.701  -7.485   2.697
  387    HB   ILE  54           HB       ILE  54  -5.769  -6.267   1.626
  388   1HG1  ILE  54          11HG      ILE  54  -3.713  -4.553   3.031
  389   2HG1  ILE  54          12HG      ILE  54  -3.388  -5.475   1.566
  390   1HG2  ILE  54          21HG      ILE  54  -5.783  -5.098   4.398
  391   2HG2  ILE  54          22HG      ILE  54  -7.107  -5.955   3.602
  392   3HG2  ILE  54          23HG      ILE  54  -6.606  -4.363   3.018
  393   1HD1  ILE  54          11HD      ILE  54  -3.813  -3.252   0.903
  394   2HD1  ILE  54          12HD      ILE  54  -5.273  -3.162   1.908
  395   3HD1  ILE  54          13HD      ILE  54  -5.263  -4.174   0.478
  396    H    GLN  55           H        GLN  55  -2.577  -6.208   4.374
  397    HA   GLN  55           HA       GLN  55  -3.818  -6.463   6.978
  398   1HB   GLN  55          1HB       GLN  55  -1.058  -7.415   6.265
  399   2HB   GLN  55          2HB       GLN  55  -1.645  -7.272   7.908
  400   1HG   GLN  55          1HG       GLN  55  -3.310  -8.981   7.488
  401   2HG   GLN  55          2HG       GLN  55  -2.818  -9.076   5.799
  402   1HE2  GLN  55          21HE      GLN  55   0.028  -8.872   6.301
  403   2HE2  GLN  55          22HE      GLN  55   0.495 -10.348   7.063
  404    H    VAL  56           H        VAL  56  -2.571  -5.302   8.659
  405    HA   VAL  56           HA       VAL  56  -1.735  -2.675   7.730
  406    HB   VAL  56           HB       VAL  56  -3.292  -3.101   9.702
  407   1HG1  VAL  56          11HG      VAL  56  -2.312  -3.591  11.889
  408   2HG1  VAL  56          12HG      VAL  56  -0.766  -3.921  11.109
  409   3HG1  VAL  56          13HG      VAL  56  -2.153  -4.941  10.765
  410   1HG2  VAL  56          21HG      VAL  56  -0.843  -1.411  10.200
  411   2HG2  VAL  56          22HG      VAL  56  -2.346  -1.305  11.114
  412   3HG2  VAL  56          23HG      VAL  56  -2.336  -0.896   9.410
  413    H    ASN  57           H        ASN  57  -0.313  -5.598   8.395
  414    HA   ASN  57           HA       ASN  57   2.133  -4.506   9.526
  415   1HB   ASN  57          1HB       ASN  57   1.106  -6.553  10.490
  416   2HB   ASN  57          2HB       ASN  57   1.372  -7.388   8.970
  417   1HD2  ASN  57          21HD      ASN  57   2.850  -6.108  11.823
  418   2HD2  ASN  57          22HD      ASN  57   4.372  -6.900  11.655
  419    H    ASP  58           H        ASP  58   0.970  -4.677   6.564
  420    HA   ASP  58           HA       ASP  58   3.409  -5.678   5.342
  421   1HB   ASP  58          1HB       ASP  58   0.646  -5.331   4.207
  422   2HB   ASP  58          2HB       ASP  58   2.065  -5.679   3.220
  423    H    GLN  59           H        GLN  59   3.438  -4.496   2.941
  424    HA   GLN  59           HA       GLN  59   3.818  -1.646   3.554
  425   1HB   GLN  59          1HB       GLN  59   5.941  -2.959   3.683
  426   2HB   GLN  59          2HB       GLN  59   5.676  -3.446   2.012
  427   1HG   GLN  59          1HG       GLN  59   5.782  -1.116   1.325
  428   2HG   GLN  59          2HG       GLN  59   6.069  -0.635   2.989
  429   1HE2  GLN  59          21HE      GLN  59   7.964   0.261   2.582
  430   2HE2  GLN  59          22HE      GLN  59   9.406  -0.585   2.158
  431    H    ILE  60           H        ILE  60   3.039  -0.312   1.939
  432    HA   ILE  60           HA       ILE  60   1.617  -1.484  -0.272
  433    HB   ILE  60           HB       ILE  60   2.273   1.441   0.222
  434   1HG1  ILE  60          11HG      ILE  60   0.946   0.611   2.113
  435   2HG1  ILE  60          12HG      ILE  60  -0.016   1.658   1.068
  436   1HG2  ILE  60          21HG      ILE  60   1.649   0.888  -2.085
  437   2HG2  ILE  60          22HG      ILE  60   0.450   1.923  -1.305
  438   3HG2  ILE  60          23HG      ILE  60   0.143   0.195  -1.489
  439   1HD1  ILE  60          11HD      ILE  60  -1.090  -0.285   0.078
  440   2HD1  ILE  60          12HD      ILE  60  -1.308  -0.250   1.831
  441   3HD1  ILE  60          13HD      ILE  60  -0.125  -1.344   1.112
  442    H    VAL  61           H        VAL  61   2.876  -2.274  -1.920
  443    HA   VAL  61           HA       VAL  61   5.424  -0.998  -2.507
  444    HB   VAL  61           HB       VAL  61   4.167  -3.527  -3.600
  445   1HG1  VAL  61          11HG      VAL  61   5.654  -2.589  -5.239
  446   2HG1  VAL  61          12HG      VAL  61   6.331  -4.052  -4.513
  447   3HG1  VAL  61          13HG      VAL  61   6.940  -2.461  -4.027
  448   1HG2  VAL  61          21HG      VAL  61   6.386  -3.126  -1.599
  449   2HG2  VAL  61          22HG      VAL  61   5.842  -4.682  -2.236
  450   3HG2  VAL  61          23HG      VAL  61   4.755  -3.700  -1.260
  451    H    GLU  62           H        GLU  62   2.409  -1.682  -4.207
  452    HA   GLU  62           HA       GLU  62   2.764   0.711  -5.761
  453   1HB   GLU  62          1HB       GLU  62   4.023  -0.796  -7.152
  454   2HB   GLU  62          2HB       GLU  62   2.752  -1.998  -7.124
  455   1HG   GLU  62          1HG       GLU  62   1.280  -0.419  -8.307
  456   2HG   GLU  62          2HG       GLU  62   2.629   0.711  -8.359
  457    H    VAL  63           H        VAL  63   0.815   1.663  -5.741
  458    HA   VAL  63           HA       VAL  63  -1.511  -0.083  -5.811
  459    HB   VAL  63           HB       VAL  63  -1.035   2.502  -4.310
  460   1HG1  VAL  63          11HG      VAL  63  -3.741   1.474  -5.173
  461   2HG1  VAL  63          12HG      VAL  63  -2.956   2.951  -5.749
  462   3HG1  VAL  63          13HG      VAL  63  -3.425   2.808  -4.048
  463   1HG2  VAL  63          21HG      VAL  63  -2.507  -0.046  -3.713
  464   2HG2  VAL  63          22HG      VAL  63  -2.125   1.247  -2.575
  465   3HG2  VAL  63          23HG      VAL  63  -0.834   0.272  -3.292
  466    H    ASP  64           H        ASP  64  -2.761  -0.044  -7.427
  467    HA   ASP  64           HA       ASP  64  -3.994   0.510  -9.236
  468   1HB   ASP  64          1HB       ASP  64  -4.450   2.638  -7.849
  469   2HB   ASP  64          2HB       ASP  64  -3.246   3.427  -8.856
  470    H    GLY  65           H        GLY  65  -0.943   0.408  -9.164
  471   1HA   GLY  65          1HA       GLY  65   0.663   0.138 -10.808
  472   2HA   GLY  65          2HA       GLY  65  -0.498   0.726 -11.997
  473    H    ILE  66           H        ILE  66  -0.050   2.665  -9.176
  474    HA   ILE  66           HA       ILE  66   1.038   4.803 -10.761
  475    HB   ILE  66           HB       ILE  66  -0.648   4.890  -8.655
  476   1HG1  ILE  66          11HG      ILE  66   1.536   6.941  -9.063
  477   2HG1  ILE  66          12HG      ILE  66   0.127   6.759 -10.108
  478   1HG2  ILE  66          21HG      ILE  66   0.870   3.905  -7.044
  479   2HG2  ILE  66          22HG      ILE  66   0.518   5.585  -6.616
  480   3HG2  ILE  66          23HG      ILE  66   2.057   5.169  -7.373
  481   1HD1  ILE  66          11HD      ILE  66  -0.184   8.580  -8.547
  482   2HD1  ILE  66          12HD      ILE  66   0.123   7.467  -7.208
  483   3HD1  ILE  66          13HD      ILE  66  -1.315   7.259  -8.208
  484    H    SER  67           H        SER  67   2.260   2.350  -8.878
  485    HA   SER  67           HA       SER  67   4.210   1.844  -7.802
  486   1HB   SER  67          1HB       SER  67   6.254   2.058  -9.249
  487   2HB   SER  67          2HB       SER  67   4.882   1.333 -10.083
  488    HG   SER  67           HG       SER  67   4.685   3.916 -10.459
  489    H    LEU  68           H        LEU  68   3.996   3.064  -6.019
  490    HA   LEU  68           HA       LEU  68   5.137   5.684  -6.062
  491   1HB   LEU  68          1HB       LEU  68   4.122   5.979  -3.879
  492   2HB   LEU  68          2HB       LEU  68   2.965   5.380  -5.024
  493    HG   LEU  68           HG       LEU  68   2.354   4.309  -3.171
  494   1HD1  LEU  68          11HD      LEU  68   2.465   2.614  -4.681
  495   2HD1  LEU  68          12HD      LEU  68   2.895   2.010  -3.079
  496   3HD1  LEU  68          13HD      LEU  68   4.154   2.269  -4.272
  497   1HD2  LEU  68          21HD      LEU  68   3.988   5.082  -1.630
  498   2HD2  LEU  68          22HD      LEU  68   5.196   3.982  -2.276
  499   3HD2  LEU  68          23HD      LEU  68   3.797   3.340  -1.401
  500    H    VAL  69           H        VAL  69   6.854   3.544  -6.469
  501    HA   VAL  69           HA       VAL  69   8.364   3.008  -4.101
  502    HB   VAL  69           HB       VAL  69   9.169   2.566  -6.990
  503   1HG1  VAL  69          11HG      VAL  69  11.049   2.478  -5.454
  504   2HG1  VAL  69          12HG      VAL  69  10.693   0.869  -6.085
  505   3HG1  VAL  69          13HG      VAL  69  10.194   1.307  -4.452
  506   1HG2  VAL  69          21HG      VAL  69   7.079   1.399  -6.554
  507   2HG2  VAL  69          22HG      VAL  69   7.749   0.647  -5.113
  508   3HG2  VAL  69          23HG      VAL  69   8.394   0.239  -6.700
  509    H    GLY  70           H        GLY  70   9.238   4.678  -3.169
  510   1HA   GLY  70          1HA       GLY  70  11.229   5.984  -2.994
  511   2HA   GLY  70          2HA       GLY  70  11.148   6.260  -4.729
  512    H    VAL  71           H        VAL  71   8.246   6.495  -2.773
  513    HA   VAL  71           HA       VAL  71   8.414   9.394  -3.120
  514    HB   VAL  71           HB       VAL  71   6.036   9.547  -3.211
  515   1HG1  VAL  71          11HG      VAL  71   6.915   7.270  -4.958
  516   2HG1  VAL  71          12HG      VAL  71   7.064   8.992  -5.313
  517   3HG1  VAL  71          13HG      VAL  71   5.467   8.249  -5.192
  518   1HG2  VAL  71          21HG      VAL  71   4.525   7.670  -2.966
  519   2HG2  VAL  71          22HG      VAL  71   5.515   7.838  -1.519
  520   3HG2  VAL  71          23HG      VAL  71   5.882   6.574  -2.698
  521    H    THR  72           H        THR  72   6.994  10.548  -1.475
  522    HA   THR  72           HA       THR  72   7.809   9.697   1.175
  523    HB   THR  72           HB       THR  72   6.884  12.078   1.614
  524    HG1  THR  72           HG1      THR  72   7.420  12.644  -1.031
  525   1HG2  THR  72          21HG      THR  72   9.292  11.668  -0.186
  526   2HG2  THR  72          22HG      THR  72   9.296  11.443   1.558
  527   3HG2  THR  72          23HG      THR  72   9.033  13.045   0.882
  528    H    GLN  73           H        GLN  73   6.288  10.283   2.905
  529    HA   GLN  73           HA       GLN  73   4.018   8.707   2.635
  530   1HB   GLN  73          1HB       GLN  73   3.759   8.870   4.892
  531   2HB   GLN  73          2HB       GLN  73   5.322   9.647   4.816
  532   1HG   GLN  73          1HG       GLN  73   2.773  11.230   4.746
  533   2HG   GLN  73          2HG       GLN  73   3.482  10.699   6.260
  534   1HE2  GLN  73          21HE      GLN  73   5.492  11.644   3.605
  535   2HE2  GLN  73          22HE      GLN  73   6.010  13.132   4.271
  536    H    ASN  74           H        ASN  74   4.395  12.092   1.946
  537    HA   ASN  74           HA       ASN  74   1.578  12.610   2.081
  538   1HB   ASN  74          1HB       ASN  74   2.044  14.798   1.109
  539   2HB   ASN  74          2HB       ASN  74   3.215  14.475   2.374
  540   1HD2  ASN  74          21HD      ASN  74   5.363  14.459   1.838
  541   2HD2  ASN  74          22HD      ASN  74   5.925  14.744   0.239
  542    H    PHE  75           H        PHE  75   3.809  11.644  -0.451
  543    HA   PHE  75           HA       PHE  75   1.924  11.942  -2.565
  544   1HB   PHE  75          1HB       PHE  75   4.422  11.730  -2.911
  545   2HB   PHE  75          2HB       PHE  75   4.273  10.051  -2.414
  546    HD1  PHE  75           HD1      PHE  75   2.882   8.457  -3.856
  547    HD2  PHE  75           HD2      PHE  75   3.978  12.369  -5.148
  548    HE1  PHE  75           HE1      PHE  75   2.428   7.809  -6.175
  549    HE2  PHE  75           HE2      PHE  75   3.514  11.716  -7.474
  550    HZ   PHE  75           HZ       PHE  75   2.737   9.434  -7.983
  551    H    ALA  76           H        ALA  76   3.095   9.241  -0.596
  552    HA   ALA  76           HA       ALA  76   1.502   7.273  -1.730
  553   1HB   ALA  76          1HB       ALA  76   2.535   7.381   1.088
  554   2HB   ALA  76          2HB       ALA  76   3.435   6.834  -0.331
  555   3HB   ALA  76          3HB       ALA  76   2.003   5.949   0.202
  556    H    ALA  77           H        ALA  77   0.848   9.309   1.145
  557    HA   ALA  77           HA       ALA  77  -1.593   8.132   1.815
  558   1HB   ALA  77          1HB       ALA  77  -0.402   9.682   3.303
  559   2HB   ALA  77          2HB       ALA  77  -2.075  10.190   3.045
  560   3HB   ALA  77          3HB       ALA  77  -0.763  11.007   2.198
  561    H    THR  78           H        THR  78  -0.779  10.564  -0.534
  562    HA   THR  78           HA       THR  78  -3.403  11.337  -1.183
  563    HB   THR  78           HB       THR  78  -0.829  11.428  -2.762
  564    HG1  THR  78           HG1      THR  78  -0.792  12.728  -0.930
  565   1HG2  THR  78          21HG      THR  78  -2.732  11.485  -4.277
  566   2HG2  THR  78          22HG      THR  78  -1.956  13.075  -4.215
  567   3HG2  THR  78          23HG      THR  78  -3.472  12.787  -3.347
  568    H    VAL  79           H        VAL  79  -1.240   8.870  -2.556
  569    HA   VAL  79           HA       VAL  79  -2.968   7.969  -4.592
  570    HB   VAL  79           HB       VAL  79  -0.967   6.217  -3.102
  571   1HG1  VAL  79          11HG      VAL  79  -0.879   4.939  -5.145
  572   2HG1  VAL  79          12HG      VAL  79  -2.074   6.003  -5.883
  573   3HG1  VAL  79          13HG      VAL  79  -2.518   5.005  -4.501
  574   1HG2  VAL  79          21HG      VAL  79  -0.563   8.053  -5.443
  575   2HG2  VAL  79          22HG      VAL  79   0.615   6.868  -4.864
  576   3HG2  VAL  79          23HG      VAL  79   0.148   8.227  -3.842
  577    H    LEU  80           H        LEU  80  -2.403   6.657  -1.350
  578    HA   LEU  80           HA       LEU  80  -4.488   4.756  -1.480
  579   1HB   LEU  80          1HB       LEU  80  -2.967   5.889   0.871
  580   2HB   LEU  80          2HB       LEU  80  -4.217   4.694   1.085
  581    HG   LEU  80           HG       LEU  80  -2.136   3.566   1.218
  582   1HD1  LEU  80          11HD      LEU  80  -3.812   2.357   0.024
  583   2HD1  LEU  80          12HD      LEU  80  -2.190   1.953  -0.533
  584   3HD1  LEU  80          13HD      LEU  80  -3.219   3.006  -1.507
  585   1HD2  LEU  80          21HD      LEU  80  -0.690   5.200   0.136
  586   2HD2  LEU  80          22HD      LEU  80  -1.348   4.747  -1.436
  587   3HD2  LEU  80          23HD      LEU  80  -0.417   3.580  -0.495
  588    H    ARG  81           H        ARG  81  -4.748   8.002  -1.316
  589    HA   ARG  81           HA       ARG  81  -7.305   8.057   0.107
  590   1HB   ARG  81          1HB       ARG  81  -5.843   9.841   0.756
  591   2HB   ARG  81          2HB       ARG  81  -5.420  10.199  -0.895
  592   1HG   ARG  81          1HG       ARG  81  -8.213  10.672   0.098
  593   2HG   ARG  81          2HG       ARG  81  -6.931  11.837   0.426
  594   1HD   ARG  81          1HD       ARG  81  -6.506  12.013  -2.001
  595   2HD   ARG  81          2HD       ARG  81  -7.811  10.872  -2.301
  596    HE   ARG  81           HE       ARG  81  -8.541  13.215  -0.804
  597   1HH1  ARG  81          11HH      ARG  81  -8.341  11.750  -4.029
  598   2HH1  ARG  81          12HH      ARG  81  -9.457  12.807  -4.739
  599   1HH2  ARG  81          21HH      ARG  81  -9.999  14.750  -1.824
  600   2HH2  ARG  81          22HH      ARG  81 -10.400  14.580  -3.460
  601    H    ASN  82           H        ASN  82  -5.897   8.310  -3.046
  602    HA   ASN  82           HA       ASN  82  -8.282   9.301  -4.299
  603   1HB   ASN  82          1HB       ASN  82  -5.533   8.751  -5.173
  604   2HB   ASN  82          2HB       ASN  82  -6.758   8.711  -6.430
  605   1HD2  ASN  82          21HD      ASN  82  -5.139  10.626  -4.074
  606   2HD2  ASN  82          22HD      ASN  82  -5.710  12.160  -4.632
  607    H    THR  83           H        THR  83  -7.127   6.314  -3.452
  608    HA   THR  83           HA       THR  83  -7.870   4.629  -5.504
  609    HB   THR  83           HB       THR  83  -8.085   3.027  -3.524
  610    HG1  THR  83           HG1      THR  83  -8.410   5.014  -2.166
  611   1HG2  THR  83          21HG      THR  83  -5.648   3.015  -3.242
  612   2HG2  THR  83          22HG      THR  83  -5.555   4.622  -3.957
  613   3HG2  THR  83          23HG      THR  83  -6.076   3.251  -4.936
  614    H    LYS  84           H        LYS  84  -9.652   3.415  -5.838
  615    HA   LYS  84           HA       LYS  84 -12.123   4.292  -4.562
  616   1HB   LYS  84          1HB       LYS  84 -13.182   3.511  -6.797
  617   2HB   LYS  84          2HB       LYS  84 -12.305   5.024  -6.797
  618   1HG   LYS  84          1HG       LYS  84 -11.700   3.928  -8.792
  619   2HG   LYS  84          2HG       LYS  84 -10.330   3.725  -7.705
  620   1HD   LYS  84          1HD       LYS  84 -11.177   1.459  -7.150
  621   2HD   LYS  84          2HD       LYS  84 -12.450   1.681  -8.347
  622   1HE   LYS  84          1HE       LYS  84  -9.478   1.666  -8.863
  623   2HE   LYS  84          2HE       LYS  84 -10.623   0.397  -9.272
  624   1HZ   LYS  84          1HZ       LYS  84 -10.120   1.668 -11.193
  625   2HZ   LYS  84          2HZ       LYS  84 -10.438   3.109 -10.457
  626   3HZ   LYS  84          3HZ       LYS  84 -11.716   2.039 -10.786
  627    H    GLY  85           H        GLY  85 -13.723   2.166  -5.604
  628   1HA   GLY  85          1HA       GLY  85 -13.570   0.250  -3.684
  629   2HA   GLY  85          2HA       GLY  85 -14.323   0.038  -5.250
  630    H    ASN  86           H        ASN  86 -12.803  -0.713  -7.029
  631    HA   ASN  86           HA       ASN  86 -11.284  -2.925  -5.929
  632   1HB   ASN  86          1HB       ASN  86 -11.992  -2.264  -8.772
  633   2HB   ASN  86          2HB       ASN  86 -10.883  -3.569  -8.357
  634   1HD2  ASN  86          21HD      ASN  86 -11.692  -5.425  -7.365
  635   2HD2  ASN  86          22HD      ASN  86 -13.362  -5.780  -7.271
  636    H    VAL  87           H        VAL  87  -9.444  -2.465  -5.152
  637    HA   VAL  87           HA       VAL  87  -7.636  -0.656  -6.635
  638    HB   VAL  87           HB       VAL  87  -7.090  -1.628  -3.903
  639   1HG1  VAL  87          11HG      VAL  87  -6.469   0.920  -5.315
  640   2HG1  VAL  87          12HG      VAL  87  -5.388  -0.441  -5.003
  641   3HG1  VAL  87          13HG      VAL  87  -5.998   0.526  -3.655
  642   1HG2  VAL  87          21HG      VAL  87  -8.963   0.657  -4.472
  643   2HG2  VAL  87          22HG      VAL  87  -8.314   0.173  -2.887
  644   3HG2  VAL  87          23HG      VAL  87  -9.359  -0.921  -3.785
  645    H    ARG  88           H        ARG  88  -5.799  -1.505  -7.418
  646    HA   ARG  88           HA       ARG  88  -5.057  -4.228  -6.663
  647   1HB   ARG  88          1HB       ARG  88  -4.102  -2.388  -8.850
  648   2HB   ARG  88          2HB       ARG  88  -3.323  -3.926  -8.485
  649   1HG   ARG  88          1HG       ARG  88  -5.234  -5.155  -9.073
  650   2HG   ARG  88          2HG       ARG  88  -6.242  -3.710  -9.097
  651   1HD   ARG  88          1HD       ARG  88  -5.798  -4.400 -11.312
  652   2HD   ARG  88          2HD       ARG  88  -4.965  -2.877 -10.960
  653    HE   ARG  88           HE       ARG  88  -3.162  -5.013 -10.561
  654   1HH1  ARG  88          11HH      ARG  88  -4.734  -3.315 -13.293
  655   2HH1  ARG  88          12HH      ARG  88  -3.519  -3.761 -14.393
  656   1HH2  ARG  88          21HH      ARG  88  -1.537  -5.573 -12.163
  657   2HH2  ARG  88          22HH      ARG  88  -1.707  -5.026 -13.765
  658    H    PHE  89           H        PHE  89  -4.182  -4.192  -4.768
  659    HA   PHE  89           HA       PHE  89  -2.070  -2.280  -4.156
  660   1HB   PHE  89          1HB       PHE  89  -3.270  -4.505  -2.502
  661   2HB   PHE  89          2HB       PHE  89  -2.031  -3.395  -1.959
  662    HD1  PHE  89           HD1      PHE  89  -2.570  -1.084  -1.515
  663    HD2  PHE  89           HD2      PHE  89  -5.522  -3.912  -2.603
  664    HE1  PHE  89           HE1      PHE  89  -4.300   0.416  -0.644
  665    HE2  PHE  89           HE2      PHE  89  -7.267  -2.414  -1.744
  666    HZ   PHE  89           HZ       PHE  89  -6.656  -0.248  -0.758
  667    H    VAL  90           H        VAL  90  -0.264  -2.918  -5.211
  668    HA   VAL  90           HA       VAL  90   0.373  -5.734  -5.145
  669    HB   VAL  90           HB       VAL  90   2.015  -3.436  -6.222
  670   1HG1  VAL  90          11HG      VAL  90   3.321  -5.185  -7.383
  671   2HG1  VAL  90          12HG      VAL  90   2.330  -6.419  -6.608
  672   3HG1  VAL  90          13HG      VAL  90   3.371  -5.387  -5.632
  673   1HG2  VAL  90          21HG      VAL  90  -0.062  -3.691  -7.466
  674   2HG2  VAL  90          22HG      VAL  90   0.295  -5.400  -7.720
  675   3HG2  VAL  90          23HG      VAL  90   1.323  -4.164  -8.452
  676    H    ILE  91           H        ILE  91   0.591  -5.976  -3.054
  677    HA   ILE  91           HA       ILE  91   2.741  -4.576  -1.686
  678    HB   ILE  91           HB       ILE  91   0.362  -6.212  -0.812
  679   1HG1  ILE  91          11HG      ILE  91   1.122  -3.358  -0.264
  680   2HG1  ILE  91          12HG      ILE  91  -0.025  -3.856  -1.497
  681   1HG2  ILE  91          21HG      ILE  91   2.196  -6.807   0.684
  682   2HG2  ILE  91          22HG      ILE  91   0.966  -5.845   1.501
  683   3HG2  ILE  91          23HG      ILE  91   2.485  -5.094   1.007
  684   1HD1  ILE  91          11HD      ILE  91  -1.399  -4.789   0.146
  685   2HD1  ILE  91          12HD      ILE  91  -1.085  -3.039   0.355
  686   3HD1  ILE  91          13HD      ILE  91  -0.288  -4.224   1.429
  687    H    GLY  92           H        GLY  92   4.227  -5.957  -0.481
  688   1HA   GLY  92          1HA       GLY  92   4.351  -8.605  -1.658
  689   2HA   GLY  92          2HA       GLY  92   5.793  -7.609  -1.631
  690    H    ARG  93           H        ARG  93   5.372 -10.144  -0.412
  691    HA   ARG  93           HA       ARG  93   5.763  -9.371   2.384
  692   1HB   ARG  93          1HB       ARG  93   3.620 -10.618   1.925
