*HEADER    TRANSFERASE                             01-JUN-10   2KYL              
*TITLE     SOLUTION STRUCTURE OF MAST2-PDZ COMPLEXED WITH THE C-TERMINUS OF PTEN 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MICROTUBULE-ASSOCIATED SERINE/THREONINE-PROTEIN KINASE 2;  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: PDZ DOMAIN;                                                
*COMPND   5 EC: 2.7.11.1;                                                        
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: C-TERMINUS OF PHOSPHATIDYLINOSITOL-3,4,5-TRISPHOSPHATE 3-  
*COMPND   9 PHOSPHATASE AND DUAL-SPECIFICITY PROTEIN PHOSPHATASE PTEN;           
*COMPND  10 CHAIN: B;                                                            
*COMPND  11 SYNONYM: C-TERMINUS OF PTEN;                                         
*COMPND  12 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PDEST15;                                   
*SOURCE   9 MOL_ID: 2;                                                           
*SOURCE  10 SYNTHETIC: YES;                                                      
*SOURCE  11 OTHER_DETAILS: SYNTHETIC PEPTIDE                                     
*KEYWDS    PDZ, COMPLEX, KINASE, TRANSFERASE                                     
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    E.TERRIEN, N.WOLFF, F.CORDIER, C.SIMENEL, M.LAFON, M.DELEPIERRE       
*REVDAT   1   08-JUN-11 2KYL    0                                                


!Inter
assign (resid   17 and name  HB1) (resid   109 and name HG1#) 4.716 2.92  1.28  weight 1.000    
assign (resid   17 and name  HB1) (resid   109 and name HG2#) 4.959 3.16  1.04  weight 1.000    
assign (resid   17 and name  HB2) (resid   109 and name HG2#) 4.962 3.16  1.04  weight 1.000    
assign (resid   17 and name  HB2) (resid   109 and name HG1#) 4.831 3.03  1.17  weight 1.000    
assign (resid   17 and name  HD#) (resid   109 and name HG2#) 4.834 3.03  1.17  weight 1.000    
assign (resid   17 and name  HD#) (resid   109 and name HG1#) 4.349 2.55  1.65  weight 1.000    
assign (resid   17 and name  HD#) (resid   109 and name   HB) 4.761 2.96  1.24  weight 1.000    
assign (resid   17 and name  HE#) (resid   109 and name   HN) 4.394 2.59  1.61  weight 1.000    
assign (resid   17 and name  HE#) (resid   109 and name   HB) 4.898 3.1   1.1   weight 1.000    
assign (resid   17 and name  HE#) (resid   109 and name HG1#) 4.793 2.99  1.21  weight 1.000    
assign (resid   17 and name  HE#) (resid   109 and name HG2#) 4.963 3.16  1.04  weight 1.000    
assign (resid   19 and name  HE#) (resid   109 and name HG1#) 4.466 2.67  1.53  weight 1.000    
assign (resid   19 and name  HE#) (resid   109 and name HG2#) 4.850 3.05  1.15  weight 1.000    
assign (resid   20 and name   HA) (resid   108 and name   HA) 3.257 1.46  2.74  weight 1.000    
assign (resid   20 and name   HB) (resid   109 and name HG1#) 4.882 3.08  1.12  weight 1.000    
assign (resid   20 and name HG2#) (resid   108 and name   HN) 4.948 3.15  1.05  weight 1.000    
assign (resid   20 and name HG2#) (resid   108 and name   HA) 4.271 2.47  1.73  weight 1.000    
assign (resid   20 and name HG2#) (resid   107 and name   HB) 4.890 3.09  1.11  weight 1.000    
assign (resid   20 and name HG2#) (resid   108 and name  HE#) 4.860 3.06  1.14  weight 1.000    
assign (resid   20 and name HG2#) (resid   108 and name  HB#) 4.623 2.82  1.38  weight 1.000    
assign (resid   20 and name HG2#) (resid   108 and name  HD#) 4.477 2.68  1.52  weight 1.000    
assign (resid   20 and name HG2#) (resid   108 and name  HG#) 4.146 2.35  1.85  weight 1.000    
assign (resid   21 and name   HA) (resid   109 and name HG1#) 4.718 2.92  1.28  weight 1.000    
assign (resid   21 and name  HB2) (resid   109 and name HG1#) 4.743 2.94  1.26  weight 1.000    
assign (resid   21 and name  HB1) (resid   109 and name HG1#) 4.776 2.98  1.22  weight 1.000    
assign (resid   21 and name  HB2) (resid   109 and name HG2#) 4.988 3.18  1.01  weight 1.000    
assign (resid   21 and name  HB2) (resid   109 and name HG2#) 4.989 3.18  1.01  weight 1.000    
assign (resid   21 and name HD2#) (resid   107 and name   HB) 4.854 3.05  1.15  weight 1.000    
assign (resid   21 and name HD2#) (resid   109 and name HG2#) 4.881 3.08  1.12  weight 1.000    
assign (resid   21 and name HD1#) (resid   109 and name HG2#) 4.901 3.1   1.1   weight 1.000    
assign (resid   81 and name HD2#) (resid   109 and name HG1#) 4.299 2.5   1.7   weight 1.000    
assign (resid   22 and name  HB2) (resid   106 and name HG2#) 4.898 3.1   1.1   weight 1.000    
assign (resid   22 and name  HB1) (resid   106 and name HG2#) 4.850 3.05  1.15  weight 1.000    
assign (resid   23 and name  HB#) (resid   107 and name   HB) 4.942 3.14  1.06  weight 1.000    
assign (resid   23 and name  HB#) (resid   105 and name  HG#) 4.878 3.08  1.12  weight 1.000    
assign (resid   23 and name  HB#) (resid   105 and name  HB#) 4.225 2.43  1.77  weight 1.000    
assign (resid   23 and name  HB#) (resid   106 and name   HB) 4.773 2.97  1.23  weight 1.000    
assign (resid   73 and name  HD2) (resid   107 and name HG2#) 4.863 3.06  1.14  weight 1.000    
assign (resid   73 and name  HD2) (resid   107 and name   HB) 4.909 3.11  1.09  weight 1.000    
assign (resid   73 and name  HD2) (resid   107 and name   HA) 4.854 3.05  1.15  weight 1.000    
assign (resid   17 and name  HD#) (resid   109 and name   HN) 4.954 3.15  1.05  weight 1.000    
assign (resid   73 and name  HE1) (resid   107 and name HG2#) 4.970 3.17  1.03  weight 1.000    
assign (resid   73 and name  HE1) (resid   107 and name   HB) 4.808 3.01  1.19  weight 1.000    
assign (resid   77 and name   HA) (resid   109 and name HG1#) 4.600 2.8   1.4   weight 1.000    
assign (resid   77 and name   HA) (resid   107 and name HG2#) 4.827 3.03  1.17  weight 1.000    
assign (resid   77 and name   HB) (resid   107 and name HG2#) 4.845 3.05  1.15  weight 1.000    
assign (resid   77 and name HG2#) (resid   107 and name   HA) 4.929 3.13  1.07  weight 1.000    
assign (resid   77 and name HG2#) (resid   107 and name   HB) 4.050 2.25  1.95  weight 1.000    
assign (resid   77 and name HG2#) (resid   107 and name HG2#) 2.504 0.7   3.5   weight 1.000    
assign (resid   77 and name HG2#) (resid   109 and name HG1#) 4.299 2.5   1.7   weight 1.000    
assign (resid   77 and name HG1#) (resid   107 and name   HA) 4.949 3.15  1.05  weight 1.000    
assign (resid   77 and name HG1#) (resid   109 and name   HB) 4.830 3.03  1.17  weight 1.000    
assign (resid   77 and name HG1#) (resid   107 and name HG2#) 1.800 0   4.2   weight 1.000    
assign (resid   80 and name   HA) (resid   109 and name HG1#) 4.943 3.14  1.06  weight 1.000    
assign (resid   80 and name   HB) (resid   109 and name HG1#) 4.772 2.97  1.23  weight 1.000    
assign (resid   81 and name HD1#) (resid   107 and name HG2#) 4.698 2.90  1.3   weight 1.000    
assign (resid   81 and name HD2#) (resid   109 and name   HB) 4.506 2.71  1.49  weight 1.000    
assign (resid   81 and name HD2#) (resid   109 and name   HA) 4.725 2.93  1.27  weight 1.000    
assign (resid   81 and name HD2#) (resid   109 and name HG2#) 4.970 3.17  1.03  weight 1.000    
assign (resid   81 and name HD2#) (resid   107 and name HG2#) 4.747 3.03  1.25  weight 1.000    
assign (resid   80 and name HG2#) (resid   109 and name   HN) 4.973 3.17  1.03  weight 1.000    
assign (resid   80 and name HG2#) (resid   109 and name   HA) 4.941 3.14  1.06  weight 1.000    
assign (resid   80 and name HG2#) (resid   109 and name   HB) 4.325 2.53  1.67  weight 1.000    
assign (resid   80 and name HG2#) (resid   109 and name HG1#) 3.484 1.68  2.52  weight 1.000                                                                                                                                                                                                                                                 
assign (resid   80 and name HG2#) (resid   109 and name HG2#) 4.473 2.67  1.53  weight 1.000    
assign (resid   16 and name  HE#) (resid   107 and name   HA) 4.952 3.15  1.05  weight 1.000    
assign (resid   16 and name  HE#) (resid   109 and name   HA) 4.950 3.15  1.05  weight 1.000    
assign (resid   16 and name  HE#) (resid   108 and name  HB#) 4.802 3   1.2   weight 1.000    
assign (resid   89 and name HD1#) (resid   109 and name HG1#) 4.873 3.07  1.13  weight 1.000    
assign (resid   89 and name HD1#) (resid   109 and name HG2#) 4.977 3.18  1.02  weight 1.000    
assign (resid   80 and name HD1#) (resid   109 and name HG2#) 4.730 2.93  1.27  weight 1.000    
assign (resid   80 and name HD1#) (resid   109 and name HG1#) 4.283 2.53  1.72  weight 1.000    
assign (resid   24 and name HD1#) (resid   98  and name  HE#) 4.946 3.15  1.05  weight 1.000    
assign (resid   24 and name HD1#) (resid   98  and name  HB#) 4.981 3.18  1.02  weight 1.000    
assign (resid   24 and name HG2#) (resid   98  and name  HB#) 5.000 3.2   1     weight 1.000    
assign (resid   24 and name HG2#) (resid   98  and name  HE#) 4.942 3.14  1.06  weight 1.000    
assign (resid   39 and name  HE1) (resid   98  and name  HE#) 4.923 3.12  1.08  weight 1.000    
assign (resid   94 and name HD2#) (resid   98  and name  HE#) 4.946 3.15  1.05  weight 1.000    



!intra
assign (resid 91 and name   HB) (resid   91 and name   HN) 3.094 1.197 1.197 weight 1.000 