  693   2HB   ARG  93          2HB       ARG  93   4.606 -11.996   1.448
  694   1HG   ARG  93          1HG       ARG  93   3.891 -12.330   3.692
  695   2HG   ARG  93          2HG       ARG  93   5.620 -11.957   3.709
  696   1HD   ARG  93          1HD       ARG  93   5.058  -9.593   4.206
  697   2HD   ARG  93          2HD       ARG  93   3.362 -10.054   4.297
  698    HE   ARG  93           HE       ARG  93   4.963 -11.595   6.037
  699   1HH1  ARG  93          11HH      ARG  93   3.306  -8.497   5.654
  700   2HH1  ARG  93          12HH      ARG  93   3.418  -8.074   7.311
  701   1HH2  ARG  93          21HH      ARG  93   5.043 -11.045   8.315
  702   2HH2  ARG  93          22HH      ARG  93   4.377  -9.562   8.862
  703    H    GLU  94           H        GLU  94   7.894  -9.651   2.871
  704    HA   GLU  94           HA       GLU  94   9.266 -11.861   1.615
  705   1HB   GLU  94          1HB       GLU  94  11.376 -10.918   2.510
  706   2HB   GLU  94          2HB       GLU  94  10.493  -9.765   1.536
  707   1HG   GLU  94          1HG       GLU  94   9.833  -8.526   3.457
  708   2HG   GLU  94          2HG       GLU  94  10.481  -9.761   4.536
  Start of MODEL   18
    1   1H    GLY   1          1H        GLY   1  12.273 -12.094   3.342
    2   2H    GLY   1          2H        GLY   1  13.716 -11.310   2.970
    3   3H    GLY   1          3H        GLY   1  13.665 -12.420   4.256
    4   1HA   GLY   1          1HA       GLY   1  14.725 -13.365   2.327
    5   2HA   GLY   1          2HA       GLY   1  13.202 -14.181   2.668
    6    H    HIS   2           H        HIS   2  12.032 -14.528   0.911
    7    HA   HIS   2           HA       HIS   2  12.474 -12.945  -1.482
    8   1HB   HIS   2          1HB       HIS   2  12.441 -15.360  -1.745
    9   2HB   HIS   2          2HB       HIS   2  10.892 -15.466  -0.930
   10    HD1  HIS   2           HD1      HIS   2  12.424 -14.739  -4.288
   11    HD2  HIS   2           HD2      HIS   2   8.663 -14.875  -2.521
   12    HE1  HIS   2           HE1      HIS   2  10.766 -14.725  -6.169
   13    H    MET   3           H        MET   3  11.329 -11.116  -1.648
   14    HA   MET   3           HA       MET   3   8.791 -10.891  -0.294
   15   1HB   MET   3          1HB       MET   3  10.379  -8.969  -0.366
   16   2HB   MET   3          2HB       MET   3  10.169  -8.900  -2.111
   17   1HG   MET   3          1HG       MET   3   7.806  -8.417  -1.826
   18   2HG   MET   3          2HG       MET   3   7.972  -8.506  -0.078
   19   1HE   MET   3          1HE       MET   3   6.598  -5.991  -1.162
   20   2HE   MET   3          2HE       MET   3   7.487  -4.690  -0.374
   21   3HE   MET   3          3HE       MET   3   7.087  -6.153   0.526
   22    H    GLU   4           H        GLU   4   7.066 -11.662  -1.214
   23    HA   GLU   4           HA       GLU   4   7.061 -12.087  -4.087
   24   1HB   GLU   4          1HB       GLU   4   6.414 -13.932  -2.569
   25   2HB   GLU   4          2HB       GLU   4   5.121 -12.904  -1.955
   26   1HG   GLU   4          1HG       GLU   4   4.022 -12.919  -4.091
   27   2HG   GLU   4          2HG       GLU   4   5.356 -13.820  -4.797
   28    H    LEU   5           H        LEU   5   6.333 -10.437  -5.265
   29    HA   LEU   5           HA       LEU   5   4.549  -8.481  -4.092
   30   1HB   LEU   5          1HB       LEU   5   5.769  -8.549  -6.859
   31   2HB   LEU   5          2HB       LEU   5   4.882  -7.214  -6.158
   32    HG   LEU   5           HG       LEU   5   7.059  -6.549  -6.051
   33   1HD1  LEU   5          11HD      LEU   5   5.969  -6.163  -3.977
   34   2HD1  LEU   5          12HD      LEU   5   7.695  -6.455  -3.723
   35   3HD1  LEU   5          13HD      LEU   5   6.523  -7.730  -3.382
   36   1HD2  LEU   5          21HD      LEU   5   8.188  -8.602  -6.639
   37   2HD2  LEU   5          22HD      LEU   5   7.881  -9.261  -5.033
   38   3HD2  LEU   5          23HD      LEU   5   8.955  -7.876  -5.227
   39    H    PHE   6           H        PHE   6   2.411  -8.474  -4.421
   40    HA   PHE   6           HA       PHE   6   1.378  -9.925  -6.691
   41   1HB   PHE   6          1HB       PHE   6  -0.380 -10.797  -5.038
   42   2HB   PHE   6          2HB       PHE   6   1.141 -11.690  -5.179
   43    HD1  PHE   6           HD1      PHE   6  -0.785  -9.205  -3.286
   44    HD2  PHE   6           HD2      PHE   6   2.359 -12.009  -3.201
   45    HE1  PHE   6           HE1      PHE   6  -0.651  -8.953  -0.818
   46    HE2  PHE   6           HE2      PHE   6   2.535 -11.792  -0.789
   47    HZ   PHE   6           HZ       PHE   6   1.017 -10.252   0.436
   48    HA   PRO   7           HA       PRO   7  -1.536  -6.586  -6.634
   49   1HB   PRO   7          1HB       PRO   7  -3.240  -7.478  -8.415
   50   2HB   PRO   7          2HB       PRO   7  -1.634  -6.935  -8.884
   51   1HG   PRO   7          1HG       PRO   7  -2.649  -9.743  -8.549
   52   2HG   PRO   7          2HG       PRO   7  -1.537  -9.109  -9.782
   53   1HD   PRO   7          1HD       PRO   7  -0.793 -10.467  -7.458
   54   2HD   PRO   7          2HD       PRO   7   0.267  -9.381  -8.400
   55    H    VAL   8           H        VAL   8  -2.958  -6.297  -5.102
   56    HA   VAL   8           HA       VAL   8  -4.914  -8.386  -4.607
   57    HB   VAL   8           HB       VAL   8  -4.303  -6.017  -2.838
   58   1HG1  VAL   8          11HG      VAL   8  -5.436  -7.297  -1.089
   59   2HG1  VAL   8          12HG      VAL   8  -5.815  -8.547  -2.281
   60   3HG1  VAL   8          13HG      VAL   8  -6.468  -6.915  -2.468
   61   1HG2  VAL   8          21HG      VAL   8  -3.033  -7.547  -1.384
   62   2HG2  VAL   8          22HG      VAL   8  -2.305  -7.336  -2.979
   63   3HG2  VAL   8          23HG      VAL   8  -3.198  -8.811  -2.610
   64    H    GLU   9           H        GLU   9  -6.562  -7.906  -6.002
   65    HA   GLU   9           HA       GLU   9  -7.386  -5.163  -6.331
   66   1HB   GLU   9          1HB       GLU   9  -7.608  -6.848  -8.181
   67   2HB   GLU   9          2HB       GLU   9  -8.821  -7.679  -7.211
   68   1HG   GLU   9          1HG       GLU   9 -10.129  -5.531  -7.206
   69   2HG   GLU   9          2HG       GLU   9  -8.979  -4.923  -8.397
   70    H    LEU  10           H        LEU  10  -8.371  -4.274  -4.715
   71    HA   LEU  10           HA       LEU  10  -9.992  -5.928  -2.911
   72   1HB   LEU  10          1HB       LEU  10  -8.004  -4.123  -2.418
   73   2HB   LEU  10          2HB       LEU  10  -9.419  -3.097  -2.358
   74    HG   LEU  10           HG       LEU  10  -8.916  -3.707  -0.139
   75   1HD1  LEU  10          11HD      LEU  10 -11.285  -3.760  -0.620
   76   2HD1  LEU  10          12HD      LEU  10 -10.857  -4.943   0.613
   77   3HD1  LEU  10          13HD      LEU  10 -11.173  -5.468  -1.038
   78   1HD2  LEU  10          21HD      LEU  10  -7.446  -5.564  -0.598
   79   2HD2  LEU  10          22HD      LEU  10  -8.823  -6.559  -1.069
   80   3HD2  LEU  10          23HD      LEU  10  -8.659  -6.010   0.599
   81    H    GLU  11           H        GLU  11 -12.200  -5.524  -2.985
   82    HA   GLU  11           HA       GLU  11 -12.954  -3.087  -4.388
   83   1HB   GLU  11          1HB       GLU  11 -13.907  -5.219  -5.302
   84   2HB   GLU  11          2HB       GLU  11 -14.732  -5.455  -3.763
   85   1HG   GLU  11          1HG       GLU  11 -16.049  -3.493  -4.098
   86   2HG   GLU  11          2HG       GLU  11 -15.119  -3.062  -5.534
   87    H    LYS  12           H        LYS  12 -12.884  -1.615  -2.957
   88    HA   LYS  12           HA       LYS  12 -13.729  -2.095  -0.278
   89   1HB   LYS  12          1HB       LYS  12 -12.317   0.124  -1.630
   90   2HB   LYS  12          2HB       LYS  12 -13.062   0.472  -0.093
   91   1HG   LYS  12          1HG       LYS  12 -10.980  -1.648  -0.679
   92   2HG   LYS  12          2HG       LYS  12 -10.687  -0.122   0.169
   93   1HD   LYS  12          1HD       LYS  12 -12.825  -1.647   1.354
   94   2HD   LYS  12          2HD       LYS  12 -11.321  -2.599   1.337
   95   1HE   LYS  12          1HE       LYS  12 -11.468  -1.511   3.415
   96   2HE   LYS  12          2HE       LYS  12 -10.319  -0.573   2.512
   97   1HZ   LYS  12          1HZ       LYS  12 -13.199   0.154   2.861
   98   2HZ   LYS  12          2HZ       LYS  12 -12.129   1.038   1.952
   99   3HZ   LYS  12          3HZ       LYS  12 -11.915   0.914   3.609
  100    H    ASP  13           H        ASP  13 -14.770  -0.193   0.794
  101    HA   ASP  13           HA       ASP  13 -17.428  -0.013  -0.226
  102   1HB   ASP  13          1HB       ASP  13 -17.774   0.936   2.100
  103   2HB   ASP  13          2HB       ASP  13 -17.262  -0.742   2.016
  104    H    GLU  14           H        GLU  14 -18.448   2.111   0.455
  105    HA   GLU  14           HA       GLU  14 -17.430   4.015  -1.366
  106   1HB   GLU  14          1HB       GLU  14 -19.409   5.372  -0.707
  107   2HB   GLU  14          2HB       GLU  14 -19.764   3.738  -1.250
  108   1HG   GLU  14          1HG       GLU  14 -19.961   3.048   1.111
  109   2HG   GLU  14          2HG       GLU  14 -19.722   4.728   1.581
  110    H    ASP  15           H        ASP  15 -16.675   3.629   1.856
  111    HA   ASP  15           HA       ASP  15 -16.162   6.366   2.503
  112   1HB   ASP  15          1HB       ASP  15 -16.380   4.615   4.228
  113   2HB   ASP  15          2HB       ASP  15 -14.924   3.849   3.621
  114    H    GLY  16           H        GLY  16 -14.473   3.740   0.977
  115   1HA   GLY  16          1HA       GLY  16 -12.835   4.407  -0.723
  116   2HA   GLY  16          2HA       GLY  16 -12.175   5.507   0.498
  117    H    LEU  17           H        LEU  17 -10.323   4.665   1.195
  118    HA   LEU  17           HA       LEU  17 -10.328   1.773   1.727
  119   1HB   LEU  17          1HB       LEU  17  -7.970   3.567   2.166
  120   2HB   LEU  17          2HB       LEU  17  -8.002   1.838   1.969
  121    HG   LEU  17           HG       LEU  17  -8.406   3.916  -0.076
  122   1HD1  LEU  17          11HD      LEU  17  -6.417   2.879  -1.098
  123   2HD1  LEU  17          12HD      LEU  17  -6.285   1.849   0.333
  124   3HD1  LEU  17          13HD      LEU  17  -6.133   3.600   0.484
  125   1HD2  LEU  17          21HD      LEU  17  -8.671   0.926  -0.406
  126   2HD2  LEU  17          22HD      LEU  17  -8.588   2.095  -1.734
  127   3HD2  LEU  17          23HD      LEU  17  -9.940   2.137  -0.607
  128    H    GLY  18           H        GLY  18  -9.618   4.877   3.187
  129   1HA   GLY  18          1HA       GLY  18  -9.866   5.596   5.319
  130   2HA   GLY  18          2HA       GLY  18 -10.664   4.071   5.696
  131    H    ILE  19           H        ILE  19  -7.508   4.269   4.185
  132    HA   ILE  19           HA       ILE  19  -6.455   3.091   6.673
  133    HB   ILE  19           HB       ILE  19  -4.842   1.804   5.441
  134   1HG1  ILE  19          11HG      ILE  19  -5.883   3.122   2.920
  135   2HG1  ILE  19          12HG      ILE  19  -4.355   3.474   3.733
  136   1HG2  ILE  19          21HG      ILE  19  -7.079   0.835   5.598
  137   2HG2  ILE  19          22HG      ILE  19  -6.265   0.326   4.117
  138   3HG2  ILE  19          23HG      ILE  19  -7.509   1.574   4.058
  139   1HD1  ILE  19          11HD      ILE  19  -5.099   0.828   2.495
  140   2HD1  ILE  19          12HD      ILE  19  -3.574   1.208   3.295
  141   3HD1  ILE  19          13HD      ILE  19  -4.010   2.025   1.795
  142    H    SER  20           H        SER  20  -3.887   3.289   6.593
  143    HA   SER  20           HA       SER  20  -3.134   6.040   5.898
  144   1HB   SER  20          1HB       SER  20  -2.838   4.759   8.626
  145   2HB   SER  20          2HB       SER  20  -2.281   6.369   8.196
  146    HG   SER  20           HG       SER  20  -4.813   6.184   7.514
  147    H    ILE  21           H        ILE  21  -0.842   6.316   5.859
  148    HA   ILE  21           HA       ILE  21   0.660   3.798   5.593
  149    HB   ILE  21           HB       ILE  21   1.878   4.827   3.702
  150   1HG1  ILE  21          11HG      ILE  21   0.362   6.713   2.528
  151   2HG1  ILE  21          12HG      ILE  21  -0.047   7.041   4.188
  152   1HG2  ILE  21          21HG      ILE  21   0.144   4.473   1.993
  153   2HG2  ILE  21          22HG      ILE  21  -1.083   4.490   3.262
  154   3HG2  ILE  21          23HG      ILE  21   0.142   3.223   3.237
  155   1HD1  ILE  21          11HD      ILE  21   2.298   7.428   4.741
  156   2HD1  ILE  21          12HD      ILE  21   1.799   8.492   3.445
  157   3HD1  ILE  21          13HD      ILE  21   2.769   7.085   3.089
  158    H    ILE  22           H        ILE  22   3.038   4.213   5.676
  159    HA   ILE  22           HA       ILE  22   3.631   6.673   7.020
  160    HB   ILE  22           HB       ILE  22   3.205   5.140   8.815
  161   1HG1  ILE  22          11HG      ILE  22   6.175   5.692   8.585
  162   2HG1  ILE  22          12HG      ILE  22   4.964   6.820   9.172
  163   1HG2  ILE  22          21HG      ILE  22   5.356   3.400   7.653
  164   2HG2  ILE  22          22HG      ILE  22   3.631   3.033   7.733
  165   3HG2  ILE  22          23HG      ILE  22   4.586   3.140   9.219
  166   1HD1  ILE  22          11HD      ILE  22   6.217   5.828  11.001
  167   2HD1  ILE  22          12HD      ILE  22   5.736   4.218  10.474
  168   3HD1  ILE  22          13HD      ILE  22   4.523   5.346  11.075
  169    H    GLY  23           H        GLY  23   5.588   7.517   6.541
  170   1HA   GLY  23          1HA       GLY  23   7.056   6.098   4.484
  171   2HA   GLY  23          2HA       GLY  23   7.190   7.822   4.852
  172    H    MET  24           H        MET  24   8.489   4.809   5.160
  173    HA   MET  24           HA       MET  24  10.383   5.738   7.220
  174   1HB   MET  24          1HB       MET  24   9.463   2.900   6.689
  175   2HB   MET  24          2HB       MET  24  10.718   3.353   7.826
  176   1HG   MET  24          1HG       MET  24   7.806   4.092   7.995
  177   2HG   MET  24          2HG       MET  24   8.628   2.864   8.958
  178   1HE   MET  24          1HE       MET  24  11.449   4.418   9.503
  179   2HE   MET  24          2HE       MET  24  10.586   3.438  10.685
  180   3HE   MET  24          3HE       MET  24  11.078   5.084  11.094
  181    H    GLY  25           H        GLY  25  11.984   6.420   5.917
  182   1HA   GLY  25          1HA       GLY  25  12.513   5.275   3.388
  183   2HA   GLY  25          2HA       GLY  25  13.541   6.437   4.185
  184    H    VAL  26           H        VAL  26  13.031   3.251   3.320
  185    HA   VAL  26           HA       VAL  26  15.475   2.329   4.665
  186    HB   VAL  26           HB       VAL  26  13.244   1.306   5.411
  187   1HG1  VAL  26          11HG      VAL  26  12.030   1.315   3.377
  188   2HG1  VAL  26          12HG      VAL  26  12.132  -0.336   3.992
  189   3HG1  VAL  26          13HG      VAL  26  13.156   0.169   2.647
  190   1HG2  VAL  26          21HG      VAL  26  15.290   0.065   5.800
  191   2HG2  VAL  26          22HG      VAL  26  15.200  -0.632   4.182
  192   3HG2  VAL  26          23HG      VAL  26  13.976  -1.035   5.390
  193    H    GLY  27           H        GLY  27  15.252   3.761   2.390
  194   1HA   GLY  27          1HA       GLY  27  15.150   1.981   0.081
  195   2HA   GLY  27          2HA       GLY  27  15.053   3.723   0.018
  196    H    ALA  28           H        ALA  28  17.668   3.600   1.799
  197    HA   ALA  28           HA       ALA  28  19.351   2.961  -0.517
  198   1HB   ALA  28          1HB       ALA  28  20.608   5.002  -0.334
  199   2HB   ALA  28          2HB       ALA  28  19.629   5.510   1.044
  200   3HB   ALA  28          3HB       ALA  28  18.895   5.361  -0.553
  201    H    ASP  29           H        ASP  29  20.055   4.362   2.606
  202    HA   ASP  29           HA       ASP  29  22.541   3.064   2.884
  203   1HB   ASP  29          1HB       ASP  29  21.992   5.131   4.083
  204   2HB   ASP  29          2HB       ASP  29  20.815   4.258   5.059
  205    H    ALA  30           H        ALA  30  19.373   2.158   3.866
  206    HA   ALA  30           HA       ALA  30  19.972   0.142   5.720
  207   1HB   ALA  30          1HB       ALA  30  17.592   0.335   3.901
  208   2HB   ALA  30          2HB       ALA  30  17.763   1.130   5.467
  209   3HB   ALA  30          3HB       ALA  30  17.712  -0.631   5.369
  210    H    GLY  31           H        GLY  31  20.103   0.106   2.234
  211   1HA   GLY  31          1HA       GLY  31  21.291  -1.510   1.007
  212   2HA   GLY  31          2HA       GLY  31  21.191  -2.576   2.405
  213    H    LEU  32           H        LEU  32  18.183  -1.569   2.107
  214    HA   LEU  32           HA       LEU  32  17.409  -3.990   0.733
  215   1HB   LEU  32          1HB       LEU  32  15.796  -1.897   2.177
  216   2HB   LEU  32          2HB       LEU  32  15.039  -3.176   1.261
  217    HG   LEU  32           HG       LEU  32  16.109  -4.849   2.770
  218   1HD1  LEU  32          11HD      LEU  32  18.028  -3.543   3.535
  219   2HD1  LEU  32          12HD      LEU  32  17.071  -4.153   4.886
  220   3HD1  LEU  32          13HD      LEU  32  16.940  -2.463   4.405
  221   1HD2  LEU  32          21HD      LEU  32  13.837  -4.123   3.152
  222   2HD2  LEU  32          22HD      LEU  32  14.413  -2.761   4.111
  223   3HD2  LEU  32          23HD      LEU  32  14.657  -4.410   4.686
  224    H    GLU  33           H        GLU  33  17.230  -0.571   0.243
  225    HA   GLU  33           HA       GLU  33  16.680   0.758  -1.430
  226   1HB   GLU  33          1HB       GLU  33  17.794  -1.487  -3.094
  227   2HB   GLU  33          2HB       GLU  33  17.450   0.127  -3.706
  228   1HG   GLU  33          1HG       GLU  33  19.068   1.029  -2.063
  229   2HG   GLU  33          2HG       GLU  33  19.464  -0.628  -1.602
  230    H    LYS  34           H        LYS  34  14.508   0.684  -0.899
  231    HA   LYS  34           HA       LYS  34  12.818   0.028  -3.078
  232   1HB   LYS  34          1HB       LYS  34  11.397  -1.502  -1.848
  233   2HB   LYS  34          2HB       LYS  34  13.039  -2.132  -1.793
  234   1HG   LYS  34          1HG       LYS  34  13.183  -0.907   0.488
  235   2HG   LYS  34          2HG       LYS  34  11.443  -0.848   0.382
  236   1HD   LYS  34          1HD       LYS  34  13.068  -3.388   0.279
  237   2HD   LYS  34          2HD       LYS  34  12.195  -2.794   1.688
  238   1HE   LYS  34          1HE       LYS  34  10.095  -2.982   0.466
  239   2HE   LYS  34          2HE       LYS  34  10.963  -3.548  -0.958
  240   1HZ   LYS  34          1HZ       LYS  34  11.763  -5.432   0.433
  241   2HZ   LYS  34          2HZ       LYS  34  10.116  -5.423   0.152
  242   3HZ   LYS  34          3HZ       LYS  34  10.683  -4.966   1.652
  243    H    LEU  35           H        LEU  35  10.631   0.894  -2.462
  244    HA   LEU  35           HA       LEU  35  10.552   3.337  -1.184
  245   1HB   LEU  35          1HB       LEU  35   8.146   2.986  -1.318
  246   2HB   LEU  35          2HB       LEU  35   8.960   2.463  -2.790
  247    HG   LEU  35           HG       LEU  35   8.889   0.204  -1.217
  248   1HD1  LEU  35          11HD      LEU  35   6.291   1.644  -0.974
  249   2HD1  LEU  35          12HD      LEU  35   7.377   1.051   0.304
  250   3HD1  LEU  35          13HD      LEU  35   6.521  -0.085  -0.724
  251   1HD2  LEU  35          21HD      LEU  35   8.661   0.301  -3.605
  252   2HD2  LEU  35          22HD      LEU  35   7.012   0.951  -3.449
  253   3HD2  LEU  35          23HD      LEU  35   7.407  -0.676  -2.868
  254    H    GLY  36           H        GLY  36   9.812   3.877   0.968
  255   1HA   GLY  36          1HA       GLY  36   9.785   1.574   2.774
  256   2HA   GLY  36          2HA       GLY  36  10.360   3.177   3.217
  257    H    ILE  37           H        ILE  37   7.490   2.538   1.345
  258    HA   ILE  37           HA       ILE  37   6.024   3.955   3.391
  259    HB   ILE  37           HB       ILE  37   5.098   3.109   0.640
  260   1HG1  ILE  37          11HG      ILE  37   6.981   4.784   0.834
  261   2HG1  ILE  37          12HG      ILE  37   5.570   5.375  -0.086
  262   1HG2  ILE  37          21HG      ILE  37   3.848   4.937   2.709
  263   2HG2  ILE  37          22HG      ILE  37   3.257   3.352   2.245
  264   3HG2  ILE  37          23HG      ILE  37   3.223   4.680   1.079
  265   1HD1  ILE  37          11HD      ILE  37   6.500   6.010   2.697
  266   2HD1  ILE  37          12HD      ILE  37   4.946   6.534   2.059
  267   3HD1  ILE  37          13HD      ILE  37   6.445   7.102   1.313
  268    H    PHE  38           H        PHE  38   5.572   2.696   4.918
  269    HA   PHE  38           HA       PHE  38   4.531   0.019   4.420
  270   1HB   PHE  38          1HB       PHE  38   5.398   1.440   6.922
  271   2HB   PHE  38          2HB       PHE  38   4.620  -0.135   6.943
  272    HD1  PHE  38           HD1      PHE  38   7.708   1.690   6.327
  273    HD2  PHE  38           HD2      PHE  38   5.748  -2.069   5.973
  274    HE1  PHE  38           HE1      PHE  38   9.876   0.593   6.024
  275    HE2  PHE  38           HE2      PHE  38   7.891  -3.174   5.661
  276    HZ   PHE  38           HZ       PHE  38   9.987  -1.839   5.695
  277    H    VAL  39           H        VAL  39   2.608  -0.638   5.583
  278    HA   VAL  39           HA       VAL  39   0.611   1.410   5.440
  279    HB   VAL  39           HB       VAL  39   0.339  -1.462   6.420
  280   1HG1  VAL  39          11HG      VAL  39  -1.751   0.517   5.510
  281   2HG1  VAL  39          12HG      VAL  39  -1.486  -0.021   7.165
  282   3HG1  VAL  39          13HG      VAL  39  -2.056  -1.163   5.945
  283   1HG2  VAL  39          21HG      VAL  39   1.129  -1.414   4.114
  284   2HG2  VAL  39          22HG      VAL  39  -0.173  -0.314   3.674
  285   3HG2  VAL  39          23HG      VAL  39  -0.546  -1.964   4.179
  286    H    LYS  40           H        LYS  40  -0.067   2.561   7.065
  287    HA   LYS  40           HA       LYS  40   1.310   2.318   9.613
  288   1HB   LYS  40          1HB       LYS  40   1.275   4.489   8.560
  289   2HB   LYS  40          2HB       LYS  40  -0.466   4.436   8.415
  290   1HG   LYS  40          1HG       LYS  40   0.189   5.951  10.157
  291   2HG   LYS  40          2HG       LYS  40  -0.671   4.574  10.838
  292   1HD   LYS  40          1HD       LYS  40   1.455   3.587  11.525
  293   2HD   LYS  40          2HD       LYS  40   2.326   4.958  10.819
  294   1HE   LYS  40          1HE       LYS  40   1.157   6.464  12.264
  295   2HE   LYS  40          2HE       LYS  40   0.248   5.124  12.970
  296   1HZ   LYS  40          1HZ       LYS  40   3.203   5.555  13.173
  297   2HZ   LYS  40          2HZ       LYS  40   2.390   4.245  13.842
  298   3HZ   LYS  40          3HZ       LYS  40   2.082   5.807  14.385
  299    H    THR  41           H        THR  41  -1.996   2.552   8.356
  300    HA   THR  41           HA       THR  41  -2.994   1.017  10.601
  301    HB   THR  41           HB       THR  41  -4.456   3.426   9.841
  302    HG1  THR  41           HG1      THR  41  -3.287   4.485  11.766
  303   1HG2  THR  41          21HG      THR  41  -4.096   2.019  12.482
  304   2HG2  THR  41          22HG      THR  41  -5.479   1.898  11.385
  305   3HG2  THR  41          23HG      THR  41  -5.143   3.414  12.224
  306    H    VAL  42           H        VAL  42  -5.229   0.409  10.066
  307    HA   VAL  42           HA       VAL  42  -5.968   0.831   7.295
  308    HB   VAL  42           HB       VAL  42  -6.354  -1.754   8.900
  309   1HG1  VAL  42          11HG      VAL  42  -7.234  -2.731   6.793
  310   2HG1  VAL  42          12HG      VAL  42  -7.115  -1.127   6.063
  311   3HG1  VAL  42          13HG      VAL  42  -8.214  -1.397   7.407
  312   1HG2  VAL  42          21HG      VAL  42  -4.852  -2.807   7.275
  313   2HG2  VAL  42          22HG      VAL  42  -4.045  -1.512   8.161
  314   3HG2  VAL  42          23HG      VAL  42  -4.593  -1.241   6.505
  315    H    THR  43           H        THR  43  -8.399   0.828   7.122
  316    HA   THR  43           HA       THR  43  -9.903   2.004   9.132
  317    HB   THR  43           HB       THR  43 -10.643   1.955   6.777
  318    HG1  THR  43           HG1      THR  43 -12.590   2.068   7.491
  319   1HG2  THR  43          21HG      THR  43 -11.045  -1.002   7.205
  320   2HG2  THR  43          22HG      THR  43  -9.806  -0.267   6.188
  321   3HG2  THR  43          23HG      THR  43 -11.510  -0.106   5.757
  322    H    GLU  44           H        GLU  44 -11.789   0.915  10.293
  323    HA   GLU  44           HA       GLU  44 -10.831  -1.044  12.047
  324   1HB   GLU  44          1HB       GLU  44 -12.649   0.501  12.646
  325   2HB   GLU  44          2HB       GLU  44 -13.709  -0.279  11.487
  326   1HG   GLU  44          1HG       GLU  44 -13.614  -2.343  12.778
  327   2HG   GLU  44          2HG       GLU  44 -12.531  -1.574  13.932
  328    H    GLY  45           H        GLY  45 -12.717  -1.335   9.147
  329   1HA   GLY  45          1HA       GLY  45 -11.852  -4.068   8.869
  330   2HA   GLY  45          2HA       GLY  45 -13.577  -3.894   9.133
  331    H    GLY  46           H        GLY  46 -14.292  -1.881   7.875
  332   1HA   GLY  46          1HA       GLY  46 -15.379  -1.391   5.936
  333   2HA   GLY  46          2HA       GLY  46 -13.736  -1.220   5.326
  334    H    ALA  47           H        ALA  47 -13.098  -2.462   4.064
  335    HA   ALA  47           HA       ALA  47 -14.163  -5.162   3.681
  336   1HB   ALA  47          1HB       ALA  47 -15.238  -3.699   1.953
  337   2HB   ALA  47          2HB       ALA  47 -14.285  -5.020   1.291
  338   3HB   ALA  47          3HB       ALA  47 -13.624  -3.393   1.284
  339    H    ALA  48           H        ALA  48 -11.653  -3.428   4.474
  340    HA   ALA  48           HA       ALA  48  -9.627  -4.570   2.702
  341   1HB   ALA  48          1HB       ALA  48  -9.352  -2.213   3.289
  342   2HB   ALA  48          2HB       ALA  48  -8.031  -3.164   3.961
  343   3HB   ALA  48          3HB       ALA  48  -9.349  -2.626   5.001
  344    H    GLN  49           H        GLN  49 -10.254  -4.309   6.248
  345    HA   GLN  49           HA       GLN  49  -8.549  -6.545   6.585
  346   1HB   GLN  49          1HB       GLN  49 -10.289  -4.976   8.367
  347   2HB   GLN  49          2HB       GLN  49  -9.473  -6.429   9.001
  348   1HG   GLN  49          1HG       GLN  49  -7.352  -5.299   8.084
  349   2HG   GLN  49          2HG       GLN  49  -8.373  -3.861   7.956
  350   1HE2  GLN  49          21HE      GLN  49  -8.997  -2.791   9.831
  351   2HE2  GLN  49          22HE      GLN  49  -8.314  -3.161  11.347
  352    H    ARG  50           H        ARG  50 -11.896  -6.093   5.995
  353    HA   ARG  50           HA       ARG  50 -12.669  -8.719   6.686
  354   1HB   ARG  50          1HB       ARG  50 -13.882  -6.733   4.801
  355   2HB   ARG  50          2HB       ARG  50 -14.540  -8.352   4.988
  356   1HG   ARG  50          1HG       ARG  50 -14.169  -6.364   7.192
  357   2HG   ARG  50          2HG       ARG  50 -15.717  -6.685   6.384
  358   1HD   ARG  50          1HD       ARG  50 -14.075  -8.575   8.105
  359   2HD   ARG  50          2HD       ARG  50 -15.648  -7.892   8.471
  360    HE   ARG  50           HE       ARG  50 -16.120  -9.211   6.191
  361   1HH1  ARG  50          11HH      ARG  50 -14.603 -10.244   9.245
  362   2HH1  ARG  50          12HH      ARG  50 -15.143 -11.851   9.124
  363   1HH2  ARG  50          21HH      ARG  50 -16.861 -11.466   6.056
  364   2HH2  ARG  50          22HH      ARG  50 -16.418 -12.545   7.293
  365    H    ASP  51           H        ASP  51 -11.004  -7.364   3.981
  366    HA   ASP  51           HA       ASP  51 -11.107  -9.699   2.370
  367   1HB   ASP  51          1HB       ASP  51 -10.445  -7.647   1.315
  368   2HB   ASP  51          2HB       ASP  51  -9.199  -7.363   2.519
  369    H    GLY  52           H        GLY  52  -8.386  -8.353   4.251
  370   1HA   GLY  52          1HA       GLY  52  -7.188  -9.414   5.951
  371   2HA   GLY  52          2HA       GLY  52  -8.030 -10.909   5.595
  372    H    ARG  53           H        ARG  53  -7.052  -9.915   2.664
  373    HA   ARG  53           HA       ARG  53  -4.740 -11.645   2.728
  374   1HB   ARG  53          1HB       ARG  53  -6.646 -11.625   0.941
  375   2HB   ARG  53          2HB       ARG  53  -5.909 -10.153   0.356
  376   1HG   ARG  53          1HG       ARG  53  -4.416 -12.751   0.535
  377   2HG   ARG  53          2HG       ARG  53  -5.380 -12.309  -0.861
  378   1HD   ARG  53          1HD       ARG  53  -3.983 -10.339  -1.213
  379   2HD   ARG  53          2HD       ARG  53  -3.038 -10.750   0.222
  380    HE   ARG  53           HE       ARG  53  -2.225 -12.678  -0.889
  381   1HH1  ARG  53          11HH      ARG  53  -3.959 -10.469  -3.092
  382   2HH1  ARG  53          12HH      ARG  53  -3.225 -11.106  -4.490
  383   1HH2  ARG  53          21HH      ARG  53  -1.258 -13.519  -2.844
  384   2HH2  ARG  53          22HH      ARG  53  -1.695 -12.854  -4.347
  385    H    ILE  54           H        ILE  54  -5.747  -8.348   2.327
  386    HA   ILE  54           HA       ILE  54  -2.994  -7.371   2.363
  387    HB   ILE  54           HB       ILE  54  -4.773  -6.194   0.957
  388   1HG1  ILE  54          11HG      ILE  54  -3.583  -4.507   3.178
  389   2HG1  ILE  54          12HG      ILE  54  -2.718  -5.027   1.737
  390   1HG2  ILE  54          21HG      ILE  54  -6.398  -4.728   2.175
  391   2HG2  ILE  54          22HG      ILE  54  -5.856  -5.503   3.683
  392   3HG2  ILE  54          23HG      ILE  54  -6.679  -6.456   2.455
  393   1HD1  ILE  54          11HD      ILE  54  -5.120  -3.211   1.803
  394   2HD1  ILE  54          12HD      ILE  54  -4.245  -3.729   0.355
  395   3HD1  ILE  54          13HD      ILE  54  -3.439  -2.725   1.552
  396    H    GLN  55           H        GLN  55  -2.144  -6.342   4.239
  397    HA   GLN  55           HA       GLN  55  -3.904  -6.272   6.530
  398   1HB   GLN  55          1HB       GLN  55  -1.265  -7.747   6.405
  399   2HB   GLN  55          2HB       GLN  55  -2.012  -7.301   7.932
  400   1HG   GLN  55          1HG       GLN  55  -3.836  -8.726   7.598
  401   2HG   GLN  55          2HG       GLN  55  -3.511  -8.881   5.878
  402   1HE2  GLN  55          21HE      GLN  55  -3.577 -11.072   6.005
  403   2HE2  GLN  55          22HE      GLN  55  -2.332 -12.039   6.695
  404    H    VAL  56           H        VAL  56  -2.406  -5.292   8.528
  405    HA   VAL  56           HA       VAL  56  -1.667  -2.658   7.544
  406    HB   VAL  56           HB       VAL  56  -3.059  -3.114   9.652
  407   1HG1  VAL  56          11HG      VAL  56  -1.796  -4.734  10.797
  408   2HG1  VAL  56          12HG      VAL  56  -1.827  -3.274  11.782
  409   3HG1  VAL  56          13HG      VAL  56  -0.385  -3.679  10.852
  410   1HG2  VAL  56          21HG      VAL  56  -2.312  -0.855   9.116
  411   2HG2  VAL  56          22HG      VAL  56  -0.752  -1.181   9.860
  412   3HG2  VAL  56          23HG      VAL  56  -2.207  -1.134  10.847
  413    H    ASN  57           H        ASN  57  -0.054  -5.499   8.255
  414    HA   ASN  57           HA       ASN  57   2.398  -4.176   9.095
  415   1HB   ASN  57          1HB       ASN  57   3.237  -6.308   9.718
  416   2HB   ASN  57          2HB       ASN  57   1.515  -6.339  10.106
  417   1HD2  ASN  57          21HD      ASN  57   0.155  -7.710   8.935
  418   2HD2  ASN  57          22HD      ASN  57   0.732  -8.916   7.873
  419    H    ASP  58           H        ASP  58   0.971  -4.414   6.401
  420    HA   ASP  58           HA       ASP  58   2.958  -5.561   4.647
  421   1HB   ASP  58          1HB       ASP  58   0.320  -4.197   4.060
  422   2HB   ASP  58          2HB       ASP  58   1.348  -4.986   2.877
  423    H    GLN  59           H        GLN  59   2.976  -4.112   2.520
  424    HA   GLN  59           HA       GLN  59   3.684  -1.385   3.170
  425   1HB   GLN  59          1HB       GLN  59   5.768  -2.533   3.432
  426   2HB   GLN  59          2HB       GLN  59   5.486  -3.481   1.980
  427   1HG   GLN  59          1HG       GLN  59   5.794  -1.586   0.598
  428   2HG   GLN  59          2HG       GLN  59   5.853  -0.510   1.993
  429   1HE2  GLN  59          21HE      GLN  59   7.673  -0.422   3.202
  430   2HE2  GLN  59          22HE      GLN  59   9.184  -1.073   2.664
  431    H    ILE  60           H        ILE  60   3.004  -0.047   1.574
  432    HA   ILE  60           HA       ILE  60   1.531  -1.188  -0.624
  433    HB   ILE  60           HB       ILE  60   2.209   1.730  -0.134
  434   1HG1  ILE  60          11HG      ILE  60   0.917   0.933   1.795
  435   2HG1  ILE  60          12HG      ILE  60  -0.064   1.960   0.744
  436   1HG2  ILE  60          21HG      ILE  60   0.363   2.203  -1.638
  437   2HG2  ILE  60          22HG      ILE  60   0.037   0.476  -1.766
  438   3HG2  ILE  60          23HG      ILE  60   1.538   1.125  -2.416
  439   1HD1  ILE  60          11HD      ILE  60  -1.344   0.075   1.573
  440   2HD1  ILE  60          12HD      ILE  60  -0.175  -1.037   0.869
  441   3HD1  ILE  60          13HD      ILE  60  -1.155  -0.009  -0.181
  442    H    VAL  61           H        VAL  61   2.785  -1.986  -2.236
  443    HA   VAL  61           HA       VAL  61   5.349  -0.768  -2.833
  444    HB   VAL  61           HB       VAL  61   3.929  -3.170  -4.025
  445   1HG1  VAL  61          11HG      VAL  61   6.786  -2.326  -4.436
  446   2HG1  VAL  61          12HG      VAL  61   5.478  -2.296  -5.640
  447   3HG1  VAL  61          13HG      VAL  61   6.021  -3.834  -4.961
  448   1HG2  VAL  61          21HG      VAL  61   6.166  -3.034  -2.023
  449   2HG2  VAL  61          22HG      VAL  61   5.500  -4.506  -2.735
  450   3HG2  VAL  61          23HG      VAL  61   4.493  -3.492  -1.708
  451    H    GLU  62           H        GLU  62   2.334  -1.445  -4.491
  452    HA   GLU  62           HA       GLU  62   2.607   0.983  -6.048
  453   1HB   GLU  62          1HB       GLU  62   3.682  -0.600  -7.454
  454   2HB   GLU  62          2HB       GLU  62   2.423  -1.788  -7.239
  455   1HG   GLU  62          1HG       GLU  62   0.856  -0.154  -8.335
  456   2HG   GLU  62          2HG       GLU  62   2.286   0.818  -8.680
  457    H    VAL  63           H        VAL  63   0.606   1.886  -6.224
  458    HA   VAL  63           HA       VAL  63  -1.674   0.108  -5.982
  459    HB   VAL  63           HB       VAL  63  -1.213   2.764  -4.629
  460   1HG1  VAL  63          11HG      VAL  63  -3.944   1.717  -5.440
  461   2HG1  VAL  63          12HG      VAL  63  -3.166   3.183  -6.060
  462   3HG1  VAL  63          13HG      VAL  63  -3.637   3.081  -4.354
  463   1HG2  VAL  63          21HG      VAL  63  -2.715   0.271  -3.903
  464   2HG2  VAL  63          22HG      VAL  63  -2.373   1.628  -2.834
  465   3HG2  VAL  63          23HG      VAL  63  -1.051   0.623  -3.461
  466    H    ASP  64           H        ASP  64  -2.986   0.069  -7.559
  467    HA   ASP  64           HA       ASP  64  -4.147   0.501  -9.397
  468   1HB   ASP  64          1HB       ASP  64  -4.749   2.673  -8.421
  469   2HB   ASP  64          2HB       ASP  64  -3.286   3.387  -9.086
  470    H    GLY  65           H        GLY  65  -1.014   0.817  -9.294
  471   1HA   GLY  65          1HA       GLY  65   0.485   0.147 -11.058
  472   2HA   GLY  65          2HA       GLY  65  -0.723   0.738 -12.203
  473    H    ILE  66           H        ILE  66  -0.286   2.786  -9.558
  474    HA   ILE  66           HA       ILE  66   0.785   4.891 -11.159
  475    HB   ILE  66           HB       ILE  66  -0.795   5.008  -9.003
  476   1HG1  ILE  66          11HG      ILE  66   1.492   6.954  -9.355
  477   2HG1  ILE  66          12HG      ILE  66   0.055   6.912 -10.377
  478   1HG2  ILE  66          21HG      ILE  66   0.694   3.861  -7.491
  479   2HG2  ILE  66          22HG      ILE  66   0.430   5.528  -6.955
  480   3HG2  ILE  66          23HG      ILE  66   1.937   5.081  -7.760
  481   1HD1  ILE  66          11HD      ILE  66  -0.084   8.650  -8.681
  482   2HD1  ILE  66          12HD      ILE  66   0.117   7.414  -7.436
  483   3HD1  ILE  66          13HD      ILE  66  -1.327   7.412  -8.450
  484    H    SER  67           H        SER  67   2.091   2.416  -9.393
  485    HA   SER  67           HA       SER  67   4.041   1.874  -8.403
  486   1HB   SER  67          1HB       SER  67   6.061   2.140  -9.887
  487   2HB   SER  67          2HB       SER  67   4.665   1.432 -10.692
  488    HG   SER  67           HG       SER  67   4.495   4.054 -10.997
  489    H    LEU  68           H        LEU  68   4.076   2.897  -6.556
  490    HA   LEU  68           HA       LEU  68   5.194   5.585  -6.455
  491   1HB   LEU  68          1HB       LEU  68   4.274   5.608  -4.178
  492   2HB   LEU  68          2HB       LEU  68   3.057   5.308  -5.400
  493    HG   LEU  68           HG       LEU  68   3.937   2.803  -4.602
  494   1HD1  LEU  68          11HD      LEU  68   4.999   3.764  -2.697
  495   2HD1  LEU  68          12HD      LEU  68   3.606   2.799  -2.195
  496   3HD1  LEU  68          13HD      LEU  68   3.507   4.569  -2.209
  497   1HD2  LEU  68          21HD      LEU  68   1.476   4.353  -3.860
  498   2HD2  LEU  68          22HD      LEU  68   1.673   2.586  -3.780
  499   3HD2  LEU  68          23HD      LEU  68   1.767   3.422  -5.332
  500    H    VAL  69           H        VAL  69   6.440   2.957  -6.761
  501    HA   VAL  69           HA       VAL  69   8.116   2.273  -4.653
  502    HB   VAL  69           HB       VAL  69   8.854   2.157  -7.591
  503   1HG1  VAL  69          11HG      VAL  69   9.955   0.602  -5.246
  504   2HG1  VAL  69          12HG      VAL  69  10.799   1.838  -6.180
  505   3HG1  VAL  69          13HG      VAL  69  10.348   0.314  -6.941
  506   1HG2  VAL  69          21HG      VAL  69   6.742   1.008  -7.183
  507   2HG2  VAL  69          22HG      VAL  69   7.474   0.090  -5.869
  508   3HG2  VAL  69          23HG      VAL  69   8.021  -0.157  -7.528
  509    H    GLY  70           H        GLY  70   8.835   4.061  -3.602
  510   1HA   GLY  70          1HA       GLY  70  11.030   5.023  -3.160
  511   2HA   GLY  70          2HA       GLY  70  11.131   5.402  -4.874
  512    H    VAL  71           H        VAL  71   8.187   5.907  -3.081
  513    HA   VAL  71           HA       VAL  71   8.621   8.801  -3.458
  514    HB   VAL  71           HB       VAL  71   6.225   9.167  -3.429
  515   1HG1  VAL  71          11HG      VAL  71   7.194   8.618  -5.564
  516   2HG1  VAL  71          12HG      VAL  71   5.556   7.972  -5.441
  517   3HG1  VAL  71          13HG      VAL  71   6.942   6.898  -5.261
  518   1HG2  VAL  71          21HG      VAL  71   4.617   7.340  -3.227
  519   2HG2  VAL  71          22HG      VAL  71   5.617   7.460  -1.782
  520   3HG2  VAL  71          23HG      VAL  71   5.936   6.194  -2.968
  521    H    THR  72           H        THR  72   7.169  10.130  -1.890
  522    HA   THR  72           HA       THR  72   8.035   9.512   0.819
  523    HB   THR  72           HB       THR  72   7.100  11.857   1.146
  524    HG1  THR  72           HG1      THR  72   7.384  12.258  -1.599
  525   1HG2  THR  72          21HG      THR  72   9.092  12.918   0.165
  526   2HG2  THR  72          22HG      THR  72   9.398  11.453  -0.780
  527   3HG2  THR  72          23HG      THR  72   9.475  11.405   0.986
  528    H    GLN  73           H        GLN  73   6.469  10.255   2.503
  529    HA   GLN  73           HA       GLN  73   4.199   8.600   2.275
  530   1HB   GLN  73          1HB       GLN  73   3.869   8.857   4.532
  531   2HB   GLN  73          2HB       GLN  73   5.493   9.492   4.465
  532   1HG   GLN  73          1HG       GLN  73   2.983  11.167   4.443
  533   2HG   GLN  73          2HG       GLN  73   3.925  10.812   5.881
  534   1HE2  GLN  73          21HE      GLN  73   6.475  11.058   4.457
  535   2HE2  GLN  73          22HE      GLN  73   6.658  12.742   4.200
  536    H    ASN  74           H        ASN  74   4.667  11.974   1.659
  537    HA   ASN  74           HA       ASN  74   1.875  12.584   1.717
  538   1HB   ASN  74          1HB       ASN  74   2.429  14.787   0.866
  539   2HB   ASN  74          2HB       ASN  74   3.591  14.364   2.115
  540   1HD2  ASN  74          21HD      ASN  74   5.781  14.231   1.550
  541   2HD2  ASN  74          22HD      ASN  74   6.320  14.559  -0.042
  542    H    PHE  75           H        PHE  75   4.055  11.368  -0.704
  543    HA   PHE  75           HA       PHE  75   2.256  11.848  -2.881
  544   1HB   PHE  75          1HB       PHE  75   4.724  11.392  -3.195
  545   2HB   PHE  75          2HB       PHE  75   4.404   9.736  -2.687
  546    HD1  PHE  75           HD1      PHE  75   4.204  12.110  -5.395
  547    HD2  PHE  75           HD2      PHE  75   2.980   8.207  -4.161
  548    HE1  PHE  75           HE1      PHE  75   3.656  11.532  -7.718
  549    HE2  PHE  75           HE2      PHE  75   2.433   7.645  -6.489
  550    HZ   PHE  75           HZ       PHE  75   2.774   9.301  -8.262
  551    H    ALA  76           H        ALA  76   3.196   9.077  -0.948
  552    HA   ALA  76           HA       ALA  76   1.464   7.213  -2.049
  553   1HB   ALA  76          1HB       ALA  76   3.365   6.644  -0.649
  554   2HB   ALA  76          2HB       ALA  76   1.878   5.869  -0.096
  555   3HB   ALA  76          3HB       ALA  76   2.516   7.278   0.763
  556    H    ALA  77           H        ALA  77   0.966   9.232   0.856
  557    HA   ALA  77           HA       ALA  77  -1.533   8.254   1.584
  558   1HB   ALA  77          1HB       ALA  77  -0.221   9.775   2.997
  559   2HB   ALA  77          2HB       ALA  77  -1.864  10.379   2.762
  560   3HB   ALA  77          3HB       ALA  77  -0.528  11.086   1.860
  561    H    THR  78           H        THR  78  -0.658  10.644  -0.809
  562    HA   THR  78           HA       THR  78  -3.249  11.541  -1.443
  563    HB   THR  78           HB       THR  78  -0.700  11.478  -3.039
  564    HG1  THR  78           HG1      THR  78  -0.281  12.905  -1.563
  565   1HG2  THR  78          21HG      THR  78  -1.728  13.233  -4.464
  566   2HG2  THR  78          22HG      THR  78  -3.263  12.988  -3.612
  567   3HG2  THR  78          23HG      THR  78  -2.552  11.679  -4.558
  568    H    VAL  79           H        VAL  79  -1.199   8.989  -2.841
  569    HA   VAL  79           HA       VAL  79  -2.954   8.207  -4.898
  570    HB   VAL  79           HB       VAL  79  -1.084   6.333  -3.412
  571   1HG1  VAL  79          11HG      VAL  79  -2.731   5.280  -4.877
  572   2HG1  VAL  79          12HG      VAL  79  -1.092   5.052  -5.473
  573   3HG1  VAL  79          13HG      VAL  79  -2.157   6.241  -6.230
  574   1HG2  VAL  79          21HG      VAL  79  -0.547   8.195  -5.709
  575   2HG2  VAL  79          22HG      VAL  79   0.545   6.913  -5.176
  576   3HG2  VAL  79          23HG      VAL  79   0.175   8.262  -4.101
  577    H    LEU  80           H        LEU  80  -2.482   6.887  -1.650
  578    HA   LEU  80           HA       LEU  80  -4.592   5.030  -1.813
  579   1HB   LEU  80          1HB       LEU  80  -3.148   6.200   0.566
  580   2HB   LEU  80          2HB       LEU  80  -4.467   5.074   0.766
  581    HG   LEU  80           HG       LEU  80  -2.449   3.859   1.044
  582   1HD1  LEU  80          11HD      LEU  80  -2.528   2.172  -0.656
  583   2HD1  LEU  80          12HD      LEU  80  -3.438   3.253  -1.708
  584   3HD1  LEU  80          13HD      LEU  80  -4.150   2.695  -0.193
  585   1HD2  LEU  80          21HD      LEU  80  -0.668   3.709  -0.606
  586   2HD2  LEU  80          22HD      LEU  80  -0.877   5.369  -0.048
  587   3HD2  LEU  80          23HD      LEU  80  -1.500   4.884  -1.623
  588    H    ARG  81           H        ARG  81  -4.625   8.386  -1.279
  589    HA   ARG  81           HA       ARG  81  -7.303   8.430  -0.182
  590   1HB   ARG  81          1HB       ARG  81  -5.772  10.091   0.637
  591   2HB   ARG  81          2HB       ARG  81  -5.335  10.582  -0.980
  592   1HG   ARG  81          1HG       ARG  81  -8.135  10.982  -0.012
  593   2HG   ARG  81          2HG       ARG  81  -6.864  12.088   0.502
  594   1HD   ARG  81          1HD       ARG  81  -6.345  12.560  -1.840
  595   2HD   ARG  81          2HD       ARG  81  -7.601  11.440  -2.348