assign (resid 91 and name   HB) (resid   58 and name  HB2) 2.885 1.040 1.040 weight 1.000 
assign (resid 91 and name   HB) (resid   58 and name  HB1) 2.607 0.850 0.850 weight 1.000 
assign (resid 91 and name   HB) (resid   91 and name HG21) 2.158 0.582 0.582 weight 1.000 
    or (resid 91 and name   HB) (resid   91 and name HG22)
    or (resid 91 and name   HB) (resid   91 and name HG23)
assign (resid 92 and name   HB) (resid   92 and name   HN) 2.719 0.924 0.924 weight 1.000 
assign (resid 35 and name   HB) (resid   35 and name   HN) 2.604 0.848 0.848 weight 1.000 
assign (resid 20 and name   HB) (resid   42 and name  HB2) 2.682 0.899 0.899 weight 1.000 
assign (resid 20 and name   HB) (resid   42 and name  HB1) 2.665 0.888 0.888 weight 1.000 
assign (resid 92 and name   HB) (resid    5 and name  HG2) 2.818 0.993 0.993 weight 1.000 
    or (resid 92 and name   HB) (resid    5 and name  HG1)
assign (resid 35 and name   HB) (resid   26 and name   HB) 2.628 0.863 0.863 weight 1.000 
assign (resid 20 and name   HB) (resid   20 and name HG21) 2.290 0.656 0.656 weight 1.000 
    or (resid 20 and name   HB) (resid   20 and name HG22)
    or (resid 20 and name   HB) (resid   20 and name HG23)
assign (resid 92 and name   HB) (resid   92 and name HG21) 1.935 0.468 0.468 weight 1.000 
    or (resid 92 and name   HB) (resid   92 and name HG22)
    or (resid 92 and name   HB) (resid   92 and name HG23)
assign (resid 35 and name   HB) (resid   35 and name HG21) 1.946 0.473 0.473 weight 1.000 
    or (resid 35 and name   HB) (resid   35 and name HG22)
    or (resid 35 and name   HB) (resid   35 and name HG23)
assign (resid 35 and name   HB) (resid   26 and name HG12) 2.766 0.957 0.957 weight 1.000 
    or (resid 35 and name   HB) (resid   26 and name HG11)
    or (resid 35 and name   HB) (resid   26 and name HG13)
assign (resid 20 and name   HB) (resid   40 and name HG22) 3.122 1.218 1.218 weight 1.000 
    or (resid 20 and name   HB) (resid   40 and name HG21)
    or (resid 20 and name   HB) (resid   40 and name HG23)
assign (resid 81 and name   HN) (resid   77 and name   HA) 2.983 1.112 1.112 weight 1.000 
assign (resid 74 and name   HN) (resid   74 and name   HB) 2.848 1.014 1.014 weight 1.000 
assign (resid 77 and name   HN) (resid   77 and name   HA) 2.302 0.662 0.662 weight 1.000 
assign (resid 76 and name   HA) (resid   77 and name   HN) 2.774 0.962 0.962 weight 1.000 
assign (resid 76 and name   HN) (resid   76 and name   HA) 2.274 0.647 0.647 weight 1.000 
assign (resid 74 and name   HB) (resid   75 and name   HN) 2.814 0.990 0.990 weight 1.000 
assign (resid 74 and name   HB) (resid   74 and name   HA) 2.218 0.615 0.615 weight 1.000 
assign (resid 77 and name   HA) (resid   77 and name   HB) 2.314 0.669 0.669 weight 1.000 
assign (resid 74 and name   HB) (resid   77 and name   HB) 2.813 0.989 0.989 weight 1.000 
assign (resid 76 and name   HA) (resid   76 and name   HB) 2.427 0.737 0.737 weight 1.000 
assign (resid 74 and name   HB) (resid   74 and name HG21) 1.952 0.476 0.476 weight 1.000 
    or (resid 74 and name   HB) (resid   74 and name HG22)
    or (resid 74 and name   HB) (resid   74 and name HG23)
assign (resid 76 and name   HA) (resid   79 and name  HB1) 2.712 0.919 0.919 weight 1.000 
assign (resid 77 and name   HA) (resid   77 and name HG22) 2.051 0.526 0.526 weight 1.000 
    or (resid 77 and name   HA) (resid   77 and name HG21)
    or (resid 77 and name   HA) (resid   77 and name HG23)
assign (resid 76 and name   HA) (resid   76 and name HG12) 2.155 0.580 0.580 weight 1.000 
    or (resid 76 and name   HA) (resid   76 and name HG11)
    or (resid 76 and name   HA) (resid   76 and name HG13)
assign (resid 81 and name   HN) (resid   80 and name   HA) 2.864 1.026 1.026 weight 1.000 
assign (resid 74 and name   HN) (resid   74 and name   HA) 2.707 0.916 0.916 weight 1.000 
assign (resid 33 and name   HN) (resid   31 and name  HB2) 2.904 1.054 1.054 weight 1.000 
assign (resid 77 and name   HN) (resid   74 and name   HA) 2.497 0.779 0.779 weight 1.000 
assign (resid 78 and name   HN) (resid   74 and name   HA) 2.669 0.891 0.891 weight 1.000 
assign (resid 80 and name   HN) (resid   80 and name   HA) 2.408 0.725 0.725 weight 1.000 
assign (resid 75 and name   HN) (resid   74 and name   HA) 2.926 1.070 1.070 weight 1.000 
assign (resid 31 and name  HB1) (resid   31 and name  HB2) 1.974 0.487 0.487 weight 1.000 
assign (resid 48 and name   HA) (resid   48 and name  HB1) 2.310 0.667 0.667 weight 1.000 
assign (resid 48 and name   HA) (resid   48 and name  HB2) 2.331 0.679 0.679 weight 1.000 
assign (resid 48 and name   HA) (resid   51 and name  HB2) 2.144 0.575 0.575 weight 1.000 