  596    HE   ARG  81           HE       ARG  81  -8.274  13.730  -0.658
  597   1HH1  ARG  81          11HH      ARG  81  -8.699  11.968  -3.711
  598   2HH1  ARG  81          12HH      ARG  81  -9.941  12.974  -4.273
  599   1HH2  ARG  81          21HH      ARG  81 -10.012  15.103  -1.444
  600   2HH2  ARG  81          22HH      ARG  81 -10.712  14.785  -2.960
  601    H    ASN  82           H        ASN  82  -5.817   8.563  -3.282
  602    HA   ASN  82           HA       ASN  82  -8.156   9.711  -4.538
  603   1HB   ASN  82          1HB       ASN  82  -5.420   9.115  -5.466
  604   2HB   ASN  82          2HB       ASN  82  -6.696   9.136  -6.682
  605   1HD2  ASN  82          21HD      ASN  82  -4.983  10.975  -4.311
  606   2HD2  ASN  82          22HD      ASN  82  -5.503  12.524  -4.901
  607    H    THR  83           H        THR  83  -7.498   6.817  -3.468
  608    HA   THR  83           HA       THR  83  -8.264   5.122  -5.596
  609    HB   THR  83           HB       THR  83  -8.589   3.462  -3.742
  610    HG1  THR  83           HG1      THR  83  -7.397   4.997  -1.834
  611   1HG2  THR  83          21HG      THR  83  -6.390   3.760  -4.849
  612   2HG2  THR  83          22HG      THR  83  -6.193   3.356  -3.152
  613   3HG2  THR  83          23HG      THR  83  -5.989   5.022  -3.690
  614    H    LYS  84           H        LYS  84 -10.173   3.516  -4.871
  615    HA   LYS  84           HA       LYS  84 -12.512   4.629  -3.863
  616   1HB   LYS  84          1HB       LYS  84 -13.729   4.174  -6.176
  617   2HB   LYS  84          2HB       LYS  84 -12.993   5.732  -5.868
  618   1HG   LYS  84          1HG       LYS  84 -12.498   5.095  -8.111
  619   2HG   LYS  84          2HG       LYS  84 -11.015   4.989  -7.176
  620   1HD   LYS  84          1HD       LYS  84 -11.307   2.545  -7.043
  621   2HD   LYS  84          2HD       LYS  84 -12.776   2.684  -8.018
  622   1HE   LYS  84          1HE       LYS  84 -11.426   3.738  -9.815
  623   2HE   LYS  84          2HE       LYS  84  -9.983   3.464  -8.844
  624   1HZ   LYS  84          1HZ       LYS  84 -10.446   1.062  -8.975
  625   2HZ   LYS  84          2HZ       LYS  84 -10.195   1.765 -10.481
  626   3HZ   LYS  84          3HZ       LYS  84 -11.756   1.386 -10.002
  627    H    GLY  85           H        GLY  85 -14.281   2.767  -5.025
  628   1HA   GLY  85          1HA       GLY  85 -14.134   0.544  -3.582
  629   2HA   GLY  85          2HA       GLY  85 -14.834   0.561  -5.186
  630    H    ASN  86           H        ASN  86 -13.314   0.028  -6.985
  631    HA   ASN  86           HA       ASN  86 -11.749  -2.251  -6.115
  632   1HB   ASN  86          1HB       ASN  86 -12.272  -1.264  -8.916
  633   2HB   ASN  86          2HB       ASN  86 -11.369  -2.725  -8.538
  634   1HD2  ASN  86          21HD      ASN  86 -12.513  -4.499  -7.603
  635   2HD2  ASN  86          22HD      ASN  86 -14.238  -4.588  -7.736
  636    H    VAL  87           H        VAL  87  -9.790  -2.129  -5.512
  637    HA   VAL  87           HA       VAL  87  -7.981  -0.127  -6.758
  638    HB   VAL  87           HB       VAL  87  -7.413  -1.266  -4.106
  639   1HG1  VAL  87          11HG      VAL  87  -6.324   0.877  -3.713
  640   2HG1  VAL  87          12HG      VAL  87  -6.826   1.400  -5.323
  641   3HG1  VAL  87          13HG      VAL  87  -5.729   0.030  -5.143
  642   1HG2  VAL  87          21HG      VAL  87  -9.339   1.021  -4.455
  643   2HG2  VAL  87          22HG      VAL  87  -8.613   0.478  -2.927
  644   3HG2  VAL  87          23HG      VAL  87  -9.674  -0.598  -3.834
  645    H    ARG  88           H        ARG  88  -6.100  -0.950  -7.487
  646    HA   ARG  88           HA       ARG  88  -5.489  -3.729  -6.851
  647   1HB   ARG  88          1HB       ARG  88  -4.689  -1.911  -9.058
  648   2HB   ARG  88          2HB       ARG  88  -3.640  -3.253  -8.622
  649   1HG   ARG  88          1HG       ARG  88  -5.408  -4.819  -8.987
  650   2HG   ARG  88          2HG       ARG  88  -6.545  -3.511  -9.307
  651   1HD   ARG  88          1HD       ARG  88  -5.643  -4.661 -11.301
  652   2HD   ARG  88          2HD       ARG  88  -5.444  -2.905 -11.267
  653    HE   ARG  88           HE       ARG  88  -3.116  -3.246 -10.757
  654   1HH1  ARG  88          11HH      ARG  88  -4.729  -6.276 -11.639
  655   2HH1  ARG  88          12HH      ARG  88  -3.375  -6.944 -12.407
  656   1HH2  ARG  88          21HH      ARG  88  -1.227  -4.170 -11.815
  657   2HH2  ARG  88          22HH      ARG  88  -1.336  -5.718 -12.507
  658    H    PHE  89           H        PHE  89  -4.575  -3.782  -4.955
  659    HA   PHE  89           HA       PHE  89  -2.371  -1.971  -4.343
  660   1HB   PHE  89          1HB       PHE  89  -3.596  -4.208  -2.712
  661   2HB   PHE  89          2HB       PHE  89  -2.343  -3.115  -2.164
  662    HD1  PHE  89           HD1      PHE  89  -2.861  -0.783  -1.743
  663    HD2  PHE  89           HD2      PHE  89  -5.862  -3.604  -2.738
  664    HE1  PHE  89           HE1      PHE  89  -4.559   0.746  -0.880
  665    HE2  PHE  89           HE2      PHE  89  -7.586  -2.067  -1.873
  666    HZ   PHE  89           HZ       PHE  89  -6.921   0.110  -0.934
  667    H    VAL  90           H        VAL  90  -0.549  -2.623  -5.384
  668    HA   VAL  90           HA       VAL  90  -0.113  -5.483  -5.521
  669    HB   VAL  90           HB       VAL  90   1.499  -3.267  -6.784
  670   1HG1  VAL  90          11HG      VAL  90   2.447  -5.057  -8.204
  671   2HG1  VAL  90          12HG      VAL  90   1.526  -6.247  -7.286
  672   3HG1  VAL  90          13HG      VAL  90   2.789  -5.308  -6.493
  673   1HG2  VAL  90          21HG      VAL  90  -0.620  -5.003  -8.047
  674   2HG2  VAL  90          22HG      VAL  90   0.410  -3.857  -8.908
  675   3HG2  VAL  90          23HG      VAL  90  -0.748  -3.278  -7.710
  676    H    ILE  91           H        ILE  91   0.249  -5.669  -3.433
  677    HA   ILE  91           HA       ILE  91   2.551  -4.411  -2.158
  678    HB   ILE  91           HB       ILE  91   0.089  -5.883  -1.218
  679   1HG1  ILE  91          11HG      ILE  91   1.057  -3.106  -0.666
  680   2HG1  ILE  91          12HG      ILE  91  -0.114  -3.510  -1.913
  681   1HG2  ILE  91          21HG      ILE  91   1.927  -6.584   0.248
  682   2HG2  ILE  91          22HG      ILE  91   0.734  -5.597   1.075
  683   3HG2  ILE  91          23HG      ILE  91   2.284  -4.888   0.601
  684   1HD1  ILE  91          11HD      ILE  91  -0.422  -3.896   1.031
  685   2HD1  ILE  91          12HD      ILE  91  -1.575  -4.366  -0.241
  686   3HD1  ILE  91          13HD      ILE  91  -1.176  -2.653   0.010
  687    H    GLY  92           H        GLY  92   3.938  -5.909  -0.888
  688   1HA   GLY  92          1HA       GLY  92   3.862  -8.570  -2.035
  689   2HA   GLY  92          2HA       GLY  92   5.404  -7.756  -1.776
  690    H    ARG  93           H        ARG  93   4.668 -10.210  -0.659
  691    HA   ARG  93           HA       ARG  93   4.013  -9.625   2.130
  692   1HB   ARG  93          1HB       ARG  93   2.754 -11.394   1.098
  693   2HB   ARG  93          2HB       ARG  93   4.226 -12.269   0.687
  694   1HG   ARG  93          1HG       ARG  93   3.078 -13.287   2.567
  695   2HG   ARG  93          2HG       ARG  93   4.625 -12.627   3.091
  696   1HD   ARG  93          1HD       ARG  93   2.764 -12.177   4.673
  697   2HD   ARG  93          2HD       ARG  93   3.547 -10.723   4.058
  698    HE   ARG  93           HE       ARG  93   1.165 -11.604   2.665
  699   1HH1  ARG  93          11HH      ARG  93   2.431  -9.612   5.281
  700   2HH1  ARG  93          12HH      ARG  93   1.249  -8.366   5.094
  701   1HH2  ARG  93          21HH      ARG  93  -0.516  -9.843   2.457
  702   2HH2  ARG  93          22HH      ARG  93  -0.362  -8.474   3.454
  703    H    GLU  94           H        GLU  94   5.514  -9.362   3.567
  704    HA   GLU  94           HA       GLU  94   7.888 -11.051   3.514
  705   1HB   GLU  94          1HB       GLU  94   7.728  -8.148   4.369
  706   2HB   GLU  94          2HB       GLU  94   9.104  -9.200   4.625
  707   1HG   GLU  94          1HG       GLU  94   9.339  -9.414   2.176
  708   2HG   GLU  94          2HG       GLU  94   8.012  -8.264   1.998
  Start of MODEL   19
    1   1H    GLY   1          1H        GLY   1  16.681 -12.017   1.584
    2   2H    GLY   1          2H        GLY   1  15.332 -12.905   2.063
    3   3H    GLY   1          3H        GLY   1  16.209 -12.000   3.184
    4   1HA   GLY   1          1HA       GLY   1  14.156 -10.883   2.560
    5   2HA   GLY   1          2HA       GLY   1  15.604  -9.958   2.178
    6    H    HIS   2           H        HIS   2  13.520 -12.452   0.705
    7    HA   HIS   2           HA       HIS   2  13.783 -11.064  -1.857
    8   1HB   HIS   2          1HB       HIS   2  12.767 -13.861  -1.188
    9   2HB   HIS   2          2HB       HIS   2  12.723 -13.152  -2.792
   10    HD1  HIS   2           HD1      HIS   2  14.691 -13.825  -4.260
   11    HD2  HIS   2           HD2      HIS   2  15.558 -14.067  -0.192
   12    HE1  HIS   2           HE1      HIS   2  16.997 -14.774  -4.090
   13    H    MET   3           H        MET   3  11.897 -10.216  -2.751
   14    HA   MET   3           HA       MET   3   9.614 -10.356  -0.924
   15   1HB   MET   3          1HB       MET   3  10.877  -8.162  -0.988
   16   2HB   MET   3          2HB       MET   3  10.358  -8.001  -2.658
   17   1HG   MET   3          1HG       MET   3   8.070  -7.921  -2.001
   18   2HG   MET   3          2HG       MET   3   8.481  -8.242  -0.310
   19   1HE   MET   3          1HE       MET   3   7.453  -4.569   0.170
   20   2HE   MET   3          2HE       MET   3   7.450  -6.198   0.848
   21   3HE   MET   3          3HE       MET   3   6.627  -5.877  -0.678
   22    H    GLU   4           H        GLU   4   8.012 -11.377  -1.800
   23    HA   GLU   4           HA       GLU   4   7.795 -11.605  -4.704
   24   1HB   GLU   4          1HB       GLU   4   7.517 -13.617  -3.284
   25   2HB   GLU   4          2HB       GLU   4   6.149 -12.848  -2.493
   26   1HG   GLU   4          1HG       GLU   4   4.956 -12.789  -4.614
   27   2HG   GLU   4          2HG       GLU   4   6.312 -13.576  -5.407
   28    H    LEU   5           H        LEU   5   6.834  -9.937  -5.651
   29    HA   LEU   5           HA       LEU   5   4.908  -8.351  -4.199
   30   1HB   LEU   5          1HB       LEU   5   5.885  -8.048  -7.031
   31   2HB   LEU   5          2HB       LEU   5   4.898  -6.900  -6.161
   32    HG   LEU   5           HG       LEU   5   6.991  -5.959  -6.131
   33   1HD1  LEU   5          11HD      LEU   5   7.775  -5.962  -3.868
   34   2HD1  LEU   5          12HD      LEU   5   6.845  -7.431  -3.566
   35   3HD1  LEU   5          13HD      LEU   5   6.006  -5.931  -3.964
   36   1HD2  LEU   5          21HD      LEU   5   9.075  -7.114  -5.602
   37   2HD2  LEU   5          22HD      LEU   5   8.275  -7.818  -7.008
   38   3HD2  LEU   5          23HD      LEU   5   8.192  -8.630  -5.443
   39    H    PHE   6           H        PHE   6   2.805  -8.628  -4.290
   40    HA   PHE   6           HA       PHE   6   1.726  -9.889  -6.640
   41   1HB   PHE   6          1HB       PHE   6   0.097 -11.032  -5.030
   42   2HB   PHE   6          2HB       PHE   6   1.673 -11.785  -5.268
   43    HD1  PHE   6           HD1      PHE   6   3.146 -11.956  -3.406
   44    HD2  PHE   6           HD2      PHE   6  -0.520  -9.845  -3.070
   45    HE1  PHE   6           HE1      PHE   6   3.395 -11.953  -0.999
   46    HE2  PHE   6           HE2      PHE   6  -0.284  -9.810  -0.593
   47    HZ   PHE   6           HZ       PHE   6   1.684 -10.873   0.439
   48    HA   PRO   7           HA       PRO   7  -1.199  -6.665  -6.247
   49   1HB   PRO   7          1HB       PRO   7  -3.018  -7.500  -7.961
   50   2HB   PRO   7          2HB       PRO   7  -1.446  -6.909  -8.487
   51   1HG   PRO   7          1HG       PRO   7  -2.398  -9.740  -8.219
   52   2HG   PRO   7          2HG       PRO   7  -1.382  -9.028  -9.495
   53   1HD   PRO   7          1HD       PRO   7  -0.470 -10.499  -7.340
   54   2HD   PRO   7          2HD       PRO   7   0.507  -9.319  -8.249
   55    H    VAL   8           H        VAL   8  -2.499  -6.421  -4.640
   56    HA   VAL   8           HA       VAL   8  -4.436  -8.493  -4.056
   57    HB   VAL   8           HB       VAL   8  -3.657  -6.076  -2.396
   58   1HG1  VAL   8          11HG      VAL   8  -4.859  -7.149  -0.558
   59   2HG1  VAL   8          12HG      VAL   8  -5.371  -8.431  -1.655
   60   3HG1  VAL   8          13HG      VAL   8  -5.913  -6.776  -1.923
   61   1HG2  VAL   8          21HG      VAL   8  -2.839  -8.957  -2.060
   62   2HG2  VAL   8          22HG      VAL   8  -2.484  -7.652  -0.917
   63   3HG2  VAL   8          23HG      VAL   8  -1.805  -7.614  -2.547
   64    H    GLU   9           H        GLU   9  -6.108  -8.057  -5.446
   65    HA   GLU   9           HA       GLU   9  -6.839  -5.293  -5.858
   66   1HB   GLU   9          1HB       GLU   9  -6.689  -6.797  -7.816
   67   2HB   GLU   9          2HB       GLU   9  -7.949  -7.803  -7.125
   68   1HG   GLU   9          1HG       GLU   9  -9.574  -6.080  -7.384
   69   2HG   GLU   9          2HG       GLU   9  -8.336  -4.911  -7.843
   70    H    LEU  10           H        LEU  10  -7.967  -4.432  -4.344
   71    HA   LEU  10           HA       LEU  10  -9.740  -6.090  -2.704
   72   1HB   LEU  10          1HB       LEU  10  -7.809  -4.225  -2.148
   73   2HB   LEU  10          2HB       LEU  10  -9.269  -3.266  -2.067
   74    HG   LEU  10           HG       LEU  10  -8.759  -3.918   0.131
   75   1HD1  LEU  10          11HD      LEU  10 -11.116  -4.111  -0.368
   76   2HD1  LEU  10          12HD      LEU  10 -10.617  -5.284   0.850
   77   3HD1  LEU  10          13HD      LEU  10 -10.884  -5.799  -0.818
   78   1HD2  LEU  10          21HD      LEU  10  -7.166  -5.655  -0.351
   79   2HD2  LEU  10          22HD      LEU  10  -8.463  -6.732  -0.875
   80   3HD2  LEU  10          23HD      LEU  10  -8.361  -6.225   0.812
   81    H    GLU  11           H        GLU  11 -11.957  -5.703  -2.829
   82    HA   GLU  11           HA       GLU  11 -12.788  -3.371  -4.364
   83   1HB   GLU  11          1HB       GLU  11 -13.816  -5.575  -5.001
   84   2HB   GLU  11          2HB       GLU  11 -14.499  -5.684  -3.381
   85   1HG   GLU  11          1HG       GLU  11 -15.786  -3.647  -3.780
   86   2HG   GLU  11          2HG       GLU  11 -15.093  -3.521  -5.390
   87    H    LYS  12           H        LYS  12 -12.845  -1.714  -3.153
   88    HA   LYS  12           HA       LYS  12 -13.540  -1.977  -0.360
   89   1HB   LYS  12          1HB       LYS  12 -11.983   0.127  -1.832
   90   2HB   LYS  12          2HB       LYS  12 -12.588   0.399  -0.205
   91   1HG   LYS  12          1HG       LYS  12 -10.829  -1.884  -1.005
   92   2HG   LYS  12          2HG       LYS  12 -10.225  -0.362  -0.299
   93   1HD   LYS  12          1HD       LYS  12 -12.405  -1.634   1.017
   94   2HD   LYS  12          2HD       LYS  12 -10.927  -2.629   1.112
   95   1HE   LYS  12          1HE       LYS  12 -11.087  -1.409   3.077
   96   2HE   LYS  12          2HE       LYS  12  -9.943  -0.476   2.147
   97   1HZ   LYS  12          1HZ       LYS  12 -11.791   1.070   1.518
   98   2HZ   LYS  12          2HZ       LYS  12 -11.595   1.018   3.177
   99   3HZ   LYS  12          3HZ       LYS  12 -12.856   0.188   2.471
  100    H    ASP  13           H        ASP  13 -14.414   0.012   0.616
  101    HA   ASP  13           HA       ASP  13 -17.092   0.411   0.051
  102   1HB   ASP  13          1HB       ASP  13 -15.277   2.303   1.541
  103   2HB   ASP  13          2HB       ASP  13 -16.969   1.962   1.850
  104    H    GLU  14           H        GLU  14 -18.033   2.619  -0.429
  105    HA   GLU  14           HA       GLU  14 -16.937   3.842  -2.720
  106   1HB   GLU  14          1HB       GLU  14 -18.669   5.553  -2.457
  107   2HB   GLU  14          2HB       GLU  14 -19.333   3.947  -2.222
  108   1HG   GLU  14          1HG       GLU  14 -19.368   4.265   0.167
  109   2HG   GLU  14          2HG       GLU  14 -18.565   5.825   0.000
  110    H    ASP  15           H        ASP  15 -16.484   4.288   0.589
  111    HA   ASP  15           HA       ASP  15 -15.447   6.870   0.852
  112   1HB   ASP  15          1HB       ASP  15 -15.957   5.587   2.803
  113   2HB   ASP  15          2HB       ASP  15 -14.877   4.297   2.314
  114    H    GLY  16           H        GLY  16 -13.872   3.799   0.089
  115   1HA   GLY  16          1HA       GLY  16 -12.057   4.003  -1.566
  116   2HA   GLY  16          2HA       GLY  16 -11.446   5.314  -0.547
  117    H    LEU  17           H        LEU  17  -9.937   4.720   0.842
  118    HA   LEU  17           HA       LEU  17  -9.937   1.867   1.595
  119   1HB   LEU  17          1HB       LEU  17  -7.666   3.759   2.030
  120   2HB   LEU  17          2HB       LEU  17  -7.662   2.011   2.118
  121    HG   LEU  17           HG       LEU  17  -7.875   3.749  -0.225
  122   1HD1  LEU  17          11HD      LEU  17  -5.805   2.550  -0.907
  123   2HD1  LEU  17          12HD      LEU  17  -5.848   1.717   0.649
  124   3HD1  LEU  17          13HD      LEU  17  -5.651   3.470   0.590
  125   1HD2  LEU  17          21HD      LEU  17  -7.846   1.631  -1.582
  126   2HD2  LEU  17          22HD      LEU  17  -9.352   1.987  -0.741
  127   3HD2  LEU  17          23HD      LEU  17  -8.261   0.763  -0.095
  128    H    GLY  18           H        GLY  18  -9.403   5.099   2.861
  129   1HA   GLY  18          1HA       GLY  18  -9.665   5.942   4.922
  130   2HA   GLY  18          2HA       GLY  18 -10.602   4.503   5.338
  131    H    ILE  19           H        ILE  19  -7.336   4.356   4.072
  132    HA   ILE  19           HA       ILE  19  -6.550   3.357   6.716
  133    HB   ILE  19           HB       ILE  19  -4.832   2.003   5.738
  134   1HG1  ILE  19          11HG      ILE  19  -5.563   3.177   3.049
  135   2HG1  ILE  19          12HG      ILE  19  -4.142   3.610   4.003
  136   1HG2  ILE  19          21HG      ILE  19  -6.135   0.499   4.305
  137   2HG2  ILE  19          22HG      ILE  19  -7.340   1.775   4.098
  138   3HG2  ILE  19          23HG      ILE  19  -7.077   1.077   5.686
  139   1HD1  ILE  19          11HD      ILE  19  -3.334   1.294   3.831
  140   2HD1  ILE  19          12HD      ILE  19  -3.516   2.057   2.259
  141   3HD1  ILE  19          13HD      ILE  19  -4.724   0.896   2.817
  142    H    SER  20           H        SER  20  -4.072   3.577   7.026
  143    HA   SER  20           HA       SER  20  -3.297   6.360   6.417
  144   1HB   SER  20          1HB       SER  20  -2.942   4.845   9.007
  145   2HB   SER  20          2HB       SER  20  -2.529   6.531   8.711
  146    HG   SER  20           HG       SER  20  -4.576   6.206   9.802
  147    H    ILE  21           H        ILE  21  -1.051   6.701   6.287
  148    HA   ILE  21           HA       ILE  21   0.547   4.254   5.897
  149    HB   ILE  21           HB       ILE  21   1.675   5.348   4.013
  150   1HG1  ILE  21          11HG      ILE  21   0.101   7.330   3.027
  151   2HG1  ILE  21          12HG      ILE  21  -0.093   7.601   4.736
  152   1HG2  ILE  21          21HG      ILE  21  -0.107   3.829   3.495
  153   2HG2  ILE  21          22HG      ILE  21  -0.089   5.153   2.329
  154   3HG2  ILE  21          23HG      ILE  21  -1.294   5.130   3.616
  155   1HD1  ILE  21          11HD      ILE  21   2.331   7.847   5.026
  156   2HD1  ILE  21          12HD      ILE  21   1.741   8.998   3.843
  157   3HD1  ILE  21          13HD      ILE  21   2.589   7.573   3.314
  158    H    ILE  22           H        ILE  22   2.842   4.644   6.136
  159    HA   ILE  22           HA       ILE  22   3.388   7.109   7.501
  160    HB   ILE  22           HB       ILE  22   3.035   5.486   9.272
  161   1HG1  ILE  22          11HG      ILE  22   5.987   6.092   9.018
  162   2HG1  ILE  22          12HG      ILE  22   4.759   7.193   9.633
  163   1HG2  ILE  22          21HG      ILE  22   3.476   3.442   8.097
  164   2HG2  ILE  22          22HG      ILE  22   4.435   3.510   9.578
  165   3HG2  ILE  22          23HG      ILE  22   5.195   3.837   8.014
  166   1HD1  ILE  22          11HD      ILE  22   6.026   6.170  11.442
  167   2HD1  ILE  22          12HD      ILE  22   5.548   4.567  10.877
  168   3HD1  ILE  22          13HD      ILE  22   4.331   5.680  11.503
  169    H    GLY  23           H        GLY  23   5.164   8.103   6.840
  170   1HA   GLY  23          1HA       GLY  23   6.575   6.785   4.699
  171   2HA   GLY  23          2HA       GLY  23   6.623   8.516   5.033
  172    H    MET  24           H        MET  24   8.038   5.487   5.451
  173    HA   MET  24           HA       MET  24  10.065   6.616   7.279
  174   1HB   MET  24          1HB       MET  24   9.372   3.685   6.941
  175   2HB   MET  24          2HB       MET  24  10.521   4.361   8.076
  176   1HG   MET  24          1HG       MET  24   7.540   4.634   8.101
  177   2HG   MET  24          2HG       MET  24   8.516   3.706   9.224
  178   1HE   MET  24          1HE       MET  24  10.309   4.897  10.910
  179   2HE   MET  24          2HE       MET  24  10.488   6.648  11.047
  180   3HE   MET  24          3HE       MET  24  10.978   5.827   9.569
  181    H    GLY  25           H        GLY  25  10.956   7.481   5.398
  182   1HA   GLY  25          1HA       GLY  25  11.631   6.214   3.063
  183   2HA   GLY  25          2HA       GLY  25  12.561   7.524   3.773
  184    H    VAL  26           H        VAL  26  12.547   4.337   2.869
  185    HA   VAL  26           HA       VAL  26  14.969   3.783   4.400
  186    HB   VAL  26           HB       VAL  26  13.021   2.254   4.846
  187   1HG1  VAL  26          11HG      VAL  26  11.955   2.248   2.693
  188   2HG1  VAL  26          12HG      VAL  26  12.320   0.599   3.203
  189   3HG1  VAL  26          13HG      VAL  26  13.323   1.391   1.989
  190   1HG2  VAL  26          21HG      VAL  26  15.402   0.944   3.551
  191   2HG2  VAL  26          22HG      VAL  26  14.239   0.132   4.602
  192   3HG2  VAL  26          23HG      VAL  26  15.244   1.435   5.239
  193    H    GLY  27           H        GLY  27  16.792   3.151   3.215