    or (resid 48 and name   HA) (resid   51 and name  HB1)
assign (resid 74 and name   HA) (resid   77 and name   HB) 2.094 0.548 0.548 weight 1.000 
assign (resid 80 and name   HA) (resid   80 and name   HB) 2.382 0.709 0.709 weight 1.000 
assign (resid 74 and name   HA) (resid   74 and name HG21) 2.102 0.552 0.552 weight 1.000 
    or (resid 74 and name   HA) (resid   74 and name HG22)
    or (resid 74 and name   HA) (resid   74 and name HG23)
assign (resid 48 and name   HA) (resid   10 and name HG22) 2.830 1.001 1.001 weight 1.000 
    or (resid 48 and name   HA) (resid   10 and name HG21)
    or (resid 48 and name   HA) (resid   10 and name HG23)
assign (resid 31 and name  HB1) (resid   33 and name HG12) 2.788 0.972 0.972 weight 1.000 
    or (resid 31 and name  HB1) (resid   33 and name HG11)
    or (resid 31 and name  HB1) (resid   33 and name HG13)
assign (resid 74 and name   HA) (resid   77 and name HG12) 2.420 0.732 0.732 weight 1.000 
    or (resid 74 and name   HA) (resid   77 and name HG11)
    or (resid 74 and name   HA) (resid   77 and name HG13)
assign (resid 74 and name   HA) (resid   77 and name HG22) 2.334 0.681 0.681 weight 1.000 
    or (resid 74 and name   HA) (resid   77 and name HG21)
    or (resid 74 and name   HA) (resid   77 and name HG23)
assign (resid 41 and name   HN) (resid   40 and name   HA) 2.184 0.596 0.596 weight 1.000 
assign (resid 61 and name   HA) (resid   61 and name   HN) 2.828 1.000 1.000 weight 1.000 
assign (resid 40 and name   HN) (resid   40 and name   HA) 2.675 0.895 0.895 weight 1.000 
assign (resid 50 and name  HB2) (resid   50 and name   HN) 2.495 0.778 0.778 weight 1.000 
assign (resid 50 and name  HB2) (resid   51 and name   HN) 2.609 0.851 0.851 weight 1.000 
assign (resid 33 and name   HN) (resid   33 and name   HA) 2.650 0.877 0.877 weight 1.000 
assign (resid 34 and name   HN) (resid   33 and name   HA) 1.995 0.498 0.498 weight 1.000 
assign (resid 83 and name  HB2) (resid   83 and name   HN) 2.691 0.905 0.905 weight 1.000 
assign (resid 83 and name  HB1) (resid   83 and name   HN) 2.644 0.874 0.874 weight 1.000 
assign (resid 40 and name   HA) (resid   19 and name  HD1) 2.968 1.101 1.101 weight 1.000 
    or (resid 40 and name   HA) (resid   19 and name  HD2)
assign (resid 33 and name   HA) (resid   34 and name  HD1) 2.935 1.077 1.077 weight 1.000 
    or (resid 33 and name   HA) (resid   34 and name  HD2)
assign (resid 67 and name   HA) (resid   62 and name   HA) 2.787 0.971 0.971 weight 1.000 
assign (resid 43 and name   HA) (resid   19 and name  HB1) 2.817 0.992 0.992 weight 1.000 
assign (resid 90 and name  HB2) (resid   62 and name  HB2) 2.867 1.028 1.028 weight 1.000 
assign (resid 90 and name  HB1) (resid   62 and name  HB2) 2.852 1.017 1.017 weight 1.000 
assign (resid 50 and name  HB1) (resid   51 and name  HG2) 2.835 1.005 1.005 weight 1.000 
assign (resid 40 and name   HA) (resid   40 and name   HB) 2.662 0.886 0.886 weight 1.000 
assign (resid 93 and name   HA) (resid   93 and name  HB2) 2.633 0.867 0.867 weight 1.000 
assign (resid  7 and name   HA) (resid    7 and name  HB2) 2.291 0.656 0.656 weight 1.000 
assign (resid 93 and name   HA) (resid   93 and name  HB1) 2.745 0.942 0.942 weight 1.000 
assign (resid 83 and name  HB1) (resid   87 and name   HB) 2.798 0.978 0.978 weight 1.000 
assign (resid 33 and name   HA) (resid   33 and name   HB) 2.430 0.738 0.738 weight 1.000 
assign (resid  7 and name   HA) (resid    7 and name  HB1) 2.480 0.769 0.769 weight 1.000 
assign (resid 60 and name   HA) (resid   92 and name HG21) 2.826 0.998 0.998 weight 1.000 
    or (resid 60 and name   HA) (resid   92 and name HG22)
    or (resid 60 and name   HA) (resid   92 and name HG23)
assign (resid 60 and name   HA) (resid   91 and name HG21) 2.390 0.714 0.714 weight 1.000 
    or (resid 60 and name   HA) (resid   91 and name HG22)
    or (resid 60 and name   HA) (resid   91 and name HG23)
assign (resid 33 and name   HA) (resid   33 and name HG22) 1.960 0.480 0.480 weight 1.000 
    or (resid 33 and name   HA) (resid   33 and name HG21)
    or (resid 33 and name   HA) (resid   33 and name HG23)
assign (resid 63 and name   HA) (resid   63 and name HG22) 2.060 0.530 0.530 weight 1.000 
    or (resid 63 and name   HA) (resid   63 and name HG21)
    or (resid 63 and name   HA) (resid   63 and name HG23)
assign (resid 64 and name   HN) (resid   63 and name   HA) 2.423 0.734 0.734 weight 1.000 
assign (resid 92 and name   HN) (resid   91 and name   HA) 2.210 0.611 0.611 weight 1.000 
assign (resid 61 and name   HN) (resid   60 and name   HA) 2.254 0.635 0.635 weight 1.000 
assign (resid 27 and name   HN) (resid   26 and name   HA) 2.250 0.633 0.633 weight 1.000 