  194   1HA   GLY  27          1HA       GLY  27  16.536   3.646   0.346
  195   2HA   GLY  27          2HA       GLY  27  18.023   3.732   1.291
  196    H    ALA  28           H        ALA  28  19.271   2.017   1.423
  197    HA   ALA  28           HA       ALA  28  18.376  -0.454   0.090
  198   1HB   ALA  28          1HB       ALA  28  21.082   0.466   0.904
  199   2HB   ALA  28          2HB       ALA  28  20.405   0.673  -0.724
  200   3HB   ALA  28          3HB       ALA  28  20.711  -0.956  -0.069
  201    H    ASP  29           H        ASP  29  18.174   0.697   2.954
  202    HA   ASP  29           HA       ASP  29  19.763  -0.684   4.745
  203   1HB   ASP  29          1HB       ASP  29  16.958   0.269   5.203
  204   2HB   ASP  29          2HB       ASP  29  18.251  -0.005   6.377
  205    H    ALA  30           H        ALA  30  16.757  -1.609   3.205
  206    HA   ALA  30           HA       ALA  30  16.616  -3.988   4.906
  207   1HB   ALA  30          1HB       ALA  30  14.295  -4.163   4.195
  208   2HB   ALA  30          2HB       ALA  30  14.529  -2.789   3.104
  209   3HB   ALA  30          3HB       ALA  30  14.642  -2.555   4.843
  210    H    GLY  31           H        GLY  31  17.972  -3.143   2.102
  211   1HA   GLY  31          1HA       GLY  31  19.046  -4.538   0.620
  212   2HA   GLY  31          2HA       GLY  31  18.082  -5.879   1.206
  213    H    LEU  32           H        LEU  32  15.635  -4.079   0.601
  214    HA   LEU  32           HA       LEU  32  15.377  -5.158  -2.063
  215   1HB   LEU  32          1HB       LEU  32  13.384  -3.989  -0.173
  216   2HB   LEU  32          2HB       LEU  32  12.982  -4.216  -1.860
  217    HG   LEU  32           HG       LEU  32  12.099  -6.037  -0.624
  218   1HD1  LEU  32          11HD      LEU  32  14.526  -6.982  -2.122
  219   2HD1  LEU  32          12HD      LEU  32  12.953  -6.580  -2.809
  220   3HD1  LEU  32          13HD      LEU  32  13.111  -7.947  -1.710
  221   1HD2  LEU  32          21HD      LEU  32  14.880  -6.553   0.411
  222   2HD2  LEU  32          22HD      LEU  32  13.476  -7.588   0.677
  223   3HD2  LEU  32          23HD      LEU  32  13.512  -5.957   1.351
  224    H    GLU  33           H        GLU  33  15.492  -2.015  -0.603
  225    HA   GLU  33           HA       GLU  33  15.747   0.068  -1.398
  226   1HB   GLU  33          1HB       GLU  33  16.512  -1.296  -3.969
  227   2HB   GLU  33          2HB       GLU  33  16.762   0.413  -3.628
  228   1HG   GLU  33          1HG       GLU  33  18.299  -0.165  -1.855
  229   2HG   GLU  33          2HG       GLU  33  18.021  -1.889  -2.140
  230    H    LYS  34           H        LYS  34  13.616   0.733  -1.215
  231    HA   LYS  34           HA       LYS  34  12.405   1.479  -3.651
  232   1HB   LYS  34          1HB       LYS  34  10.245   0.384  -3.320
  233   2HB   LYS  34          2HB       LYS  34  11.538  -0.807  -3.385
  234   1HG   LYS  34          1HG       LYS  34  11.377  -1.246  -1.030
  235   2HG   LYS  34          2HG       LYS  34  10.378   0.175  -0.801
  236   1HD   LYS  34          1HD       LYS  34   9.052  -1.880  -0.691
  237   2HD   LYS  34          2HD       LYS  34   8.549  -0.829  -2.008
  238   1HE   LYS  34          1HE       LYS  34   8.566  -3.141  -2.738
  239   2HE   LYS  34          2HE       LYS  34   9.805  -2.200  -3.570
  240   1HZ   LYS  34          1HZ       LYS  34  10.374  -3.935  -1.218
  241   2HZ   LYS  34          2HZ       LYS  34  11.488  -3.211  -2.297
  242   3HZ   LYS  34          3HZ       LYS  34  10.491  -4.433  -2.816
  243    H    LEU  35           H        LEU  35   9.989   2.155  -2.635
  244    HA   LEU  35           HA       LEU  35  10.328   4.490  -1.137
  245   1HB   LEU  35          1HB       LEU  35   7.913   4.378  -0.788
  246   2HB   LEU  35          2HB       LEU  35   8.328   4.034  -2.456
  247    HG   LEU  35           HG       LEU  35   8.110   1.642  -0.759
  248   1HD1  LEU  35          11HD      LEU  35   5.721   3.369  -1.301
  249   2HD1  LEU  35          12HD      LEU  35   6.362   2.795   0.263
  250   3HD1  LEU  35          13HD      LEU  35   5.673   1.658  -0.872
  251   1HD2  LEU  35          21HD      LEU  35   6.860   2.398  -3.390
  252   2HD2  LEU  35          22HD      LEU  35   6.876   0.799  -2.648
  253   3HD2  LEU  35          23HD      LEU  35   8.382   1.522  -3.188
  254    H    GLY  36           H        GLY  36   9.695   4.887   1.091
  255   1HA   GLY  36          1HA       GLY  36   9.908   2.492   2.783
  256   2HA   GLY  36          2HA       GLY  36  10.371   4.117   3.283
  257    H    ILE  37           H        ILE  37   7.488   3.372   1.530
  258    HA   ILE  37           HA       ILE  37   6.023   4.566   3.722
  259    HB   ILE  37           HB       ILE  37   4.890   3.768   1.033
  260   1HG1  ILE  37          11HG      ILE  37   6.803   5.414   1.028
  261   2HG1  ILE  37          12HG      ILE  37   5.313   6.025   0.250
  262   1HG2  ILE  37          21HG      ILE  37   3.859   5.593   3.191
  263   2HG2  ILE  37          22HG      ILE  37   3.234   3.999   2.779
  264   3HG2  ILE  37          23HG      ILE  37   3.103   5.322   1.618
  265   1HD1  ILE  37          11HD      ILE  37   6.671   6.684   2.827
  266   2HD1  ILE  37          12HD      ILE  37   4.981   7.114   2.552
  267   3HD1  ILE  37          13HD      ILE  37   6.239   7.771   1.501
  268    H    PHE  38           H        PHE  38   5.314   3.353   5.191
  269    HA   PHE  38           HA       PHE  38   4.505   0.597   4.589
  270   1HB   PHE  38          1HB       PHE  38   5.386   1.945   7.118
  271   2HB   PHE  38          2HB       PHE  38   4.692   0.332   7.113
  272    HD1  PHE  38           HD1      PHE  38   5.918  -1.537   6.225
  273    HD2  PHE  38           HD2      PHE  38   7.593   2.364   6.208
  274    HE1  PHE  38           HE1      PHE  38   8.106  -2.500   5.752
  275    HE2  PHE  38           HE2      PHE  38   9.794   1.442   5.743
  276    HZ   PHE  38           HZ       PHE  38  10.080  -1.018   5.505
  277    H    VAL  39           H        VAL  39   2.633  -0.215   5.680
  278    HA   VAL  39           HA       VAL  39   0.511   1.689   5.625
  279    HB   VAL  39           HB       VAL  39   0.463  -1.173   6.648
  280   1HG1  VAL  39          11HG      VAL  39  -1.765   0.629   5.709
  281   2HG1  VAL  39          12HG      VAL  39  -1.449   0.149   7.372
  282   3HG1  VAL  39          13HG      VAL  39  -1.942  -1.060   6.182
  283   1HG2  VAL  39          21HG      VAL  39  -0.144  -0.139   3.877
  284   2HG2  VAL  39          22HG      VAL  39  -0.391  -1.796   4.440
  285   3HG2  VAL  39          23HG      VAL  39   1.241  -1.129   4.340
  286    H    LYS  40           H        LYS  40  -0.073   2.879   7.257
  287    HA   LYS  40           HA       LYS  40   1.300   2.557   9.779
  288   1HB   LYS  40          1HB       LYS  40   1.251   4.761   8.850
  289   2HB   LYS  40          2HB       LYS  40  -0.490   4.703   8.684
  290   1HG   LYS  40          1HG       LYS  40  -0.800   4.705  10.992
  291   2HG   LYS  40          2HG       LYS  40   0.949   4.627  11.314
  292   1HD   LYS  40          1HD       LYS  40   1.171   6.833  10.272
  293   2HD   LYS  40          2HD       LYS  40  -0.570   6.855   9.948
  294   1HE   LYS  40          1HE       LYS  40  -0.955   6.546  12.344
  295   2HE   LYS  40          2HE       LYS  40   0.764   6.701  12.624
  296   1HZ   LYS  40          1HZ       LYS  40  -0.895   8.830  11.359
  297   2HZ   LYS  40          2HZ       LYS  40   0.727   8.975  11.805
  298   3HZ   LYS  40          3HZ       LYS  40  -0.463   8.807  12.973
  299    H    THR  41           H        THR  41  -2.028   2.714   8.571
  300    HA   THR  41           HA       THR  41  -2.849   1.102  10.793
  301    HB   THR  41           HB       THR  41  -4.507   3.460  10.186
  302    HG1  THR  41           HG1      THR  41  -2.193   3.340  11.899
  303   1HG2  THR  41          21HG      THR  41  -5.397   1.750  11.641
  304   2HG2  THR  41          22HG      THR  41  -5.155   3.234  12.567
  305   3HG2  THR  41          23HG      THR  41  -4.009   1.901  12.721
  306    H    VAL  42           H        VAL  42  -5.207   0.401  10.225
  307    HA   VAL  42           HA       VAL  42  -5.893   0.964   7.466
  308    HB   VAL  42           HB       VAL  42  -6.126  -1.787   8.793
  309   1HG1  VAL  42          11HG      VAL  42  -7.910  -1.370   7.215
  310   2HG1  VAL  42          12HG      VAL  42  -6.778  -2.553   6.528
  311   3HG1  VAL  42          13HG      VAL  42  -6.735  -0.869   6.008
  312   1HG2  VAL  42          21HG      VAL  42  -4.302  -0.922   6.555
  313   2HG2  VAL  42          22HG      VAL  42  -4.465  -2.565   7.181
  314   3HG2  VAL  42          23HG      VAL  42  -3.797  -1.291   8.202
  315    H    THR  43           H        THR  43  -8.199   0.940   7.177
  316    HA   THR  43           HA       THR  43  -9.741   1.884   9.305
  317    HB   THR  43           HB       THR  43 -10.236   2.330   6.900
  318    HG1  THR  43           HG1      THR  43 -11.949   2.636   8.206
  319   1HG2  THR  43          21HG      THR  43 -11.234   0.621   5.514
  320   2HG2  THR  43          22HG      THR  43 -11.105  -0.535   6.853
  321   3HG2  THR  43          23HG      THR  43  -9.643   0.090   6.089
  322    H    GLU  44           H        GLU  44 -11.540   0.827  10.305
  323    HA   GLU  44           HA       GLU  44 -10.787  -1.348  11.775
  324   1HB   GLU  44          1HB       GLU  44 -12.563   0.361  12.286
  325   2HB   GLU  44          2HB       GLU  44 -13.659  -0.602  11.307
  326   1HG   GLU  44          1HG       GLU  44 -13.919  -1.077  13.664
  327   2HG   GLU  44          2HG       GLU  44 -13.335  -2.495  12.783
  328    H    GLY  45           H        GLY  45 -13.386  -1.512   9.372
  329   1HA   GLY  45          1HA       GLY  45 -12.443  -3.808   8.125
  330   2HA   GLY  45          2HA       GLY  45 -13.413  -4.350   9.482
  331    H    GLY  46           H        GLY  46 -13.749  -1.821   6.986
  332   1HA   GLY  46          1HA       GLY  46 -16.483  -2.706   6.563
  333   2HA   GLY  46          2HA       GLY  46 -15.684  -1.369   5.746
  334    H    ALA  47           H        ALA  47 -13.393  -2.949   5.030
  335    HA   ALA  47           HA       ALA  47 -14.256  -5.116   3.352
  336   1HB   ALA  47          1HB       ALA  47 -15.066  -3.369   1.945
  337   2HB   ALA  47          2HB       ALA  47 -13.556  -3.939   1.193
  338   3HB   ALA  47          3HB       ALA  47 -13.585  -2.468   2.160
  339    H    ALA  48           H        ALA  48 -11.588  -2.808   4.097
  340    HA   ALA  48           HA       ALA  48  -9.524  -4.319   2.742
  341   1HB   ALA  48          1HB       ALA  48  -9.138  -1.962   3.311
  342   2HB   ALA  48          2HB       ALA  48  -7.918  -2.991   4.060
  343   3HB   ALA  48          3HB       ALA  48  -9.248  -2.357   5.025
  344    H    GLN  49           H        GLN  49 -10.065  -3.908   6.208
  345    HA   GLN  49           HA       GLN  49  -8.590  -6.254   6.709
  346   1HB   GLN  49          1HB       GLN  49 -10.091  -4.336   8.348
  347   2HB   GLN  49          2HB       GLN  49  -9.440  -5.806   9.124
  348   1HG   GLN  49          1HG       GLN  49  -7.208  -5.100   8.123
  349   2HG   GLN  49          2HG       GLN  49  -8.017  -3.589   7.703
  350   1HE2  GLN  49          21HE      GLN  49  -9.569  -3.505  10.153
  351   2HE2  GLN  49          22HE      GLN  49  -8.498  -3.050  11.392
  352    H    ARG  50           H        ARG  50 -11.434  -6.074   5.384
  353    HA   ARG  50           HA       ARG  50 -12.491  -8.342   6.813
  354   1HB   ARG  50          1HB       ARG  50 -13.652  -6.774   4.539
  355   2HB   ARG  50          2HB       ARG  50 -14.388  -8.230   5.197
  356   1HG   ARG  50          1HG       ARG  50 -13.784  -5.722   6.648
  357   2HG   ARG  50          2HG       ARG  50 -15.419  -6.247   6.161
  358   1HD   ARG  50          1HD       ARG  50 -13.547  -7.397   8.247
  359   2HD   ARG  50          2HD       ARG  50 -15.131  -6.694   8.492
  360    HE   ARG  50           HE       ARG  50 -15.483  -8.850   6.813
  361   1HH1  ARG  50          11HH      ARG  50 -14.408  -8.286  10.169
  362   2HH1  ARG  50          12HH      ARG  50 -14.858  -9.852  10.676
  363   1HH2  ARG  50          21HH      ARG  50 -16.056 -10.994   7.565
  364   2HH2  ARG  50          22HH      ARG  50 -15.818 -11.379   9.206
  365    H    ASP  51           H        ASP  51 -10.904  -7.331   3.880
  366    HA   ASP  51           HA       ASP  51 -11.062  -9.804   2.532
  367   1HB   ASP  51          1HB       ASP  51 -10.290  -7.674   1.440
  368   2HB   ASP  51          2HB       ASP  51  -8.847  -7.735   2.425
  369    H    GLY  52           H        GLY  52  -8.875  -8.483   4.924
  370   1HA   GLY  52          1HA       GLY  52  -7.936  -9.718   6.698
  371   2HA   GLY  52          2HA       GLY  52  -8.322 -11.183   5.833
  372    H    ARG  53           H        ARG  53  -7.070 -10.281   3.431
  373    HA   ARG  53           HA       ARG  53  -4.532 -11.519   3.545
  374   1HB   ARG  53          1HB       ARG  53  -6.212 -10.924   1.728
  375   2HB   ARG  53          2HB       ARG  53  -5.270  -9.451   1.623
  376   1HG   ARG  53          1HG       ARG  53  -3.264 -10.937   1.379
  377   2HG   ARG  53          2HG       ARG  53  -4.421 -12.253   1.123
  378   1HD   ARG  53          1HD       ARG  53  -3.980  -9.788  -0.403
  379   2HD   ARG  53          2HD       ARG  53  -4.010 -11.492  -0.949
  380    HE   ARG  53           HE       ARG  53  -6.517 -10.291   0.058
  381   1HH1  ARG  53          11HH      ARG  53  -4.799 -11.427  -2.823
  382   2HH1  ARG  53          12HH      ARG  53  -6.154 -11.295  -3.840
  383   1HH2  ARG  53          21HH      ARG  53  -8.341 -10.118  -1.277
  384   2HH2  ARG  53          22HH      ARG  53  -8.255 -10.534  -2.929
  385    H    ILE  54           H        ILE  54  -5.404  -8.135   3.107
  386    HA   ILE  54           HA       ILE  54  -2.662  -7.308   3.351
  387    HB   ILE  54           HB       ILE  54  -4.239  -6.322   1.667
  388   1HG1  ILE  54          11HG      ILE  54  -3.102  -4.383   3.694
  389   2HG1  ILE  54          12HG      ILE  54  -2.257  -5.121   2.329
  390   1HG2  ILE  54          21HG      ILE  54  -5.550  -5.155   4.110
  391   2HG2  ILE  54          22HG      ILE  54  -6.295  -6.276   2.968
  392   3HG2  ILE  54          23HG      ILE  54  -5.903  -4.625   2.460
  393   1HD1  ILE  54          11HD      ILE  54  -2.931  -2.789   1.932
  394   2HD1  ILE  54          12HD      ILE  54  -4.632  -3.312   2.054
  395   3HD1  ILE  54          13HD      ILE  54  -3.591  -3.939   0.769
  396    H    GLN  55           H        GLN  55  -1.863  -6.104   5.163
  397    HA   GLN  55           HA       GLN  55  -3.818  -5.428   7.169
  398   1HB   GLN  55          1HB       GLN  55  -1.409  -7.151   7.796
  399   2HB   GLN  55          2HB       GLN  55  -2.374  -6.342   9.013
  400   1HG   GLN  55          1HG       GLN  55  -4.333  -7.634   8.244
  401   2HG   GLN  55          2HG       GLN  55  -3.277  -8.526   7.148
  402   1HE2  GLN  55          21HE      GLN  55  -4.244  -7.998  10.412
  403   2HE2  GLN  55          22HE      GLN  55  -3.403  -9.341  11.098
  404    H    VAL  56           H        VAL  56  -2.472  -4.433   9.162
  405    HA   VAL  56           HA       VAL  56  -1.326  -1.990   8.338
  406    HB   VAL  56           HB       VAL  56  -1.239  -3.395  11.032
  407   1HG1  VAL  56          11HG      VAL  56   0.544  -1.779  10.895
  408   2HG1  VAL  56          12HG      VAL  56  -0.706  -1.216  12.010
  409   3HG1  VAL  56          13HG      VAL  56  -0.588  -0.521  10.389
  410   1HG2  VAL  56          21HG      VAL  56  -3.006  -1.146  10.084
  411   2HG2  VAL  56          22HG      VAL  56  -3.047  -1.926  11.666
  412   3HG2  VAL  56          23HG      VAL  56  -3.493  -2.834  10.220
  413    H    ASN  57           H        ASN  57   0.026  -5.058   9.059
  414    HA   ASN  57           HA       ASN  57   2.679  -4.010   9.416
  415   1HB   ASN  57          1HB       ASN  57   1.485  -6.715   9.617
  416   2HB   ASN  57          2HB       ASN  57   3.245  -6.553   9.526
  417   1HD2  ASN  57          21HD      ASN  57   0.380  -6.022  11.444
  418   2HD2  ASN  57          22HD      ASN  57   1.198  -5.624  12.893
  419    H    ASP  58           H        ASP  58   1.219  -3.954   6.723
  420    HA   ASP  58           HA       ASP  58   3.320  -5.308   5.219
  421   1HB   ASP  58          1HB       ASP  58   0.599  -4.358   4.296
  422   2HB   ASP  58          2HB       ASP  58   1.901  -4.847   3.221
  423    H    GLN  59           H        GLN  59   3.730  -4.175   3.084
  424    HA   GLN  59           HA       GLN  59   4.102  -1.315   3.547
  425   1HB   GLN  59          1HB       GLN  59   6.224  -2.565   3.818
  426   2HB   GLN  59          2HB       GLN  59   5.978  -3.226   2.198
  427   1HG   GLN  59          1HG       GLN  59   6.067  -0.959   1.270
  428   2HG   GLN  59          2HG       GLN  59   6.318  -0.310   2.883
  429   1HE2  GLN  59          21HE      GLN  59   8.185   0.610   2.372
  430   2HE2  GLN  59          22HE      GLN  59   9.648  -0.245   2.049
  431    H    ILE  60           H        ILE  60   3.568  -0.085   1.830
  432    HA   ILE  60           HA       ILE  60   2.103  -1.262  -0.386
  433    HB   ILE  60           HB       ILE  60   3.004   1.599   0.095
  434   1HG1  ILE  60          11HG      ILE  60   1.592   0.885   1.974
  435   2HG1  ILE  60          12HG      ILE  60   0.737   2.029   0.943
  436   1HG2  ILE  60          21HG      ILE  60   2.390   1.091  -2.203
  437   2HG2  ILE  60          22HG      ILE  60   1.225   2.195  -1.457
  438   3HG2  ILE  60          23HG      ILE  60   0.832   0.478  -1.643
  439   1HD1  ILE  60          11HD      ILE  60  -0.738   0.257   1.672
  440   2HD1  ILE  60          12HD      ILE  60   0.353  -0.953   1.007
  441   3HD1  ILE  60          13HD      ILE  60  -0.492   0.156  -0.074
  442    H    VAL  61           H        VAL  61   2.863  -1.545  -2.381
  443    HA   VAL  61           HA       VAL  61   5.623  -0.684  -2.867
  444    HB   VAL  61           HB       VAL  61   4.213  -3.140  -3.947
  445   1HG1  VAL  61          11HG      VAL  61   5.733  -2.277  -5.607
  446   2HG1  VAL  61          12HG      VAL  61   6.310  -3.791  -4.903
  447   3HG1  VAL  61          13HG      VAL  61   7.046  -2.257  -4.415
  448   1HG2  VAL  61          21HG      VAL  61   5.851  -4.408  -2.624
  449   2HG2  VAL  61          22HG      VAL  61   4.823  -3.387  -1.624
  450   3HG2  VAL  61          23HG      VAL  61   6.476  -2.892  -1.975
  451    H    GLU  62           H        GLU  62   2.606  -1.492  -4.496
  452    HA   GLU  62           HA       GLU  62   2.836   0.842  -6.245
  453   1HB   GLU  62          1HB       GLU  62   4.117  -0.776  -7.463
  454   2HB   GLU  62          2HB       GLU  62   2.907  -2.014  -7.284
  455   1HG   GLU  62          1HG       GLU  62   1.390  -0.704  -8.691
  456   2HG   GLU  62          2HG       GLU  62   2.633   0.531  -8.872
  457    H    VAL  63           H        VAL  63   0.876   1.657  -5.582
  458    HA   VAL  63           HA       VAL  63  -1.381  -0.161  -5.548
  459    HB   VAL  63           HB       VAL  63  -0.933   2.562  -4.275
  460   1HG1  VAL  63          11HG      VAL  63  -3.267   2.685  -3.763
  461   2HG1  VAL  63          12HG      VAL  63  -3.593   1.261  -4.776
  462   3HG1  VAL  63          13HG      VAL  63  -2.989   2.759  -5.502
  463   1HG2  VAL  63          21HG      VAL  63  -0.446   0.447  -3.113
  464   2HG2  VAL  63          22HG      VAL  63  -2.143  -0.001  -3.341
  465   3HG2  VAL  63          23HG      VAL  63  -1.731   1.416  -2.379
  466    H    ASP  64           H        ASP  64  -2.746  -0.304  -7.027
  467    HA   ASP  64           HA       ASP  64  -4.087   0.058  -8.805
  468   1HB   ASP  64          1HB       ASP  64  -4.813   1.962  -7.352
  469   2HB   ASP  64          2HB       ASP  64  -3.672   2.997  -8.193
  470    H    GLY  65           H        GLY  65  -1.139   0.065  -9.038
  471   1HA   GLY  65          1HA       GLY  65   0.364  -0.008 -10.772
  472   2HA   GLY  65          2HA       GLY  65  -0.935   0.491 -11.847
  473    H    ILE  66           H        ILE  66  -0.363   2.521  -9.108
  474    HA   ILE  66           HA       ILE  66   0.449   4.633 -10.871
  475    HB   ILE  66           HB       ILE  66  -1.091   4.725  -8.668
  476   1HG1  ILE  66          11HG      ILE  66   0.934   6.894  -9.256
  477   2HG1  ILE  66          12HG      ILE  66  -0.495   6.593 -10.243
  478   1HG2  ILE  66          21HG      ILE  66   0.579   3.889  -7.128
  479   2HG2  ILE  66          22HG      ILE  66   0.166   5.568  -6.736
  480   3HG2  ILE  66          23HG      ILE  66   1.670   5.198  -7.582
  481   1HD1  ILE  66          11HD      ILE  66  -0.854   8.441  -8.718
  482   2HD1  ILE  66          12HD      ILE  66  -0.448   7.383  -7.361
  483   3HD1  ILE  66          13HD      ILE  66  -1.899   7.070  -8.314
  484    H    SER  67           H        SER  67   2.035   2.230  -9.216
  485    HA   SER  67           HA       SER  67   4.088   1.803  -8.351
  486   1HB   SER  67          1HB       SER  67   4.675   3.444 -10.697
  487   2HB   SER  67          2HB       SER  67   5.843   2.267 -10.007
  488    HG   SER  67           HG       SER  67   4.372   0.607 -10.683
  489    H    LEU  68           H        LEU  68   3.958   3.034  -6.423
  490    HA   LEU  68           HA       LEU  68   4.948   5.766  -6.508
  491   1HB   LEU  68          1HB       LEU  68   4.241   5.875  -4.181
  492   2HB   LEU  68          2HB       LEU  68   2.949   5.398  -5.263
  493    HG   LEU  68           HG       LEU  68   4.375   3.144  -4.078
  494   1HD1  LEU  68          11HD      LEU  68   4.528   4.758  -2.339
  495   2HD1  LEU  68          12HD      LEU  68   3.420   3.448  -1.890
  496   3HD1  LEU  68          13HD      LEU  68   2.785   5.044  -2.373
  497   1HD2  LEU  68          21HD      LEU  68   1.479   3.973  -4.212
  498   2HD2  LEU  68          22HD      LEU  68   2.089   2.377  -3.761
  499   3HD2  LEU  68          23HD      LEU  68   2.329   2.987  -5.399