assign (resid  8 and name   HN) (resid    8 and name   HA) 2.609 0.851 0.851 weight 1.000 
assign (resid 81 and name   HN) (resid   78 and name   HA) 2.532 0.801 0.801 weight 1.000 
assign (resid 35 and name   HN) (resid   35 and name   HA) 2.643 0.873 0.873 weight 1.000 
assign (resid 11 and name   HN) (resid   10 and name   HA) 2.085 0.543 0.543 weight 1.000 
assign (resid  9 and name   HN) (resid    8 and name   HA) 1.883 0.443 0.443 weight 1.000 
assign (resid 51 and name   HA) (resid   51 and name   HN) 2.213 0.612 0.612 weight 1.000 
assign (resid 52 and name   HN) (resid   51 and name   HA) 2.592 0.840 0.840 weight 1.000 
assign (resid 60 and name   HA) (resid   62 and name   HN) 2.916 1.063 1.063 weight 1.000 
assign (resid 78 and name   HN) (resid   78 and name   HA) 2.170 0.589 0.589 weight 1.000 
assign (resid 83 and name   HA) (resid   83 and name   HN) 2.545 0.810 0.810 weight 1.000 
assign (resid 17 and name   HA) (resid   17 and name  HD1) 2.478 0.768 0.768 weight 1.000 
    or (resid 17 and name   HA) (resid   17 and name  HD2)
assign (resid 35 and name   HA) (resid   34 and name  HD1) 2.791 0.974 0.974 weight 1.000 
    or (resid 35 and name   HA) (resid   34 and name  HD2)
assign (resid 60 and name   HA) (resid   91 and name   HA) 2.693 0.906 0.906 weight 1.000 
assign (resid 91 and name   HB) (resid   91 and name   HA) 2.508 0.786 0.786 weight 1.000 
assign (resid 17 and name   HA) (resid   17 and name  HB2) 2.695 0.908 0.908 weight 1.000 
assign (resid 10 and name   HA) (resid   11 and name  HB2) 3.063 1.173 1.173 weight 1.000 
assign (resid 17 and name   HA) (resid   17 and name  HB1) 2.730 0.932 0.932 weight 1.000 
assign (resid 72 and name   HA) (resid   72 and name   HB) 2.872 1.031 1.031 weight 1.000 
assign (resid  6 and name   HA) (resid    6 and name  HB2) 2.485 0.772 0.772 weight 1.000 
assign (resid 17 and name   HA) (resid   48 and name  HB2) 2.674 0.894 0.894 weight 1.000 
assign (resid 78 and name   HA) (resid   78 and name  HG2) 2.341 0.685 0.685 weight 1.000 
assign (resid 68 and name   HA) (resid   68 and name   HB) 2.264 0.641 0.641 weight 1.000 
assign (resid  6 and name   HA) (resid    6 and name  HB1) 2.535 0.803 0.803 weight 1.000 
assign (resid  8 and name   HA) (resid    8 and name   HB) 2.310 0.667 0.667 weight 1.000 
assign (resid 78 and name   HA) (resid   81 and name  HB2) 2.127 0.566 0.566 weight 1.000 
assign (resid 68 and name   HA) (resid   71 and name  HB2) 2.851 1.016 1.016 weight 1.000 
assign (resid 26 and name   HA) (resid   26 and name   HB) 2.680 0.898 0.898 weight 1.000 
assign (resid 60 and name   HA) (resid   60 and name   HB) 2.420 0.732 0.732 weight 1.000 
assign (resid 68 and name   HA) (resid   71 and name   HG) 2.414 0.729 0.729 weight 1.000 
assign (resid 10 and name   HA) (resid   10 and name HG11) 2.212 0.612 0.612 weight 1.000 
assign (resid  8 and name   HA) (resid    8 and name HG12) 2.316 0.670 0.670 weight 1.000 
assign (resid 20 and name   HA) (resid   20 and name HG21) 2.518 0.793 0.793 weight 1.000 
    or (resid 20 and name   HA) (resid   20 and name HG22)
    or (resid 20 and name   HA) (resid   20 and name HG23)
assign (resid 87 and name   HA) (resid   88 and name  HB2) 2.904 1.054 1.054 weight 1.000 
    or (resid 87 and name   HA) (resid   88 and name  HB1)
    or (resid 87 and name   HA) (resid   88 and name  HB3)
assign (resid 91 and name   HA) (resid   61 and name HG21) 2.520 0.794 0.794 weight 1.000 
    or (resid 91 and name   HA) (resid   61 and name HG22)
    or (resid 91 and name   HA) (resid   61 and name HG23)
assign (resid 91 and name   HA) (resid   91 and name HG21) 2.232 0.623 0.623 weight 1.000 
    or (resid 91 and name   HA) (resid   91 and name HG22)
    or (resid 91 and name   HA) (resid   91 and name HG23)
assign (resid 72 and name   HA) (resid   72 and name HG12) 2.526 0.797 0.797 weight 1.000 
    or (resid 72 and name   HA) (resid   72 and name HG11)
    or (resid 72 and name   HA) (resid   72 and name HG13)
assign (resid 35 and name   HA) (resid   35 and name HG21) 2.186 0.597 0.597 weight 1.000 
    or (resid 35 and name   HA) (resid   35 and name HG22)
    or (resid 35 and name   HA) (resid   35 and name HG23)
assign (resid 10 and name   HA) (resid   10 and name HG22) 2.263 0.640 0.640 weight 1.000 
    or (resid 10 and name   HA) (resid   10 and name HG21)
    or (resid 10 and name   HA) (resid   10 and name HG23)
assign (resid 87 and name   HA) (resid   87 and name HG22) 2.322 0.674 0.674 weight 1.000 
    or (resid 87 and name   HA) (resid   87 and name HG21)
    or (resid 87 and name   HA) (resid   87 and name HG23)
assign (resid 68 and name   HA) (resid   68 and name HG22) 2.042 0.521 0.521 weight 1.000 