  500    H    VAL  69           H        VAL  69   6.437   3.204  -6.677
  501    HA   VAL  69           HA       VAL  69   8.365   3.001  -4.648
  502    HB   VAL  69           HB       VAL  69   8.873   2.631  -7.617
  503   1HG1  VAL  69          11HG      VAL  69  10.665   1.105  -6.914
  504   2HG1  VAL  69          12HG      VAL  69  10.337   1.513  -5.229
  505   3HG1  VAL  69          13HG      VAL  69  10.932   2.751  -6.335
  506   1HG2  VAL  69          21HG      VAL  69   6.987   1.261  -6.909
  507   2HG2  VAL  69          22HG      VAL  69   7.939   0.612  -5.574
  508   3HG2  VAL  69          23HG      VAL  69   8.393   0.246  -7.238
  509    H    GLY  70           H        GLY  70   9.232   4.774  -3.822
  510   1HA   GLY  70          1HA       GLY  70  11.121   6.231  -3.882
  511   2HA   GLY  70          2HA       GLY  70  10.852   6.435  -5.608
  512    H    VAL  71           H        VAL  71   8.168   6.612  -3.346
  513    HA   VAL  71           HA       VAL  71   8.180   9.506  -3.783
  514    HB   VAL  71           HB       VAL  71   5.801   9.581  -3.581
  515   1HG1  VAL  71          11HG      VAL  71   6.615   9.089  -5.778
  516   2HG1  VAL  71          12HG      VAL  71   5.084   8.259  -5.504
  517   3HG1  VAL  71          13HG      VAL  71   6.602   7.361  -5.432
  518   1HG2  VAL  71          21HG      VAL  71   5.510   7.885  -1.850
  519   2HG2  VAL  71          22HG      VAL  71   5.851   6.606  -3.017
  520   3HG2  VAL  71          23HG      VAL  71   4.407   7.614  -3.192
  521    H    THR  72           H        THR  72   6.755  10.614  -2.016
  522    HA   THR  72           HA       THR  72   7.773   9.794   0.601
  523    HB   THR  72           HB       THR  72   6.869  12.256   0.971
  524    HG1  THR  72           HG1      THR  72   7.865  12.645  -1.596
  525   1HG2  THR  72          21HG      THR  72   9.205  11.552   1.327
  526   2HG2  THR  72          22HG      THR  72   9.147  13.101   0.485
  527   3HG2  THR  72          23HG      THR  72   9.491  11.622  -0.410
  528    H    GLN  73           H        GLN  73   6.316  10.596   2.368
  529    HA   GLN  73           HA       GLN  73   4.054   8.980   2.338
  530   1HB   GLN  73          1HB       GLN  73   3.935   9.364   4.596
  531   2HB   GLN  73          2HB       GLN  73   5.505  10.069   4.325
  532   1HG   GLN  73          1HG       GLN  73   2.906  11.574   4.596
  533   2HG   GLN  73          2HG       GLN  73   4.140  11.411   5.834
  534   1HE2  GLN  73          21HE      GLN  73   6.318  11.813   3.770
  535   2HE2  GLN  73          22HE      GLN  73   6.235  13.488   3.447
  536    H    ASN  74           H        ASN  74   4.417  12.303   1.638
  537    HA   ASN  74           HA       ASN  74   1.704  13.058   1.675
  538   1HB   ASN  74          1HB       ASN  74   2.647  14.918   0.084
  539   2HB   ASN  74          2HB       ASN  74   3.128  14.872   1.778
  540   1HD2  ASN  74          21HD      ASN  74   4.183  14.210  -1.496
  541   2HD2  ASN  74          22HD      ASN  74   5.851  14.010  -1.043
  542    H    PHE  75           H        PHE  75   3.684  11.569  -0.799
  543    HA   PHE  75           HA       PHE  75   1.681  11.927  -2.836
  544   1HB   PHE  75          1HB       PHE  75   4.138  11.659  -3.366
  545   2HB   PHE  75          2HB       PHE  75   3.997  10.002  -2.797
  546    HD1  PHE  75           HD1      PHE  75   2.760   8.317  -4.102
  547    HD2  PHE  75           HD2      PHE  75   3.227  12.300  -5.520
  548    HE1  PHE  75           HE1      PHE  75   2.100   7.586  -6.344
  549    HE2  PHE  75           HE2      PHE  75   2.560  11.569  -7.771
  550    HZ   PHE  75           HZ       PHE  75   2.003   9.209  -8.186
  551    H    ALA  76           H        ALA  76   2.926   9.299  -0.848
  552    HA   ALA  76           HA       ALA  76   1.216   7.319  -1.798
  553   1HB   ALA  76          1HB       ALA  76   3.238   6.875  -0.533
  554   2HB   ALA  76          2HB       ALA  76   1.835   6.046   0.140
  555   3HB   ALA  76          3HB       ALA  76   2.465   7.501   0.927
  556    H    ALA  77           H        ALA  77   0.792   9.524   0.983
  557    HA   ALA  77           HA       ALA  77  -1.624   8.414   1.910
  558   1HB   ALA  77          1HB       ALA  77  -1.943  10.516   3.108
  559   2HB   ALA  77          2HB       ALA  77  -0.679  11.276   2.140
  560   3HB   ALA  77          3HB       ALA  77  -0.275   9.968   3.251
  561    H    THR  78           H        THR  78  -0.908  10.416  -0.756
  562    HA   THR  78           HA       THR  78  -3.602  11.274  -1.147
  563    HB   THR  78           HB       THR  78  -1.095  11.504  -2.819
  564    HG1  THR  78           HG1      THR  78  -0.827  13.012  -1.364
  565   1HG2  THR  78          21HG      THR  78  -2.359  13.088  -4.234
  566   2HG2  THR  78          22HG      THR  78  -3.826  12.718  -3.322
  567   3HG2  THR  78          23HG      THR  78  -3.046  11.464  -4.289
  568    H    VAL  79           H        VAL  79  -1.434   8.888  -2.664
  569    HA   VAL  79           HA       VAL  79  -3.278   7.954  -4.570
  570    HB   VAL  79           HB       VAL  79  -1.153   6.244  -3.212
  571   1HG1  VAL  79          11HG      VAL  79  -1.179   4.942  -5.246
  572   2HG1  VAL  79          12HG      VAL  79  -2.413   5.996  -5.926
  573   3HG1  VAL  79          13HG      VAL  79  -2.784   5.001  -4.523
  574   1HG2  VAL  79          21HG      VAL  79  -0.135   8.268  -4.017
  575   2HG2  VAL  79          22HG      VAL  79  -0.951   8.099  -5.560
  576   3HG2  VAL  79          23HG      VAL  79   0.295   6.928  -5.083
  577    H    LEU  80           H        LEU  80  -2.429   6.710  -1.378
  578    HA   LEU  80           HA       LEU  80  -4.399   4.693  -1.317
  579   1HB   LEU  80          1HB       LEU  80  -2.658   5.922   0.812
  580   2HB   LEU  80          2HB       LEU  80  -3.843   4.702   1.202
  581    HG   LEU  80           HG       LEU  80  -1.645   3.694   1.076
  582   1HD1  LEU  80          11HD      LEU  80  -2.011   1.922  -0.449
  583   2HD1  LEU  80          12HD      LEU  80  -3.174   2.890  -1.357
  584   3HD1  LEU  80          13HD      LEU  80  -3.545   2.385   0.288
  585   1HD2  LEU  80          21HD      LEU  80  -1.503   4.690  -1.757
  586   2HD2  LEU  80          22HD      LEU  80  -0.332   3.612  -0.991
  587   3HD2  LEU  80          23HD      LEU  80  -0.526   5.270  -0.410
  588    H    ARG  81           H        ARG  81  -4.926   7.808  -1.329
  589    HA   ARG  81           HA       ARG  81  -7.275   7.822   0.475
  590   1HB   ARG  81          1HB       ARG  81  -5.623   9.683   0.608
  591   2HB   ARG  81          2HB       ARG  81  -5.947  10.035  -1.073
  592   1HG   ARG  81          1HG       ARG  81  -8.345  10.440  -0.403
  593   2HG   ARG  81          2HG       ARG  81  -7.784  10.383   1.272
  594   1HD   ARG  81          1HD       ARG  81  -6.060  12.114   0.630
  595   2HD   ARG  81          2HD       ARG  81  -6.919  12.231  -0.909
  596    HE   ARG  81           HE       ARG  81  -8.903  12.665   0.819
  597   1HH1  ARG  81          11HH      ARG  81  -5.680  14.148   0.596
  598   2HH1  ARG  81          12HH      ARG  81  -6.158  15.577   1.389
  599   1HH2  ARG  81          21HH      ARG  81  -9.518  14.611   1.896
  600   2HH2  ARG  81          22HH      ARG  81  -8.367  15.860   2.130
  601    H    ASN  82           H        ASN  82  -6.077   8.523  -2.743
  602    HA   ASN  82           HA       ASN  82  -8.617   9.240  -3.766
  603   1HB   ASN  82          1HB       ASN  82  -5.851   9.331  -4.735
  604   2HB   ASN  82          2HB       ASN  82  -7.096   9.332  -5.964
  605   1HD2  ASN  82          21HD      ASN  82  -5.706  10.995  -3.305
  606   2HD2  ASN  82          22HD      ASN  82  -6.514  12.508  -3.568
  607    H    THR  83           H        THR  83  -7.014   6.286  -3.463
  608    HA   THR  83           HA       THR  83  -7.753   4.955  -5.804
  609    HB   THR  83           HB       THR  83  -7.748   2.956  -4.305
  610    HG1  THR  83           HG1      THR  83  -8.141   4.564  -2.473
  611   1HG2  THR  83          21HG      THR  83  -5.338   4.773  -4.301
  612   2HG2  THR  83          22HG      THR  83  -5.759   3.610  -5.565
  613   3HG2  THR  83          23HG      THR  83  -5.291   3.052  -3.959
  614    H    LYS  84           H        LYS  84  -9.570   3.847  -6.362
  615    HA   LYS  84           HA       LYS  84 -11.839   4.077  -4.548
  616   1HB   LYS  84          1HB       LYS  84 -11.853   4.991  -7.403
  617   2HB   LYS  84          2HB       LYS  84 -13.302   4.609  -6.467
  618   1HG   LYS  84          1HG       LYS  84 -11.274   6.713  -5.749
  619   2HG   LYS  84          2HG       LYS  84 -12.841   7.015  -6.512
  620   1HD   LYS  84          1HD       LYS  84 -13.914   5.900  -4.585
  621   2HD   LYS  84          2HD       LYS  84 -12.346   5.782  -3.809
  622   1HE   LYS  84          1HE       LYS  84 -12.115   8.221  -3.867
  623   2HE   LYS  84          2HE       LYS  84 -13.681   8.335  -4.668
  624   1HZ   LYS  84          1HZ       LYS  84 -14.672   7.311  -2.638
  625   2HZ   LYS  84          2HZ       LYS  84 -14.010   8.819  -2.419
  626   3HZ   LYS  84          3HZ       LYS  84 -13.170   7.482  -1.853
  627    H    GLY  85           H        GLY  85 -13.101   2.606  -4.409
  628   1HA   GLY  85          1HA       GLY  85 -13.893   0.524  -4.263
  629   2HA   GLY  85          2HA       GLY  85 -14.180   0.728  -5.994
  630    H    ASN  86           H        ASN  86 -12.156   0.366  -7.104
  631    HA   ASN  86           HA       ASN  86 -11.349  -2.386  -6.321
  632   1HB   ASN  86          1HB       ASN  86 -11.587  -1.248  -9.091
  633   2HB   ASN  86          2HB       ASN  86 -10.975  -2.868  -8.736
  634   1HD2  ASN  86          21HD      ASN  86 -12.439  -4.426  -7.921
  635   2HD2  ASN  86          22HD      ASN  86 -14.144  -4.224  -8.107
  636    H    VAL  87           H        VAL  87  -9.529  -2.228  -5.374
  637    HA   VAL  87           HA       VAL  87  -7.482  -0.422  -6.499
  638    HB   VAL  87           HB       VAL  87  -7.550  -1.430  -3.705
  639   1HG1  VAL  87          11HG      VAL  87  -6.295   0.965  -4.993
  640   2HG1  VAL  87          12HG      VAL  87  -5.512  -0.539  -4.500
  641   3HG1  VAL  87          13HG      VAL  87  -6.193   0.540  -3.273
  642   1HG2  VAL  87          21HG      VAL  87  -9.665  -0.399  -4.079
  643   2HG2  VAL  87          22HG      VAL  87  -8.910   1.074  -4.709
  644   3HG2  VAL  87          23HG      VAL  87  -8.704   0.610  -3.008
  645    H    ARG  88           H        ARG  88  -5.723  -1.360  -7.219
  646    HA   ARG  88           HA       ARG  88  -5.156  -4.104  -6.403
  647   1HB   ARG  88          1HB       ARG  88  -4.313  -2.453  -8.751
  648   2HB   ARG  88          2HB       ARG  88  -3.477  -3.944  -8.319
  649   1HG   ARG  88          1HG       ARG  88  -5.333  -5.257  -8.744
  650   2HG   ARG  88          2HG       ARG  88  -6.439  -3.889  -8.637
  651   1HD   ARG  88          1HD       ARG  88  -4.380  -4.287 -10.762
  652   2HD   ARG  88          2HD       ARG  88  -6.099  -4.695 -10.929
  653    HE   ARG  88           HE       ARG  88  -4.882  -2.095 -11.007
  654   1HH1  ARG  88          11HH      ARG  88  -7.967  -3.878 -10.560
  655   2HH1  ARG  88          12HH      ARG  88  -8.928  -2.504 -10.817
  656   1HH2  ARG  88          21HH      ARG  88  -6.303  -0.185 -11.302
  657   2HH2  ARG  88          22HH      ARG  88  -7.983  -0.395 -11.239
  658    H    PHE  89           H        PHE  89  -4.216  -3.931  -4.528
  659    HA   PHE  89           HA       PHE  89  -2.025  -2.073  -4.122
  660   1HB   PHE  89          1HB       PHE  89  -2.999  -4.295  -2.314
  661   2HB   PHE  89          2HB       PHE  89  -1.835  -3.043  -1.942
  662    HD1  PHE  89           HD1      PHE  89  -2.509  -0.921  -1.235
  663    HD2  PHE  89           HD2      PHE  89  -5.386  -3.744  -2.556
  664    HE1  PHE  89           HE1      PHE  89  -4.284   0.467  -0.304
  665    HE2  PHE  89           HE2      PHE  89  -7.184  -2.345  -1.635
  666    HZ   PHE  89           HZ       PHE  89  -6.641  -0.251  -0.500
  667    H    VAL  90           H        VAL  90  -0.320  -2.767  -5.383
  668    HA   VAL  90           HA       VAL  90   0.301  -5.566  -5.274
  669    HB   VAL  90           HB       VAL  90   1.824  -3.290  -6.544
  670   1HG1  VAL  90          11HG      VAL  90   3.280  -5.190  -6.041
  671   2HG1  VAL  90          12HG      VAL  90   3.047  -5.065  -7.783
  672   3HG1  VAL  90          13HG      VAL  90   2.166  -6.285  -6.860
  673   1HG2  VAL  90          21HG      VAL  90   0.957  -4.123  -8.690
  674   2HG2  VAL  90          22HG      VAL  90  -0.338  -3.597  -7.612
  675   3HG2  VAL  90          23HG      VAL  90  -0.008  -5.316  -7.823
  676    H    ILE  91           H        ILE  91   0.709  -5.873  -3.235
  677    HA   ILE  91           HA       ILE  91   2.991  -4.554  -1.996
  678    HB   ILE  91           HB       ILE  91   0.525  -5.961  -0.954
  679   1HG1  ILE  91          11HG      ILE  91   1.587  -3.212  -0.404
  680   2HG1  ILE  91          12HG      ILE  91   0.408  -3.567  -1.657
  681   1HG2  ILE  91          21HG      ILE  91   2.858  -5.056   0.738
  682   2HG2  ILE  91          22HG      ILE  91   2.375  -6.726   0.455
  683   3HG2  ILE  91          23HG      ILE  91   1.305  -5.640   1.340
  684   1HD1  ILE  91          11HD      ILE  91  -0.600  -2.695   0.277
  685   2HD1  ILE  91          12HD      ILE  91   0.076  -4.023   1.261
  686   3HD1  ILE  91          13HD      ILE  91  -1.085  -4.367  -0.056
  687    H    GLY  92           H        GLY  92   4.379  -6.092  -0.787
  688   1HA   GLY  92          1HA       GLY  92   4.301  -8.670  -2.137
  689   2HA   GLY  92          2HA       GLY  92   5.810  -7.810  -1.851
  690    H    ARG  93           H        ARG  93   5.554 -10.333  -0.986
  691    HA   ARG  93           HA       ARG  93   5.349 -10.044   1.937
  692   1HB   ARG  93          1HB       ARG  93   3.831 -11.720   0.828
  693   2HB   ARG  93          2HB       ARG  93   5.249 -12.619   0.306
  694   1HG   ARG  93          1HG       ARG  93   4.411 -12.143   3.184
  695   2HG   ARG  93          2HG       ARG  93   3.996 -13.556   2.238
  696   1HD   ARG  93          1HD       ARG  93   6.401 -14.104   2.055
  697   2HD   ARG  93          2HD       ARG  93   6.774 -12.707   3.066
  698    HE   ARG  93           HE       ARG  93   4.860 -14.422   4.287
  699   1HH1  ARG  93          11HH      ARG  93   8.384 -14.052   3.846
  700   2HH1  ARG  93          12HH      ARG  93   8.741 -15.018   5.196
  701   1HH2  ARG  93          21HH      ARG  93   5.432 -15.744   6.108
  702   2HH2  ARG  93          22HH      ARG  93   7.080 -15.956   6.504
  703    H    GLU  94           H        GLU  94   7.209 -10.172   3.004
  704    HA   GLU  94           HA       GLU  94   9.615 -10.955   1.546
  705   1HB   GLU  94          1HB       GLU  94   9.277  -9.397   4.122
  706   2HB   GLU  94          2HB       GLU  94  10.809  -9.764   3.349
  707   1HG   GLU  94          1HG       GLU  94  10.180  -8.397   1.436
  708   2HG   GLU  94          2HG       GLU  94   8.626  -8.046   2.197
  Start of MODEL   20
    1   1H    GLY   1          1H        GLY   1  17.216 -13.013   1.659
    2   2H    GLY   1          2H        GLY   1  16.903 -14.375   0.747
    3   3H    GLY   1          3H        GLY   1  16.809 -14.450   2.444
    4   1HA   GLY   1          1HA       GLY   1  14.599 -14.313   1.449
    5   2HA   GLY   1          2HA       GLY   1  14.976 -12.854   2.368
    6    H    HIS   2           H        HIS   2  13.102 -12.431   0.636
    7    HA   HIS   2           HA       HIS   2  14.228 -10.688  -1.293
    8   1HB   HIS   2          1HB       HIS   2  13.202 -11.728  -3.293
    9   2HB   HIS   2          2HB       HIS   2  14.396 -12.803  -2.586
   10    HD1  HIS   2           HD1      HIS   2  10.977 -12.793  -3.830
   11    HD2  HIS   2           HD2      HIS   2  13.114 -14.926  -0.971
   12    HE1  HIS   2           HE1      HIS   2   9.636 -14.859  -3.354
   13    H    MET   3           H        MET   3  12.265  -9.737  -2.582
   14    HA   MET   3           HA       MET   3   9.973  -9.638  -0.752
   15   1HB   MET   3          1HB       MET   3  11.349  -7.546  -0.890
   16   2HB   MET   3          2HB       MET   3  11.017  -7.495  -2.613
   17   1HG   MET   3          1HG       MET   3   8.672  -7.175  -2.191
   18   2HG   MET   3          2HG       MET   3   8.929  -7.292  -0.445
   19   1HE   MET   3          1HE       MET   3   8.160  -3.509  -0.669
   20   2HE   MET   3          2HE       MET   3   7.869  -5.027   0.186
   21   3HE   MET   3          3HE       MET   3   7.348  -4.845  -1.489
   22    H    GLU   4           H        GLU   4   8.257 -10.600  -1.641
   23    HA   GLU   4           HA       GLU   4   8.149 -10.998  -4.527
   24   1HB   GLU   4          1HB       GLU   4   7.641 -12.861  -2.932
   25   2HB   GLU   4          2HB       GLU   4   6.284 -11.880  -2.358
   26   1HG   GLU   4          1HG       GLU   4   5.269 -11.977  -4.580
   27   2HG   GLU   4          2HG       GLU   4   6.623 -12.937  -5.162
   28    H    LEU   5           H        LEU   5   7.221  -9.425  -5.656
   29    HA   LEU   5           HA       LEU   5   5.382  -7.611  -4.358
   30   1HB   LEU   5          1HB       LEU   5   6.416  -7.595  -7.194
   31   2HB   LEU   5          2HB       LEU   5   5.482  -6.329  -6.441
   32    HG   LEU   5           HG       LEU   5   7.616  -5.504  -6.458
   33   1HD1  LEU   5          11HD      LEU   5   7.354  -6.692  -3.765
   34   2HD1  LEU   5          12HD      LEU   5   6.618  -5.191  -4.332
   35   3HD1  LEU   5          13HD      LEU   5   8.380  -5.321  -4.193
   36   1HD2  LEU   5          21HD      LEU   5   8.845  -7.495  -7.120
   37   2HD2  LEU   5          22HD      LEU   5   8.699  -8.142  -5.485
   38   3HD2  LEU   5          23HD      LEU   5   9.649  -6.686  -5.775
   39    H    PHE   6           H        PHE   6   3.265  -7.993  -4.368
   40    HA   PHE   6           HA       PHE   6   2.209  -9.406  -6.650
   41   1HB   PHE   6          1HB       PHE   6   0.664 -10.549  -4.999
   42   2HB   PHE   6          2HB       PHE   6   2.291 -11.217  -5.160
   43    HD1  PHE   6           HD1      PHE   6   3.699 -11.176  -3.212
   44    HD2  PHE   6           HD2      PHE   6  -0.078  -9.290  -3.187
   45    HE1  PHE   6           HE1      PHE   6   3.841 -10.971  -0.776
   46    HE2  PHE   6           HE2      PHE   6   0.042  -9.061  -0.723
   47    HZ   PHE   6           HZ       PHE   6   1.998  -9.910   0.479
   48    HA   PRO   7           HA       PRO   7  -0.939  -6.317  -6.480
   49   1HB   PRO   7          1HB       PRO   7  -2.671  -7.452  -8.144
   50   2HB   PRO   7          2HB       PRO   7  -1.197  -6.672  -8.718
   51   1HG   PRO   7          1HG       PRO   7  -1.786  -9.596  -8.374
   52   2HG   PRO   7          2HG       PRO   7  -0.821  -8.798  -9.636
   53   1HD   PRO   7          1HD       PRO   7   0.184 -10.106  -7.417
   54   2HD   PRO   7          2HD       PRO   7   1.055  -8.851  -8.336
   55    H    VAL   8           H        VAL   8  -2.284  -6.117  -4.868
   56    HA   VAL   8           HA       VAL   8  -4.059  -8.341  -4.236
   57    HB   VAL   8           HB       VAL   8  -3.469  -5.948  -2.485
   58   1HG1  VAL   8          11HG      VAL   8  -4.807  -8.569  -1.840
   59   2HG1  VAL   8          12HG      VAL   8  -5.589  -6.996  -1.987
   60   3HG1  VAL   8          13HG      VAL   8  -4.444  -7.290  -0.679
   61   1HG2  VAL   8          21HG      VAL   8  -1.430  -7.209  -2.782
   62   2HG2  VAL   8          22HG      VAL   8  -2.260  -8.700  -2.320
   63   3HG2  VAL   8          23HG      VAL   8  -2.037  -7.409  -1.138
   64    H    GLU   9           H        GLU   9  -5.725  -7.966  -5.602
   65    HA   GLU   9           HA       GLU   9  -6.730  -5.304  -5.942
   66   1HB   GLU   9          1HB       GLU   9  -6.751  -6.952  -7.797
   67   2HB   GLU   9          2HB       GLU   9  -7.860  -7.948  -6.868
   68   1HG   GLU   9          1HG       GLU   9  -9.523  -6.172  -6.926
   69   2HG   GLU   9          2HG       GLU   9  -8.408  -5.155  -7.840
   70    H    LEU  10           H        LEU  10  -7.685  -4.456  -4.293
   71    HA   LEU  10           HA       LEU  10  -9.239  -6.146  -2.473
   72   1HB   LEU  10          1HB       LEU  10  -7.369  -4.253  -2.028
   73   2HB   LEU  10          2HB       LEU  10  -8.796  -3.248  -2.144
   74    HG   LEU  10           HG       LEU  10  -8.285  -3.627   0.152
   75   1HD1  LEU  10          11HD      LEU  10 -10.330  -4.576   1.005
   76   2HD1  LEU  10          12HD      LEU  10 -10.662  -5.294  -0.567
   77   3HD1  LEU  10          13HD      LEU  10 -10.639  -3.544  -0.394
   78   1HD2  LEU  10          21HD      LEU  10  -8.217  -5.845   1.147
   79   2HD2  LEU  10          22HD      LEU  10  -6.964  -5.632  -0.076
   80   3HD2  LEU  10          23HD      LEU  10  -8.411  -6.569  -0.447
   81    H    GLU  11           H        GLU  11 -11.485  -5.789  -2.442
   82    HA   GLU  11           HA       GLU  11 -12.329  -3.496  -4.016
   83   1HB   GLU  11          1HB       GLU  11 -13.131  -5.710  -4.904
   84   2HB   GLU  11          2HB       GLU  11 -14.089  -5.881  -3.431
   85   1HG   GLU  11          1HG       GLU  11 -15.321  -3.888  -3.938
   86   2HG   GLU  11          2HG       GLU  11 -14.291  -3.569  -5.329
   87    H    LYS  12           H        LYS  12 -12.047  -2.110  -2.413
   88    HA   LYS  12           HA       LYS  12 -13.137  -2.429   0.095
   89   1HB   LYS  12          1HB       LYS  12 -11.414  -0.585  -1.229
   90   2HB   LYS  12          2HB       LYS  12 -12.639   0.291  -0.330
   91   1HG   LYS  12          1HG       LYS  12 -11.043  -1.928   0.782
   92   2HG   LYS  12          2HG       LYS  12 -10.518  -0.236   0.961
   93   1HD   LYS  12          1HD       LYS  12 -12.902   0.180   1.902
   94   2HD   LYS  12          2HD       LYS  12 -12.995  -1.578   2.048
   95   1HE   LYS  12          1HE       LYS  12 -11.621  -1.615   3.839
   96   2HE   LYS  12          2HE       LYS  12 -10.800  -0.102   3.431