    or (resid 68 and name   HA) (resid   68 and name HG21)
    or (resid 68 and name   HA) (resid   68 and name HG23)
    or (resid 68 and name   HA) (resid   68 and name HG12)
    or (resid 68 and name   HA) (resid   68 and name HG11)
    or (resid 68 and name   HA) (resid   68 and name HG13)
assign (resid  8 and name   HA) (resid    8 and name HD12) 2.036 0.518 0.518 weight 1.000 
    or (resid  8 and name   HA) (resid    8 and name HD11)
    or (resid  8 and name   HA) (resid    8 and name HD13)
assign (resid 26 and name   HA) (resid   26 and name HG22) 2.154 0.580 0.580 weight 1.000 
    or (resid 26 and name   HA) (resid   26 and name HG21)
    or (resid 26 and name   HA) (resid   26 and name HG23)
assign (resid 87 and name   HA) (resid   87 and name HG12) 2.909 1.058 1.058 weight 1.000 
    or (resid 87 and name   HA) (resid   87 and name HG11)
    or (resid 87 and name   HA) (resid   87 and name HG13)
assign (resid 68 and name   HA) (resid   76 and name HG12) 2.831 1.002 1.002 weight 1.000 
    or (resid 68 and name   HA) (resid   76 and name HG11)
    or (resid 68 and name   HA) (resid   76 and name HG13)
assign (resid 20 and name   HN) (resid   19 and name   HA) 2.302 0.662 0.662 weight 1.000 
assign (resid 57 and name   HN) (resid   56 and name   HA) 2.043 0.521 0.521 weight 1.000 
assign (resid 81 and name   HN) (resid   81 and name   HA) 2.316 0.671 0.671 weight 1.000 
assign (resid 12 and name   HN) (resid   12 and name   HA) 2.680 0.898 0.898 weight 1.000 
assign (resid 56 and name   HN) (resid   56 and name   HA) 2.546 0.810 0.810 weight 1.000 
assign (resid 82 and name   HN) (resid   81 and name   HA) 2.741 0.939 0.939 weight 1.000 
assign (resid 82 and name   HN) (resid   82 and name   HA) 2.259 0.638 0.638 weight 1.000 
assign (resid 68 and name   HN) (resid   62 and name   HA) 2.737 0.936 0.936 weight 1.000 
assign (resid 53 and name   HN) (resid   51 and name   HA) 2.854 1.018 1.018 weight 1.000 
assign (resid 76 and name   HN) (resid   75 and name   HA) 2.610 0.852 0.852 weight 1.000 
assign (resid 79 and name   HN) (resid   79 and name   HA) 2.311 0.667 0.667 weight 1.000 
assign (resid 82 and name   HA) (resid   83 and name   HN) 2.828 1.000 1.000 weight 1.000 
assign (resid 58 and name   HN) (resid   56 and name   HA) 3.037 1.153 1.153 weight 1.000 
assign (resid 75 and name   HN) (resid   75 and name   HA) 2.456 0.754 0.754 weight 1.000 
assign (resid 12 and name   HA) (resid   17 and name  HD1) 2.916 1.063 1.063 weight 1.000 
    or (resid 12 and name   HA) (resid   17 and name  HD2)
assign (resid 19 and name   HA) (resid   19 and name  HD1) 2.846 1.013 1.013 weight 1.000 
    or (resid 19 and name   HA) (resid   19 and name  HD2)
assign (resid 43 and name   HA) (resid   19 and name   HA) 2.669 0.891 0.891 weight 1.000 
assign (resid 31 and name   HA) (resid   31 and name  HB2) 2.693 0.906 0.906 weight 1.000 
assign (resid 19 and name   HA) (resid   19 and name  HB2) 2.493 0.777 0.777 weight 1.000 
assign (resid 69 and name   HA) (resid   69 and name  HB2) 2.534 0.802 0.802 weight 1.000 
assign (resid 19 and name   HA) (resid   19 and name  HB1) 2.468 0.762 0.762 weight 1.000 
assign (resid 62 and name   HA) (resid   62 and name  HB2) 2.938 1.079 1.079 weight 1.000 
assign (resid 42 and name   HA) (resid   42 and name  HB2) 2.779 0.965 0.965 weight 1.000 
assign (resid 42 and name   HA) (resid   42 and name  HB1) 2.917 1.063 1.063 weight 1.000 
assign (resid 45 and name   HA) (resid   45 and name  HB2) 2.057 0.529 0.529 weight 1.000 
    or (resid 45 and name   HA) (resid   45 and name  HB1)
assign (resid 62 and name   HA) (resid   62 and name  HB1) 2.657 0.882 0.882 weight 1.000 
assign (resid 75 and name   HA) (resid   75 and name  HB2) 2.385 0.711 0.711 weight 1.000 
assign (resid 44 and name   HA) (resid   44 and name  HG2) 2.471 0.764 0.764 weight 1.000 
assign (resid 42 and name   HA) (resid   56 and name  HG1) 2.681 0.898 0.898 weight 1.000 
assign (resid 75 and name   HA) (resid   75 and name  HG2) 1.954 0.477 0.477 weight 1.000 
    or (resid 75 and name   HA) (resid   75 and name  HG1)
assign (resid 41 and name   HA) (resid   56 and name  HB2) 2.758 0.951 0.951 weight 1.000 
assign (resid 82 and name   HA) (resid   82 and name  HB2) 1.925 0.463 0.463 weight 1.000 
    or (resid 82 and name   HA) (resid   82 and name  HB1)
assign (resid 15 and name   HA) (resid   15 and name  HB1) 2.153 0.580 0.580 weight 1.000 
assign (resid 44 and name   HA) (resid   44 and name  HB2) 2.425 0.735 0.735 weight 1.000 
assign (resid 24 and name   HA) (resid   24 and name   HB) 2.868 1.028 1.028 weight 1.000 
assign (resid 42 and name   HA) (resid   56 and name  HB1) 2.812 0.988 0.988 weight 1.000 