   97   1HZ   LYS  12          1HZ       LYS  12 -12.482   0.205   5.290
   98   2HZ   LYS  12          2HZ       LYS  12 -13.691  -0.259   4.168
   99   3HZ   LYS  12          3HZ       LYS  12 -12.805   1.100   3.917
  100    H    ASP  13           H        ASP  13 -14.426  -0.671   1.094
  101    HA   ASP  13           HA       ASP  13 -17.077  -0.886   0.247
  102   1HB   ASP  13          1HB       ASP  13 -15.880   1.042   2.272
  103   2HB   ASP  13          2HB       ASP  13 -17.536   0.468   2.191
  104    H    GLU  14           H        GLU  14 -18.401   1.159  -0.052
  105    HA   GLU  14           HA       GLU  14 -17.246   2.617  -2.217
  106   1HB   GLU  14          1HB       GLU  14 -19.416   3.808  -2.328
  107   2HB   GLU  14          2HB       GLU  14 -19.581   2.060  -2.332
  108   1HG   GLU  14          1HG       GLU  14 -20.186   2.124   0.037
  109   2HG   GLU  14          2HG       GLU  14 -20.022   3.880   0.015
  110    H    ASP  15           H        ASP  15 -17.239   3.092   1.069
  111    HA   ASP  15           HA       ASP  15 -16.930   5.897   1.251
  112   1HB   ASP  15          1HB       ASP  15 -17.329   4.548   3.240
  113   2HB   ASP  15          2HB       ASP  15 -15.799   3.712   3.005
  114    H    GLY  16           H        GLY  16 -14.664   3.239   0.793
  115   1HA   GLY  16          1HA       GLY  16 -12.780   3.889  -0.724
  116   2HA   GLY  16          2HA       GLY  16 -12.490   5.176   0.458
  117    H    LEU  17           H        LEU  17 -10.461   4.334   1.018
  118    HA   LEU  17           HA       LEU  17 -10.361   1.573   1.971
  119   1HB   LEU  17          1HB       LEU  17  -8.133   3.565   2.144
  120   2HB   LEU  17          2HB       LEU  17  -8.042   1.821   2.190
  121    HG   LEU  17           HG       LEU  17  -8.626   3.561  -0.114
  122   1HD1  LEU  17          11HD      LEU  17  -6.507   2.545  -0.975
  123   2HD1  LEU  17          12HD      LEU  17  -6.299   1.804   0.612
  124   3HD1  LEU  17          13HD      LEU  17  -6.322   3.558   0.453
  125   1HD2  LEU  17          21HD      LEU  17  -8.586   1.472  -1.494
  126   2HD2  LEU  17          22HD      LEU  17  -9.961   1.579  -0.399
  127   3HD2  LEU  17          23HD      LEU  17  -8.597   0.538   0.005
  128    H    GLY  18           H        GLY  18  -9.812   4.840   3.116
  129   1HA   GLY  18          1HA       GLY  18  -9.868   5.735   5.189
  130   2HA   GLY  18          2HA       GLY  18 -10.620   4.240   5.758
  131    H    ILE  19           H        ILE  19  -7.595   4.107   4.058
  132    HA   ILE  19           HA       ILE  19  -6.369   3.300   6.599
  133    HB   ILE  19           HB       ILE  19  -4.751   1.983   5.415
  134   1HG1  ILE  19          11HG      ILE  19  -5.869   3.065   2.827
  135   2HG1  ILE  19          12HG      ILE  19  -4.369   3.610   3.580
  136   1HG2  ILE  19          21HG      ILE  19  -6.955   0.923   5.622
  137   2HG2  ILE  19          22HG      ILE  19  -6.144   0.402   4.147
  138   3HG2  ILE  19          23HG      ILE  19  -7.424   1.609   4.073
  139   1HD1  ILE  19          11HD      ILE  19  -4.918   0.816   2.579
  140   2HD1  ILE  19          12HD      ILE  19  -3.427   1.366   3.347
  141   3HD1  ILE  19          13HD      ILE  19  -3.904   2.023   1.786
  142    H    SER  20           H        SER  20  -3.798   3.652   6.373
  143    HA   SER  20           HA       SER  20  -3.233   6.343   5.392
  144   1HB   SER  20          1HB       SER  20  -3.030   5.504   8.296
  145   2HB   SER  20          2HB       SER  20  -2.427   7.026   7.664
  146    HG   SER  20           HG       SER  20  -4.934   6.727   6.874
  147    H    ILE  21           H        ILE  21  -0.990   6.810   5.446
  148    HA   ILE  21           HA       ILE  21   0.614   4.361   5.252
  149    HB   ILE  21           HB       ILE  21   1.891   5.472   3.485
  150   1HG1  ILE  21          11HG      ILE  21   0.505   7.564   2.435
  151   2HG1  ILE  21          12HG      ILE  21   0.069   7.749   4.104
  152   1HG2  ILE  21          21HG      ILE  21   0.205   5.353   1.704
  153   2HG2  ILE  21          22HG      ILE  21  -1.062   5.340   2.929
  154   3HG2  ILE  21          23HG      ILE  21   0.091   4.007   2.838
  155   1HD1  ILE  21          11HD      ILE  21   2.384   7.985   4.760
  156   2HD1  ILE  21          12HD      ILE  21   1.980   9.139   3.496
  157   3HD1  ILE  21          13HD      ILE  21   2.908   7.724   3.107
  158    H    ILE  22           H        ILE  22   2.912   4.681   5.644
  159    HA   ILE  22           HA       ILE  22   3.499   7.131   7.038
  160    HB   ILE  22           HB       ILE  22   3.106   5.510   8.767
  161   1HG1  ILE  22          11HG      ILE  22   6.052   6.134   8.520
  162   2HG1  ILE  22          12HG      ILE  22   4.820   7.226   9.133
  163   1HG2  ILE  22          21HG      ILE  22   4.517   3.527   9.082
  164   2HG2  ILE  22          22HG      ILE  22   5.283   3.866   7.528
  165   3HG2  ILE  22          23HG      ILE  22   3.565   3.460   7.594
  166   1HD1  ILE  22          11HD      ILE  22   6.056   6.267  10.943
  167   2HD1  ILE  22          12HD      ILE  22   5.700   4.638  10.370
  168   3HD1  ILE  22          13HD      ILE  22   4.399   5.662  10.982
  169    H    GLY  23           H        GLY  23   5.216   8.108   6.369
  170   1HA   GLY  23          1HA       GLY  23   6.767   6.788   4.333
  171   2HA   GLY  23          2HA       GLY  23   6.797   8.517   4.699
  172    H    MET  24           H        MET  24   8.188   5.517   5.108
  173    HA   MET  24           HA       MET  24  10.065   6.559   7.130
  174   1HB   MET  24          1HB       MET  24   9.517   3.704   6.249
  175   2HB   MET  24          2HB       MET  24  10.727   4.175   7.425
  176   1HG   MET  24          1HG       MET  24   7.755   4.568   7.730
  177   2HG   MET  24          2HG       MET  24   8.687   3.261   8.455
  178   1HE   MET  24          1HE       MET  24  10.489   3.605  10.364
  179   2HE   MET  24          2HE       MET  24  10.962   5.185  10.985
  180   3HE   MET  24          3HE       MET  24  11.369   4.737   9.332
  181    H    GLY  25           H        GLY  25  12.359   5.829   6.659
  182   1HA   GLY  25          1HA       GLY  25  12.702   5.888   3.742
  183   2HA   GLY  25          2HA       GLY  25  13.757   6.762   4.841
  184    H    VAL  26           H        VAL  26  12.981   3.728   3.430
  185    HA   VAL  26           HA       VAL  26  15.092   2.506   4.982
  186    HB   VAL  26           HB       VAL  26  13.036   1.142   4.840
  187   1HG1  VAL  26          11HG      VAL  26  12.261   0.140   2.772
  188   2HG1  VAL  26          12HG      VAL  26  13.429   1.107   1.871
  189   3HG1  VAL  26          13HG      VAL  26  12.127   1.898   2.754
  190   1HG2  VAL  26          21HG      VAL  26  13.998  -0.976   4.029
  191   2HG2  VAL  26          22HG      VAL  26  15.127  -0.063   5.031
  192   3HG2  VAL  26          23HG      VAL  26  15.314  -0.071   3.277
  193    H    GLY  27           H        GLY  27  17.011   2.687   4.334
  194   1HA   GLY  27          1HA       GLY  27  17.608   3.306   1.580
  195   2HA   GLY  27          2HA       GLY  27  18.758   3.232   2.913
  196    H    ALA  28           H        ALA  28  19.441   1.147   3.646
  197    HA   ALA  28           HA       ALA  28  18.934  -1.129   1.945
  198   1HB   ALA  28          1HB       ALA  28  20.759   0.051   0.766
  199   2HB   ALA  28          2HB       ALA  28  21.285  -1.495   1.432
  200   3HB   ALA  28          3HB       ALA  28  21.713   0.008   2.249
  201    H    ASP  29           H        ASP  29  18.302  -2.468   3.380
  202    HA   ASP  29           HA       ASP  29  20.075  -3.477   5.367
  203   1HB   ASP  29          1HB       ASP  29  19.554  -1.346   6.492
  204   2HB   ASP  29          2HB       ASP  29  17.842  -1.744   6.430
  205    H    ALA  30           H        ALA  30  16.732  -3.001   4.419
  206    HA   ALA  30           HA       ALA  30  15.911  -5.316   5.951
  207   1HB   ALA  30          1HB       ALA  30  14.207  -3.448   4.333
  208   2HB   ALA  30          2HB       ALA  30  14.603  -3.251   6.036
  209   3HB   ALA  30          3HB       ALA  30  13.651  -4.639   5.509
  210    H    GLY  31           H        GLY  31  16.662  -4.666   2.617
  211   1HA   GLY  31          1HA       GLY  31  16.858  -6.477   1.086
  212   2HA   GLY  31          2HA       GLY  31  15.571  -7.319   1.950
  213    H    LEU  32           H        LEU  32  14.548  -4.406   2.022
  214    HA   LEU  32           HA       LEU  32  12.768  -4.711  -0.241
  215   1HB   LEU  32          1HB       LEU  32  12.773  -2.801   2.100
  216   2HB   LEU  32          2HB       LEU  32  11.698  -2.580   0.742
  217    HG   LEU  32           HG       LEU  32  10.623  -4.759   1.241
  218   1HD1  LEU  32          11HD      LEU  32  11.033  -5.908   3.341
  219   2HD1  LEU  32          12HD      LEU  32  12.365  -4.806   3.692
  220   3HD1  LEU  32          13HD      LEU  32  12.473  -5.912   2.322
  221   1HD2  LEU  32          21HD      LEU  32  10.722  -2.853   3.565
  222   2HD2  LEU  32          22HD      LEU  32   9.472  -4.063   3.275
  223   3HD2  LEU  32          23HD      LEU  32   9.680  -2.724   2.147
  224    H    GLU  33           H        GLU  33  15.044  -2.320   1.040
  225    HA   GLU  33           HA       GLU  33  16.003  -0.503   0.169
  226   1HB   GLU  33          1HB       GLU  33  16.663  -2.736  -1.683
  227   2HB   GLU  33          2HB       GLU  33  17.348  -1.130  -1.917
  228   1HG   GLU  33          1HG       GLU  33  18.894  -2.431  -0.680
  229   2HG   GLU  33          2HG       GLU  33  18.181  -1.164   0.312
  230    H    LYS  34           H        LYS  34  13.564   0.069  -0.289
  231    HA   LYS  34           HA       LYS  34  13.569   1.511  -2.764
  232   1HB   LYS  34          1HB       LYS  34  11.303   0.657  -3.392
  233   2HB   LYS  34          2HB       LYS  34  12.568  -0.563  -3.453
  234   1HG   LYS  34          1HG       LYS  34  11.768  -1.586  -1.423
  235   2HG   LYS  34          2HG       LYS  34  10.609  -0.283  -1.184
  236   1HD   LYS  34          1HD       LYS  34   9.542  -2.314  -2.078
  237   2HD   LYS  34          2HD       LYS  34   9.381  -0.935  -3.163
  238   1HE   LYS  34          1HE       LYS  34   9.896  -2.926  -4.437
  239   2HE   LYS  34          2HE       LYS  34  11.246  -1.794  -4.491
  240   1HZ   LYS  34          1HZ       LYS  34  12.399  -3.159  -2.822
  241   2HZ   LYS  34          2HZ       LYS  34  12.047  -4.040  -4.170
  242   3HZ   LYS  34          3HZ       LYS  34  11.122  -4.253  -2.786
  243    H    LEU  35           H        LEU  35  10.843   2.180  -2.487
  244    HA   LEU  35           HA       LEU  35  10.678   4.293  -0.802
  245   1HB   LEU  35          1HB       LEU  35   8.269   4.059  -0.996
  246   2HB   LEU  35          2HB       LEU  35   9.073   3.747  -2.523
  247    HG   LEU  35           HG       LEU  35   8.844   1.244  -1.348
  248   1HD1  LEU  35          11HD      LEU  35   6.441   1.026  -0.891
  249   2HD1  LEU  35          12HD      LEU  35   6.321   2.783  -0.876
  250   3HD1  LEU  35          13HD      LEU  35   7.333   1.944   0.305
  251   1HD2  LEU  35          21HD      LEU  35   8.637   1.720  -3.682
  252   2HD2  LEU  35          22HD      LEU  35   7.068   2.518  -3.404
  253   3HD2  LEU  35          23HD      LEU  35   7.251   0.785  -3.119
  254    H    GLY  36           H        GLY  36  10.073   4.609   1.349
  255   1HA   GLY  36          1HA       GLY  36   9.875   2.174   2.974
  256   2HA   GLY  36          2HA       GLY  36  10.380   3.759   3.561
  257    H    ILE  37           H        ILE  37   7.679   3.305   1.453
  258    HA   ILE  37           HA       ILE  37   5.989   4.551   3.420
  259    HB   ILE  37           HB       ILE  37   5.167   3.530   0.694
  260   1HG1  ILE  37          11HG      ILE  37   7.000   5.285   0.692
  261   2HG1  ILE  37          12HG      ILE  37   5.533   5.772  -0.186
  262   1HG2  ILE  37          21HG      ILE  37   3.266   5.098   0.997
  263   2HG2  ILE  37          22HG      ILE  37   3.858   5.441   2.629
  264   3HG2  ILE  37          23HG      ILE  37   3.308   3.828   2.223
  265   1HD1  ILE  37          11HD      ILE  37   4.936   7.023   1.889
  266   2HD1  ILE  37          12HD      ILE  37   6.369   7.594   1.044
  267   3HD1  ILE  37          13HD      ILE  37   6.541   6.604   2.503
  268    H    PHE  38           H        PHE  38   5.464   3.282   4.956
  269    HA   PHE  38           HA       PHE  38   4.520   0.579   4.349
  270   1HB   PHE  38          1HB       PHE  38   5.335   1.862   6.944
  271   2HB   PHE  38          2HB       PHE  38   4.631   0.245   6.826
  272    HD1  PHE  38           HD1      PHE  38   5.870  -1.581   5.770
  273    HD2  PHE  38           HD2      PHE  38   7.666   2.242   6.324
  274    HE1  PHE  38           HE1      PHE  38   8.088  -2.560   5.370
  275    HE2  PHE  38           HE2      PHE  38   9.867   1.273   5.926
  276    HZ   PHE  38           HZ       PHE  38  10.095  -1.133   5.443
  277    H    VAL  39           H        VAL  39   2.644  -0.134   5.682
  278    HA   VAL  39           HA       VAL  39   0.575   1.850   5.415
  279    HB   VAL  39           HB       VAL  39   0.342  -1.018   6.405
  280   1HG1  VAL  39          11HG      VAL  39  -1.757   0.897   5.398
  281   2HG1  VAL  39          12HG      VAL  39  -1.537   0.388   7.071
  282   3HG1  VAL  39          13HG      VAL  39  -2.028  -0.786   5.851
  283   1HG2  VAL  39          21HG      VAL  39  -0.416  -1.554   4.122
  284   2HG2  VAL  39          22HG      VAL  39   1.237  -0.929   4.119
  285   3HG2  VAL  39          23HG      VAL  39  -0.091   0.109   3.632
  286    H    LYS  40           H        LYS  40   0.177   3.188   6.930
  287    HA   LYS  40           HA       LYS  40   1.313   2.999   9.566
  288   1HB   LYS  40          1HB       LYS  40   1.222   5.133   8.407
  289   2HB   LYS  40          2HB       LYS  40  -0.511   5.003   8.260
  290   1HG   LYS  40          1HG       LYS  40   0.017   6.590   9.948
  291   2HG   LYS  40          2HG       LYS  40  -0.717   5.176  10.695
  292   1HD   LYS  40          1HD       LYS  40   1.548   4.386  11.314
  293   2HD   LYS  40          2HD       LYS  40   2.212   5.888  10.649
  294   1HE   LYS  40          1HE       LYS  40   0.739   7.146  12.151
  295   2HE   LYS  40          2HE       LYS  40   0.217   5.614  12.845
  296   1HZ   LYS  40          1HZ       LYS  40   3.015   6.660  12.924
  297   2HZ   LYS  40          2HZ       LYS  40   2.504   5.221  13.614
  298   3HZ   LYS  40          3HZ       LYS  40   1.930   6.687  14.193
  299    H    THR  41           H        THR  41  -1.931   2.963   8.167
  300    HA   THR  41           HA       THR  41  -3.018   1.684  10.543
  301    HB   THR  41           HB       THR  41  -4.392   3.997   9.413
  302    HG1  THR  41           HG1      THR  41  -2.307   4.010  11.380
  303   1HG2  THR  41          21HG      THR  41  -5.332   4.228  11.719
  304   2HG2  THR  41          22HG      THR  41  -4.398   2.801  12.185
  305   3HG2  THR  41          23HG      THR  41  -5.657   2.675  10.951
  306    H    VAL  42           H        VAL  42  -5.236   1.031  10.018
  307    HA   VAL  42           HA       VAL  42  -5.897   1.064   7.208
  308    HB   VAL  42           HB       VAL  42  -5.997  -1.415   9.007
  309   1HG1  VAL  42          11HG      VAL  42  -6.687  -2.634   6.981
  310   2HG1  VAL  42          12HG      VAL  42  -6.721  -1.079   6.125
  311   3HG1  VAL  42          13HG      VAL  42  -7.833  -1.372   7.460
  312   1HG2  VAL  42          21HG      VAL  42  -4.353  -2.397   7.512
  313   2HG2  VAL  42          22HG      VAL  42  -3.725  -0.928   8.263
  314   3HG2  VAL  42          23HG      VAL  42  -4.284  -0.897   6.590
  315    H    THR  43           H        THR  43  -8.229   0.813   6.928
  316    HA   THR  43           HA       THR  43 -10.071   1.971   8.606
  317    HB   THR  43           HB       THR  43 -10.493   1.270   6.225
  318    HG1  THR  43           HG1      THR  43 -12.373   1.610   7.551
  319   1HG2  THR  43          21HG      THR  43 -10.610  -1.411   7.467
  320   2HG2  THR  43          22HG      THR  43  -9.428  -0.869   6.253
  321   3HG2  THR  43          23HG      THR  43 -11.137  -1.089   5.813
  322    H    GLU  44           H        GLU  44 -11.453   1.105  10.220
  323    HA   GLU  44           HA       GLU  44 -10.267  -0.597  12.044
  324   1HB   GLU  44          1HB       GLU  44 -12.389  -0.431  13.235
  325   2HB   GLU  44          2HB       GLU  44 -11.768   1.127  12.707
  326   1HG   GLU  44          1HG       GLU  44 -13.264   0.992  10.769
  327   2HG   GLU  44          2HG       GLU  44 -13.922  -0.486  11.444
  328    H    GLY  45           H        GLY  45 -12.831  -1.238   9.710
  329   1HA   GLY  45          1HA       GLY  45 -12.065  -3.880   9.438
  330   2HA   GLY  45          2HA       GLY  45 -13.468  -3.846  10.539
  331    H    GLY  46           H        GLY  46 -12.550  -1.963   7.668
  332   1HA   GLY  46          1HA       GLY  46 -15.031  -2.683   6.503
  333   2HA   GLY  46          2HA       GLY  46 -13.846  -1.514   5.887
  334    H    ALA  47           H        ALA  47 -14.189  -2.661   4.009
  335    HA   ALA  47           HA       ALA  47 -13.819  -5.377   3.608
  336   1HB   ALA  47          1HB       ALA  47 -13.822  -5.055   1.314
  337   2HB   ALA  47          2HB       ALA  47 -13.010  -3.526   1.518
  338   3HB   ALA  47          3HB       ALA  47 -14.730  -3.654   1.956
  339    H    ALA  48           H        ALA  48 -11.320  -3.199   4.233
  340    HA   ALA  48           HA       ALA  48  -9.217  -4.545   2.780
  341   1HB   ALA  48          1HB       ALA  48  -7.680  -3.067   3.981
  342   2HB   ALA  48          2HB       ALA  48  -8.993  -2.539   5.028
  343   3HB   ALA  48          3HB       ALA  48  -9.025  -2.140   3.311
  344    H    GLN  49           H        GLN  49  -9.833  -4.122   6.330
  345    HA   GLN  49           HA       GLN  49  -8.282  -6.386   6.862
  346   1HB   GLN  49          1HB       GLN  49 -10.135  -4.753   8.573
  347   2HB   GLN  49          2HB       GLN  49  -9.365  -6.208   9.213
  348   1HG   GLN  49          1HG       GLN  49  -7.175  -5.167   8.443
  349   2HG   GLN  49          2HG       GLN  49  -8.113  -3.690   8.214
  350   1HE2  GLN  49          21HE      GLN  49  -8.820  -2.559  10.024
  351   2HE2  GLN  49          22HE      GLN  49  -8.268  -2.937  11.590
  352    H    ARG  50           H        ARG  50 -11.606  -6.032   6.029
  353    HA   ARG  50           HA       ARG  50 -12.487  -8.570   6.853
  354   1HB   ARG  50          1HB       ARG  50 -13.375  -6.904   4.524
  355   2HB   ARG  50          2HB       ARG  50 -14.189  -8.370   5.026
  356   1HG   ARG  50          1HG       ARG  50 -13.769  -6.043   6.835
  357   2HG   ARG  50          2HG       ARG  50 -15.230  -6.224   5.844
  358   1HD   ARG  50          1HD       ARG  50 -15.676  -8.339   6.973
  359   2HD   ARG  50          2HD       ARG  50 -14.208  -8.149   7.925
  360    HE   ARG  50           HE       ARG  50 -15.239  -6.097   8.813
  361   1HH1  ARG  50          11HH      ARG  50 -17.362  -8.601   7.457
  362   2HH1  ARG  50          12HH      ARG  50 -18.638  -8.308   8.536
  363   1HH2  ARG  50          21HH      ARG  50 -17.039  -5.696  10.302
  364   2HH2  ARG  50          22HH      ARG  50 -18.463  -6.618  10.162
  365    H    ASP  51           H        ASP  51 -10.815  -7.411   3.944
  366    HA   ASP  51           HA       ASP  51 -10.926  -9.726   2.397
  367   1HB   ASP  51          1HB       ASP  51 -10.038  -7.618   1.512
  368   2HB   ASP  51          2HB       ASP  51  -8.647  -7.710   2.581
  369    H    GLY  52           H        GLY  52  -8.238  -8.719   4.473
  370   1HA   GLY  52          1HA       GLY  52  -7.474 -10.177   6.220
  371   2HA   GLY  52          2HA       GLY  52  -7.976 -11.546   5.241
  372    H    ARG  53           H        ARG  53  -6.608 -10.098   2.863
  373    HA   ARG  53           HA       ARG  53  -4.022 -11.357   3.269
  374   1HB   ARG  53          1HB       ARG  53  -5.376 -11.217   1.089
  375   2HB   ARG  53          2HB       ARG  53  -4.887  -9.546   1.012
  376   1HG   ARG  53          1HG       ARG  53  -2.920 -11.837   1.051
  377   2HG   ARG  53          2HG       ARG  53  -3.613 -11.199  -0.422
  378   1HD   ARG  53          1HD       ARG  53  -1.674 -10.077  -0.388
  379   2HD   ARG  53          2HD       ARG  53  -2.644  -8.925   0.525
  380    HE   ARG  53           HE       ARG  53  -1.002 -10.909   1.930
  381   1HH1  ARG  53          11HH      ARG  53  -1.581  -7.490   1.113
  382   2HH1  ARG  53          12HH      ARG  53  -0.484  -6.927   2.317
  383   1HH2  ARG  53          21HH      ARG  53   0.677 -10.010   3.444
  384   2HH2  ARG  53          22HH      ARG  53   0.846  -8.316   3.520
  385    H    ILE  54           H        ILE  54  -5.118  -8.083   2.557
  386    HA   ILE  54           HA       ILE  54  -2.542  -6.978   3.031
  387    HB   ILE  54           HB       ILE  54  -4.294  -5.981   1.482
  388   1HG1  ILE  54          11HG      ILE  54  -3.249  -4.075   3.590
  389   2HG1  ILE  54          12HG      ILE  54  -2.262  -4.745   2.297
  390   1HG2  ILE  54          21HG      ILE  54  -6.245  -6.147   2.920
  391   2HG2  ILE  54          22HG      ILE  54  -5.956  -4.429   2.579
  392   3HG2  ILE  54          23HG      ILE  54  -5.450  -5.140   4.124
  393   1HD1  ILE  54          11HD      ILE  54  -4.706  -3.038   1.904
  394   2HD1  ILE  54          12HD      ILE  54  -3.624  -3.651   0.640
  395   3HD1  ILE  54          13HD      ILE  54  -3.029  -2.478   1.807
  396    H    GLN  55           H        GLN  55  -1.760  -5.902   4.779
  397    HA   GLN  55           HA       GLN  55  -3.535  -5.708   7.042
  398   1HB   GLN  55          1HB       GLN  55  -0.835  -7.054   7.106
  399   2HB   GLN  55          2HB       GLN  55  -1.633  -6.488   8.561
  400   1HG   GLN  55          1HG       GLN  55  -2.796  -8.505   6.653
  401   2HG   GLN  55          2HG       GLN  55  -1.897  -8.919   8.110
  402   1HE2  GLN  55          21HE      GLN  55  -3.597  -9.950   9.086