assign (resid 56 and name   HA) (resid   56 and name  HB1) 2.321 0.673 0.673 weight 1.000 
assign (resid 81 and name   HA) (resid   81 and name  HB1) 2.169 0.588 0.588 weight 1.000 
assign (resid 75 and name   HA) (resid   72 and name HG22) 2.713 0.920 0.920 weight 1.000 
    or (resid 75 and name   HA) (resid   72 and name HG21)
    or (resid 75 and name   HA) (resid   72 and name HG23)
assign (resid 81 and name   HA) (resid   81 and name HD22) 1.933 0.467 0.467 weight 1.000 
    or (resid 81 and name   HA) (resid   81 and name HD21)
    or (resid 81 and name   HA) (resid   81 and name HD23)
assign (resid 62 and name   HA) (resid   68 and name HG22) 2.234 0.624 0.624 weight 1.000 
    or (resid 62 and name   HA) (resid   68 and name HG21)
    or (resid 62 and name   HA) (resid   68 and name HG23)
    or (resid 62 and name   HA) (resid   68 and name HG12)
    or (resid 62 and name   HA) (resid   68 and name HG11)
    or (resid 62 and name   HA) (resid   68 and name HG13)
assign (resid 56 and name   HA) (resid   40 and name HG22) 2.135 0.570 0.570 weight 1.000 
    or (resid 56 and name   HA) (resid   40 and name HG21)
    or (resid 56 and name   HA) (resid   40 and name HG23)
assign (resid 64 and name   HN) (resid   64 and name   HA) 2.465 0.759 0.759 weight 1.000 
assign (resid 40 and name   HN) (resid   39 and name   HA) 2.263 0.640 0.640 weight 1.000 
assign (resid 72 and name   HN) (resid   71 and name   HA) 2.682 0.899 0.899 weight 1.000 
assign (resid 63 and name   HN) (resid   62 and name   HA) 2.186 0.597 0.597 weight 1.000 
assign (resid 87 and name   HN) (resid   86 and name   HA) 2.078 0.540 0.540 weight 1.000 
assign (resid 95 and name   HA) (resid   95 and name   HN) 2.919 1.065 1.065 weight 1.000 
assign (resid 55 and name   HN) (resid   54 and name   HA) 2.002 0.501 0.501 weight 1.000 
assign (resid 49 and name   HA) (resid   51 and name   HN) 2.869 1.029 1.029 weight 1.000 
assign (resid 96 and name   HA) (resid   96 and name   HN) 2.649 0.877 0.877 weight 1.000 
assign (resid 44 and name   HN) (resid   44 and name   HA) 2.688 0.903 0.903 weight 1.000 
assign (resid 52 and name   HN) (resid   49 and name   HA) 2.611 0.852 0.852 weight 1.000 
assign (resid 86 and name   HA) (resid   17 and name  HE1) 2.624 0.861 0.861 weight 1.000 
    or (resid 86 and name   HA) (resid   17 and name  HE2)
assign (resid 11 and name   HA) (resid   86 and name   HA) 2.793 0.975 0.975 weight 1.000 
assign (resid  5 and name   HA) (resid    6 and name  HD2) 2.528 0.799 0.799 weight 1.000 
assign (resid  5 and name   HA) (resid    6 and name  HD1) 2.511 0.788 0.788 weight 1.000 
assign (resid 11 and name   HA) (resid   11 and name  HB2) 2.510 0.787 0.787 weight 1.000 
assign (resid 55 and name   HA) (resid   55 and name  HD2) 2.347 0.688 0.688 weight 1.000 
    or (resid 55 and name   HA) (resid   55 and name  HD1)
assign (resid 85 and name   HA) (resid   85 and name  HB2) 2.374 0.704 0.704 weight 1.000 
    or (resid 85 and name   HA) (resid   85 and name  HB1)
assign (resid 96 and name   HA) (resid   96 and name  HB2) 2.223 0.618 0.618 weight 1.000 
assign (resid 39 and name   HA) (resid   39 and name  HG2) 2.449 0.750 0.750 weight 1.000 
    or (resid 39 and name   HA) (resid   39 and name  HG1)
assign (resid 58 and name   HA) (resid   58 and name  HB1) 2.900 1.051 1.051 weight 1.000 
assign (resid 28 and name   HA) (resid   28 and name  HG1) 2.805 0.984 0.984 weight 1.000 
assign (resid 34 and name   HA) (resid   34 and name  HB2) 2.697 0.909 0.909 weight 1.000 
assign (resid 95 and name   HA) (resid   95 and name  HG2) 2.299 0.660 0.660 weight 1.000 
    or (resid 95 and name   HA) (resid   95 and name  HG1)
assign (resid 21 and name   HA) (resid   21 and name  HB2) 2.423 0.734 0.734 weight 1.000 
assign (resid 39 and name   HA) (resid   39 and name  HB1) 2.480 0.769 0.769 weight 1.000 
assign (resid 86 and name   HA) (resid   86 and name  HB2) 2.279 0.649 0.649 weight 1.000 
assign (resid 11 and name   HA) (resid   86 and name  HB2) 2.608 0.850 0.850 weight 1.000 
assign (resid 55 and name   HA) (resid   55 and name  HB2) 2.108 0.555 0.555 weight 1.000 
    or (resid 55 and name   HA) (resid   55 and name  HB1)
assign (resid 71 and name   HA) (resid   71 and name  HB1) 2.555 0.816 0.816 weight 1.000 
assign (resid 94 and name   HA) (resid   94 and name  HB2) 2.113 0.558 0.558 weight 1.000 
assign (resid 49 and name   HA) (resid   49 and name  HB2) 2.062 0.531 0.531 weight 1.000 
    or (resid 49 and name   HA) (resid   49 and name  HB1)
    or (resid 49 and name   HA) (resid   49 and name  HB3)
assign (resid 86 and name   HA) (resid   86 and name  HB1) 2.263 0.640 0.640 weight 1.000 