  403   2HE2  GLN  55          22HE      GLN  55  -5.006  -9.136   9.657
  404    H    VAL  56           H        VAL  56  -2.304  -4.562   8.901
  405    HA   VAL  56           HA       VAL  56  -1.481  -1.981   7.904
  406    HB   VAL  56           HB       VAL  56  -3.079  -2.367   9.809
  407   1HG1  VAL  56          11HG      VAL  56  -2.215  -2.797  12.061
  408   2HG1  VAL  56          12HG      VAL  56  -0.642  -3.177  11.350
  409   3HG1  VAL  56          13HG      VAL  56  -2.046  -4.165  10.959
  410   1HG2  VAL  56          21HG      VAL  56  -0.693  -0.623  10.438
  411   2HG2  VAL  56          22HG      VAL  56  -2.261  -0.506  11.236
  412   3HG2  VAL  56          23HG      VAL  56  -2.119  -0.146   9.522
  413    H    ASN  57           H        ASN  57   0.306  -4.354   7.635
  414    HA   ASN  57           HA       ASN  57   2.697  -3.167   8.871
  415   1HB   ASN  57          1HB       ASN  57   1.817  -5.171  10.189
  416   2HB   ASN  57          2HB       ASN  57   2.192  -6.157   8.787
  417   1HD2  ASN  57          21HD      ASN  57   3.505  -4.231  11.375
  418   2HD2  ASN  57          22HD      ASN  57   5.103  -4.878  11.304
  419    H    ASP  58           H        ASP  58   1.234  -3.513   6.174
  420    HA   ASP  58           HA       ASP  58   3.306  -4.831   4.609
  421   1HB   ASP  58          1HB       ASP  58   0.602  -3.722   3.867
  422   2HB   ASP  58          2HB       ASP  58   1.780  -4.246   2.671
  423    H    GLN  59           H        GLN  59   3.480  -3.568   2.361
  424    HA   GLN  59           HA       GLN  59   4.053  -0.772   2.892
  425   1HB   GLN  59          1HB       GLN  59   6.164  -1.912   3.140
  426   2HB   GLN  59          2HB       GLN  59   5.892  -2.817   1.654
  427   1HG   GLN  59          1HG       GLN  59   6.138  -0.866   0.335
  428   2HG   GLN  59          2HG       GLN  59   6.140   0.168   1.758
  429   1HE2  GLN  59          21HE      GLN  59   7.936   0.273   3.003
  430   2HE2  GLN  59          22HE      GLN  59   9.485  -0.236   2.407
  431    H    ILE  60           H        ILE  60   3.235   0.487   1.305
  432    HA   ILE  60           HA       ILE  60   1.765  -0.755  -0.862
  433    HB   ILE  60           HB       ILE  60   2.247   2.198  -0.403
  434   1HG1  ILE  60          11HG      ILE  60   1.114   1.313   1.597
  435   2HG1  ILE  60          12HG      ILE  60   0.002   2.255   0.603
  436   1HG2  ILE  60          21HG      ILE  60   1.513   1.439  -2.641
  437   2HG2  ILE  60          22HG      ILE  60   0.387   2.543  -1.868
  438   3HG2  ILE  60          23HG      ILE  60   0.045   0.807  -1.898
  439   1HD1  ILE  60          11HD      ILE  60   0.142  -0.740   0.720
  440   2HD1  ILE  60          12HD      ILE  60  -0.964   0.206  -0.273
  441   3HD1  ILE  60          13HD      ILE  60  -1.079   0.275   1.488
  442    H    VAL  61           H        VAL  61   2.820  -1.334  -2.676
  443    HA   VAL  61           HA       VAL  61   5.260   0.104  -3.393
  444    HB   VAL  61           HB       VAL  61   4.132  -2.525  -4.391
  445   1HG1  VAL  61          11HG      VAL  61   6.229  -2.933  -5.417
  446   2HG1  VAL  61          12HG      VAL  61   6.810  -1.312  -4.985
  447   3HG1  VAL  61          13HG      VAL  61   5.457  -1.513  -6.124
  448   1HG2  VAL  61          21HG      VAL  61   4.869  -2.627  -2.090
  449   2HG2  VAL  61          22HG      VAL  61   6.444  -1.974  -2.541
  450   3HG2  VAL  61          23HG      VAL  61   5.940  -3.559  -3.131
  451    H    GLU  62           H        GLU  62   2.260  -0.979  -4.902
  452    HA   GLU  62           HA       GLU  62   2.259   1.356  -6.663
  453   1HB   GLU  62          1HB       GLU  62   3.439  -0.166  -8.048
  454   2HB   GLU  62          2HB       GLU  62   2.369  -1.498  -7.743
  455   1HG   GLU  62          1HG       GLU  62   0.558  -0.133  -8.867
  456   2HG   GLU  62          2HG       GLU  62   1.843   0.985  -9.317
  457    H    VAL  63           H        VAL  63   0.229   2.185  -6.288
  458    HA   VAL  63           HA       VAL  63  -1.893   0.215  -6.020
  459    HB   VAL  63           HB       VAL  63  -1.465   2.887  -4.715
  460   1HG1  VAL  63          11HG      VAL  63  -3.579   3.180  -5.939
  461   2HG1  VAL  63          12HG      VAL  63  -3.866   3.058  -4.196
  462   3HG1  VAL  63          13HG      VAL  63  -4.194   1.674  -5.252
  463   1HG2  VAL  63          21HG      VAL  63  -2.728   0.307  -3.869
  464   2HG2  VAL  63          22HG      VAL  63  -2.325   1.667  -2.826
  465   3HG2  VAL  63          23HG      VAL  63  -1.044   0.734  -3.624
  466    H    ASP  64           H        ASP  64  -3.244  -0.010  -7.559
  467    HA   ASP  64           HA       ASP  64  -4.706   0.356  -9.237
  468   1HB   ASP  64          1HB       ASP  64  -5.386   2.363  -7.930
  469   2HB   ASP  64          2HB       ASP  64  -4.190   3.314  -8.786
  470    H    GLY  65           H        GLY  65  -1.653   0.728  -9.459
  471   1HA   GLY  65          1HA       GLY  65  -0.319   0.409 -11.377
  472   2HA   GLY  65          2HA       GLY  65  -1.642   1.044 -12.350
  473    H    ILE  66           H        ILE  66  -0.964   2.931  -9.568
  474    HA   ILE  66           HA       ILE  66  -0.045   5.055 -11.202
  475    HB   ILE  66           HB       ILE  66  -1.392   5.181  -8.882
  476   1HG1  ILE  66          11HG      ILE  66   0.836   7.133  -9.488
  477   2HG1  ILE  66          12HG      ILE  66  -0.694   7.075 -10.357
  478   1HG2  ILE  66          21HG      ILE  66   1.461   5.224  -7.968
  479   2HG2  ILE  66          22HG      ILE  66   0.216   4.066  -7.489
  480   3HG2  ILE  66          23HG      ILE  66   0.091   5.766  -7.006
  481   1HD1  ILE  66          11HD      ILE  66  -1.864   7.544  -8.276
  482   2HD1  ILE  66          12HD      ILE  66  -0.725   8.828  -8.713
  483   3HD1  ILE  66          13HD      ILE  66  -0.309   7.657  -7.449
  484    H    SER  67           H        SER  67   1.454   2.697  -9.253
  485    HA   SER  67           HA       SER  67   3.557   2.118  -8.659
  486   1HB   SER  67          1HB       SER  67   3.796   1.915 -11.160
  487   2HB   SER  67          2HB       SER  67   4.405   3.580 -11.149
  488    HG   SER  67           HG       SER  67   6.254   2.914 -10.399
  489    H    LEU  68           H        LEU  68   3.915   3.135  -6.814
  490    HA   LEU  68           HA       LEU  68   4.779   5.932  -6.921
  491   1HB   LEU  68          1HB       LEU  68   4.110   5.987  -4.561
  492   2HB   LEU  68          2HB       LEU  68   2.787   5.593  -5.639
  493    HG   LEU  68           HG       LEU  68   4.092   3.212  -4.673
  494   1HD1  LEU  68          11HD      LEU  68   3.380   3.415  -2.348
  495   2HD1  LEU  68          12HD      LEU  68   2.962   5.118  -2.639
  496   3HD1  LEU  68          13HD      LEU  68   4.637   4.568  -2.805
  497   1HD2  LEU  68          21HD      LEU  68   1.935   3.364  -5.748
  498   2HD2  LEU  68          22HD      LEU  68   1.292   4.282  -4.375
  499   3HD2  LEU  68          23HD      LEU  68   1.825   2.605  -4.167
  500    H    VAL  69           H        VAL  69   6.192   3.397  -7.252
  501    HA   VAL  69           HA       VAL  69   7.916   2.789  -5.185
  502    HB   VAL  69           HB       VAL  69   8.692   2.720  -8.089
  503   1HG1  VAL  69          11HG      VAL  69  10.528   2.311  -6.544
  504   2HG1  VAL  69          12HG      VAL  69  10.123   0.854  -7.443
  505   3HG1  VAL  69          13HG      VAL  69   9.605   1.023  -5.765
  506   1HG2  VAL  69          21HG      VAL  69   7.802   0.408  -8.115
  507   2HG2  VAL  69          22HG      VAL  69   6.552   1.619  -7.889
  508   3HG2  VAL  69          23HG      VAL  69   7.123   0.674  -6.508
  509    H    GLY  70           H        GLY  70   8.694   4.489  -4.098
  510   1HA   GLY  70          1HA       GLY  70  10.859   5.515  -3.697
  511   2HA   GLY  70          2HA       GLY  70  10.903   5.962  -5.393
  512    H    VAL  71           H        VAL  71   7.828   6.489  -4.114
  513    HA   VAL  71           HA       VAL  71   8.260   9.339  -4.242
  514    HB   VAL  71           HB       VAL  71   5.870   9.594  -3.991
  515   1HG1  VAL  71          11HG      VAL  71   6.681   9.052  -6.199
  516   2HG1  VAL  71          12HG      VAL  71   5.097   8.327  -5.923
  517   3HG1  VAL  71          13HG      VAL  71   6.548   7.329  -5.842
  518   1HG2  VAL  71          21HG      VAL  71   5.518   7.877  -2.264
  519   2HG2  VAL  71          22HG      VAL  71   5.772   6.614  -3.462
  520   3HG2  VAL  71          23HG      VAL  71   4.382   7.703  -3.599
  521    H    THR  72           H        THR  72   6.760  10.572  -2.512
  522    HA   THR  72           HA       THR  72   7.835   9.941   0.117
  523    HB   THR  72           HB       THR  72   6.807  12.207   0.611
  524    HG1  THR  72           HG1      THR  72   6.976  12.997  -1.991
  525   1HG2  THR  72          21HG      THR  72   8.692  13.425  -0.425
  526   2HG2  THR  72          22HG      THR  72   9.012  12.035  -1.464
  527   3HG2  THR  72          23HG      THR  72   9.218  11.898   0.281
  528    H    GLN  73           H        GLN  73   6.351  10.568   1.833
  529    HA   GLN  73           HA       GLN  73   4.162   8.887   1.872
  530   1HB   GLN  73          1HB       GLN  73   3.804   9.632   4.109
  531   2HB   GLN  73          2HB       GLN  73   5.517   9.658   3.798
  532   1HG   GLN  73          1HG       GLN  73   3.668  11.944   3.866
  533   2HG   GLN  73          2HG       GLN  73   4.831  11.545   5.136
  534   1HE2  GLN  73          21HE      GLN  73   7.137  11.467   4.344
  535   2HE2  GLN  73          22HE      GLN  73   7.605  12.670   3.216
  536    H    ASN  74           H        ASN  74   4.366  12.291   1.144
  537    HA   ASN  74           HA       ASN  74   1.576  12.651   1.281
  538   1HB   ASN  74          1HB       ASN  74   1.895  14.856   0.264
  539   2HB   ASN  74          2HB       ASN  74   3.068  14.590   1.544
  540   1HD2  ASN  74          21HD      ASN  74   5.232  14.543   1.021
  541   2HD2  ASN  74          22HD      ASN  74   5.805  14.976  -0.537
  542    H    PHE  75           H        PHE  75   3.713  11.674  -1.299
  543    HA   PHE  75           HA       PHE  75   1.728  11.919  -3.328
  544   1HB   PHE  75          1HB       PHE  75   4.175  11.690  -3.851
  545   2HB   PHE  75          2HB       PHE  75   4.085  10.033  -3.255
  546    HD1  PHE  75           HD1      PHE  75   3.538  12.201  -6.069
  547    HD2  PHE  75           HD2      PHE  75   2.622   8.360  -4.491
  548    HE1  PHE  75           HE1      PHE  75   2.860  11.439  -8.306
  549    HE2  PHE  75           HE2      PHE  75   1.953   7.593  -6.707
  550    HZ   PHE  75           HZ       PHE  75   2.069   9.132  -8.630
  551    H    ALA  76           H        ALA  76   2.931   9.280  -1.299
  552    HA   ALA  76           HA       ALA  76   1.168   7.317  -2.220
  553   1HB   ALA  76          1HB       ALA  76   2.405   7.565   0.517
  554   2HB   ALA  76          2HB       ALA  76   3.162   6.835  -0.903
  555   3HB   ALA  76          3HB       ALA  76   1.719   6.102  -0.196
  556    H    ALA  77           H        ALA  77   0.823   9.614   0.471
  557    HA   ALA  77           HA       ALA  77  -1.667   8.752   1.374
  558   1HB   ALA  77          1HB       ALA  77  -0.603  11.580   1.318
  559   2HB   ALA  77          2HB       ALA  77  -0.290  10.393   2.582
  560   3HB   ALA  77          3HB       ALA  77  -1.929  10.994   2.321
  561    H    THR  78           H        THR  78  -0.781  10.880  -1.271
  562    HA   THR  78           HA       THR  78  -3.378  11.701  -1.904
  563    HB   THR  78           HB       THR  78  -0.859  11.593  -3.576
  564    HG1  THR  78           HG1      THR  78  -0.567  13.060  -2.009
  565   1HG2  THR  78          21HG      THR  78  -3.474  13.021  -4.134
  566   2HG2  THR  78          22HG      THR  78  -2.839  11.648  -5.040
  567   3HG2  THR  78          23HG      THR  78  -1.993  13.197  -5.079
  568    H    VAL  79           H        VAL  79  -1.347   9.082  -3.334
  569    HA   VAL  79           HA       VAL  79  -3.393   8.260  -5.004
  570    HB   VAL  79           HB       VAL  79  -1.190   7.562  -5.628
  571   1HG1  VAL  79          11HG      VAL  79  -1.236   6.025  -3.172
  572   2HG1  VAL  79          12HG      VAL  79  -0.397   7.543  -3.520
  573   3HG1  VAL  79          13HG      VAL  79   0.088   6.040  -4.389
  574   1HG2  VAL  79          21HG      VAL  79  -2.851   5.212  -4.830
  575   2HG2  VAL  79          22HG      VAL  79  -1.508   5.160  -5.966
  576   3HG2  VAL  79          23HG      VAL  79  -2.966   6.101  -6.347
  577    H    LEU  80           H        LEU  80  -2.542   7.064  -1.785
  578    HA   LEU  80           HA       LEU  80  -4.510   5.019  -1.775
  579   1HB   LEU  80          1HB       LEU  80  -2.933   6.310   0.426
  580   2HB   LEU  80          2HB       LEU  80  -4.247   5.228   0.813
  581    HG   LEU  80           HG       LEU  80  -2.229   3.992   0.983
  582   1HD1  LEU  80          11HD      LEU  80  -4.111   2.839  -0.030
  583   2HD1  LEU  80          12HD      LEU  80  -2.551   2.198  -0.542
  584   3HD1  LEU  80          13HD      LEU  80  -3.476   3.227  -1.631
  585   1HD2  LEU  80          21HD      LEU  80  -0.832   5.475  -0.458
  586   2HD2  LEU  80          22HD      LEU  80  -1.544   4.651  -1.865
  587   3HD2  LEU  80          23HD      LEU  80  -0.588   3.751  -0.694
  588    H    ARG  81           H        ARG  81  -4.712   8.381  -1.117
  589    HA   ARG  81           HA       ARG  81  -7.332   8.091   0.041
  590   1HB   ARG  81          1HB       ARG  81  -6.140   9.804   1.071
  591   2HB   ARG  81          2HB       ARG  81  -5.456  10.356  -0.441
  592   1HG   ARG  81          1HG       ARG  81  -8.367  10.727  -0.032
  593   2HG   ARG  81          2HG       ARG  81  -7.257  11.751   0.892
  594   1HD   ARG  81          1HD       ARG  81  -6.147  12.396  -1.191
  595   2HD   ARG  81          2HD       ARG  81  -7.279  11.397  -2.098
  596    HE   ARG  81           HE       ARG  81  -8.972  12.949  -0.919
  597   1HH1  ARG  81          11HH      ARG  81  -5.775  13.968  -2.111
  598   2HH1  ARG  81          12HH      ARG  81  -6.318  15.444  -2.722
  599   1HH2  ARG  81          21HH      ARG  81  -9.694  15.027  -1.749
  600   2HH2  ARG  81          22HH      ARG  81  -8.589  16.070  -2.512
  601    H    ASN  82           H        ASN  82  -6.024   8.553  -3.080
  602    HA   ASN  82           HA       ASN  82  -8.501   9.547  -4.203
  603   1HB   ASN  82          1HB       ASN  82  -5.804   9.072  -5.299
  604   2HB   ASN  82          2HB       ASN  82  -7.164   8.985  -6.422
  605   1HD2  ASN  82          21HD      ASN  82  -5.392  10.980  -4.254
  606   2HD2  ASN  82          22HD      ASN  82  -6.047  12.488  -4.818
  607    H    THR  83           H        THR  83  -7.742   6.700  -3.132
  608    HA   THR  83           HA       THR  83  -8.324   4.944  -5.246
  609    HB   THR  83           HB       THR  83  -8.681   3.308  -3.368
  610    HG1  THR  83           HG1      THR  83  -7.583   4.988  -1.483
  611   1HG2  THR  83          21HG      THR  83  -6.480   3.616  -4.454
  612   2HG2  THR  83          22HG      THR  83  -6.275   3.282  -2.748
  613   3HG2  THR  83          23HG      THR  83  -6.119   4.932  -3.348
  614    H    LYS  84           H        LYS  84 -10.119   3.258  -4.710
  615    HA   LYS  84           HA       LYS  84 -12.621   4.284  -3.879
  616   1HB   LYS  84          1HB       LYS  84 -13.560   3.552  -6.265
  617   2HB   LYS  84          2HB       LYS  84 -12.990   5.181  -5.990
  618   1HG   LYS  84          1HG       LYS  84 -12.175   4.490  -8.113
  619   2HG   LYS  84          2HG       LYS  84 -10.807   4.502  -7.016
  620   1HD   LYS  84          1HD       LYS  84 -10.977   2.066  -6.793
  621   2HD   LYS  84          2HD       LYS  84 -12.354   2.064  -7.894
  622   1HE   LYS  84          1HE       LYS  84  -9.549   2.976  -8.568
  623   2HE   LYS  84          2HE       LYS  84 -10.285   1.458  -9.068
  624   1HZ   LYS  84          1HZ       LYS  84 -11.936   2.751 -10.298
  625   2HZ   LYS  84          2HZ       LYS  84 -10.367   3.092 -10.836
  626   3HZ   LYS  84          3HZ       LYS  84 -11.177   4.183  -9.854
  627    H    GLY  85           H        GLY  85 -14.087   2.187  -5.207
  628   1HA   GLY  85          1HA       GLY  85 -13.808   0.142  -3.354
  629   2HA   GLY  85          2HA       GLY  85 -14.619  -0.018  -4.901
  630    H    ASN  86           H        ASN  86 -13.193  -0.520  -6.765
  631    HA   ASN  86           HA       ASN  86 -11.513  -2.746  -6.026
  632   1HB   ASN  86          1HB       ASN  86 -12.209  -1.648  -8.752
  633   2HB   ASN  86          2HB       ASN  86 -11.273  -3.113  -8.474
  634   1HD2  ASN  86          21HD      ASN  86 -12.315  -4.951  -7.727
  635   2HD2  ASN  86          22HD      ASN  86 -14.028  -5.095  -7.671
  636    H    VAL  87           H        VAL  87  -9.548  -2.467  -5.442
  637    HA   VAL  87           HA       VAL  87  -7.861  -0.532  -6.880
  638    HB   VAL  87           HB       VAL  87  -7.936  -1.025  -3.911
  639   1HG1  VAL  87          11HG      VAL  87  -6.151   0.679  -3.817
  640   2HG1  VAL  87          12HG      VAL  87  -6.051   0.588  -5.598
  641   3HG1  VAL  87          13HG      VAL  87  -5.753  -0.856  -4.602
  642   1HG2  VAL  87          21HG      VAL  87  -8.479   1.469  -5.508
  643   2HG2  VAL  87          22HG      VAL  87  -8.475   1.319  -3.744
  644   3HG2  VAL  87          23HG      VAL  87  -9.681   0.456  -4.704
  645    H    ARG  88           H        ARG  88  -6.066  -1.508  -7.684
  646    HA   ARG  88           HA       ARG  88  -5.252  -4.048  -6.487
  647   1HB   ARG  88          1HB       ARG  88  -4.163  -2.633  -8.905
  648   2HB   ARG  88          2HB       ARG  88  -3.463  -4.091  -8.223
  649   1HG   ARG  88          1HG       ARG  88  -4.738  -5.060  -9.770
  650   2HG   ARG  88          2HG       ARG  88  -5.960  -4.928  -8.524
  651   1HD   ARG  88          1HD       ARG  88  -6.830  -4.162 -10.648
  652   2HD   ARG  88          2HD       ARG  88  -6.763  -2.835  -9.482
  653    HE   ARG  88           HE       ARG  88  -4.388  -2.791 -10.870
  654   1HH1  ARG  88          11HH      ARG  88  -7.806  -2.436 -11.688
  655   2HH1  ARG  88          12HH      ARG  88  -7.540  -1.382 -12.997
  656   1HH2  ARG  88          21HH      ARG  88  -4.015  -1.332 -12.718
  657   2HH2  ARG  88          22HH      ARG  88  -5.350  -0.760 -13.583
  658    H    PHE  89           H        PHE  89  -4.221  -3.861  -4.714
  659    HA   PHE  89           HA       PHE  89  -2.203  -1.793  -4.370
  660   1HB   PHE  89          1HB       PHE  89  -3.091  -3.999  -2.503
  661   2HB   PHE  89          2HB       PHE  89  -1.933  -2.729  -2.155
  662    HD1  PHE  89           HD1      PHE  89  -5.442  -3.492  -2.764
  663    HD2  PHE  89           HD2      PHE  89  -2.630  -0.596  -1.529
  664    HE1  PHE  89           HE1      PHE  89  -7.278  -2.071  -1.894
  665    HE2  PHE  89           HE2      PHE  89  -4.437   0.810  -0.643
  666    HZ   PHE  89           HZ       PHE  89  -6.753   0.075  -0.826
  667    H    VAL  90           H        VAL  90  -0.515  -2.426  -5.634
  668    HA   VAL  90           HA       VAL  90   0.370  -5.168  -5.447
  669    HB   VAL  90           HB       VAL  90   1.681  -2.822  -6.777
  670   1HG1  VAL  90          11HG      VAL  90   2.212  -5.791  -7.077
  671   2HG1  VAL  90          12HG      VAL  90   3.259  -4.623  -6.269
  672   3HG1  VAL  90          13HG      VAL  90   3.009  -4.523  -8.011
  673   1HG2  VAL  90          21HG      VAL  90  -0.023  -4.974  -8.019
  674   2HG2  VAL  90          22HG      VAL  90   0.833  -3.707  -8.903
  675   3HG2  VAL  90          23HG      VAL  90  -0.472  -3.285  -7.793
  676    H    ILE  91           H        ILE  91   0.850  -5.391  -3.487
  677    HA   ILE  91           HA       ILE  91   2.989  -3.818  -2.284
  678    HB   ILE  91           HB       ILE  91   0.757  -5.546  -1.251
  679   1HG1  ILE  91          11HG      ILE  91   1.408  -2.663  -0.760
  680   2HG1  ILE  91          12HG      ILE  91   0.243  -3.242  -1.944
  681   1HG2  ILE  91          21HG      ILE  91   2.729  -6.027   0.125
  682   2HG2  ILE  91          22HG      ILE  91   1.454  -5.210   1.012
  683   3HG2  ILE  91          23HG      ILE  91   2.883  -4.303   0.493
  684   1HD1  ILE  91          11HD      ILE  91  -0.771  -2.436  -0.016
  685   2HD1  ILE  91          12HD      ILE  91   0.103  -3.627   0.992
  686   3HD1  ILE  91          13HD      ILE  91  -1.062  -4.167  -0.262
  687    H    GLY  92           H        GLY  92   4.618  -5.041  -1.251
  688   1HA   GLY  92          1HA       GLY  92   4.773  -7.755  -2.280
  689   2HA   GLY  92          2HA       GLY  92   6.210  -6.733  -2.191
  690    H    ARG  93           H        ARG  93   5.916  -9.220  -0.883
  691    HA   ARG  93           HA       ARG  93   6.115  -8.301   1.886
  692   1HB   ARG  93          1HB       ARG  93   3.852  -9.355   1.236
  693   2HB   ARG  93          2HB       ARG  93   4.726 -10.864   1.102
  694   1HG   ARG  93          1HG       ARG  93   4.723  -9.299   3.657
  695   2HG   ARG  93          2HG       ARG  93   3.379 -10.345   3.230
  696   1HD   ARG  93          1HD       ARG  93   4.991 -12.229   3.054
  697   2HD   ARG  93          2HD       ARG  93   6.261 -11.143   3.624
  698    HE   ARG  93           HE       ARG  93   3.999 -11.162   5.335
  699   1HH1  ARG  93          11HH      ARG  93   6.964 -12.957   4.579
  700   2HH1  ARG  93          12HH      ARG  93   7.062 -13.732   6.074
  701   1HH2  ARG  93          21HH      ARG  93   4.159 -12.218   7.430
  702   2HH2  ARG  93          22HH      ARG  93   5.441 -13.280   7.755
  703    H    GLU  94           H        GLU  94   7.515  -9.567   3.163
  704    HA   GLU  94           HA       GLU  94   9.757 -10.628   1.882
  705   1HB   GLU  94          1HB       GLU  94  10.370 -11.348   4.255
  706   2HB   GLU  94          2HB       GLU  94  10.111  -9.631   4.004
  707   1HG   GLU  94          1HG       GLU  94   7.892  -9.796   4.993
  708   2HG   GLU  94          2HG       GLU  94   8.083 -11.535   5.170