assign (resid 22 and name   HA) (resid   22 and name  HB1) 2.352 0.691 0.691 weight 1.000 
assign (resid 11 and name   HA) (resid   86 and name  HB1) 2.766 0.956 0.956 weight 1.000 
assign (resid 85 and name   HA) (resid   12 and name  HB2) 2.842 1.010 1.010 weight 1.000 
assign (resid 64 and name   HA) (resid   88 and name  HB2) 2.294 0.658 0.658 weight 1.000 
    or (resid 64 and name   HA) (resid   88 and name  HB1)
    or (resid 64 and name   HA) (resid   88 and name  HB3)
assign (resid 86 and name   HA) (resid   86 and name  HG1) 2.717 0.923 0.923 weight 1.000 
assign (resid 54 and name   HA) (resid   91 and name HG21) 2.379 0.707 0.707 weight 1.000 
    or (resid 54 and name   HA) (resid   91 and name HG22)
    or (resid 54 and name   HA) (resid   91 and name HG23)
assign (resid 49 and name   HA) (resid   10 and name HG22) 2.221 0.617 0.617 weight 1.000 
    or (resid 49 and name   HA) (resid   10 and name HG21)
    or (resid 49 and name   HA) (resid   10 and name HG23)
assign (resid 21 and name   HA) (resid   21 and name HD12) 2.312 0.668 0.668 weight 1.000 
    or (resid 21 and name   HA) (resid   21 and name HD11)
    or (resid 21 and name   HA) (resid   21 and name HD13)
assign (resid 59 and name   HA) (resid   59 and name HD22) 2.481 0.769 0.769 weight 1.000 
    or (resid 59 and name   HA) (resid   59 and name HD21)
    or (resid 59 and name   HA) (resid   59 and name HD23)
    or (resid 59 and name   HA) (resid   59 and name HD12)
    or (resid 59 and name   HA) (resid   59 and name HD11)
    or (resid 59 and name   HA) (resid   59 and name HD13)
assign (resid 94 and name   HA) (resid   59 and name HD22) 2.436 0.742 0.742 weight 1.000 
    or (resid 94 and name   HA) (resid   59 and name HD21)
    or (resid 94 and name   HA) (resid   59 and name HD23)
    or (resid 94 and name   HA) (resid   59 and name HD12)
    or (resid 94 and name   HA) (resid   59 and name HD11)
    or (resid 94 and name   HA) (resid   59 and name HD13)
assign (resid 94 and name   HA) (resid   94 and name HD22) 2.066 0.534 0.534 weight 1.000 
    or (resid 94 and name   HA) (resid   94 and name HD21)
    or (resid 94 and name   HA) (resid   94 and name HD23)
    or (resid 94 and name   HA) (resid   94 and name HD12)
    or (resid 94 and name   HA) (resid   94 and name HD11)
    or (resid 94 and name   HA) (resid   94 and name HD13)
assign (resid 55 and name   HA) (resid   43 and name HG22) 2.487 0.773 0.773 weight 1.000 
    or (resid 55 and name   HA) (resid   43 and name HG21)
    or (resid 55 and name   HA) (resid   43 and name HG23)
assign (resid 54 and name   HA) (resid   54 and name HD22) 2.056 0.528 0.528 weight 1.000 
    or (resid 54 and name   HA) (resid   54 and name HD21)
    or (resid 54 and name   HA) (resid   54 and name HD23)
assign (resid 49 and name   HA) (resid   10 and name HG12) 2.131 0.568 0.568 weight 1.000 
assign (resid 86 and name   HA) (resid   87 and name HG12) 2.776 0.963 0.963 weight 1.000 
    or (resid 86 and name   HA) (resid   87 and name HG11)
    or (resid 86 and name   HA) (resid   87 and name HG13)
assign (resid 49 and name   HA) (resid   54 and name HD12) 2.895 1.048 1.048 weight 1.000 
    or (resid 49 and name   HA) (resid   54 and name HD11)
    or (resid 49 and name   HA) (resid   54 and name HD13)
assign (resid 54 and name   HA) (resid   54 and name HD12) 2.784 0.969 0.969 weight 1.000 
    or (resid 54 and name   HA) (resid   54 and name HD11)
    or (resid 54 and name   HA) (resid   54 and name HD13)
assign (resid 52 and name   HA) (resid   53 and name   HN) 2.756 0.950 0.950 weight 1.000 
assign (resid 66 and name   HA) (resid   67 and name  HD2) 2.818 0.993 0.993 weight 1.000 
assign (resid 59 and name   HA) (resid   58 and name  HB2) 3.031 1.149 1.149 weight 1.000 
assign (resid 66 and name   HA) (resid   66 and name  HB2) 2.461 0.757 0.757 weight 1.000 
    or (resid 66 and name   HA) (resid   66 and name  HB1)
assign (resid 52 and name   HA) (resid   51 and name  HB2) 2.917 1.063 1.063 weight 1.000 
    or (resid 52 and name   HA) (resid   51 and name  HB1)
assign (resid 67 and name  HD1) (resid   67 and name  HG2) 2.269 0.644 0.644 weight 1.000 
assign (resid 67 and name  HD2) (resid   67 and name  HG1) 2.238 0.626 0.626 weight 1.000 
assign (resid 93 and name  HD2) (resid   93 and name  HB2) 2.843 1.011 1.011 weight 1.000 
assign (resid 93 and name  HD2) (resid   93 and name  HG2) 2.229 0.621 0.621 weight 1.000 
    or (resid 93 and name  HD2) (resid   93 and name  HG1)
assign (resid 59 and name   HA) (resid   94 and name  HB2) 2.797 0.978 0.978 weight 1.000 
assign (resid 52 and name   HA) (resid   52 and name  HB2) 1.925 0.463 0.463 weight 1.000 
    or (resid 52 and name   HA) (resid   52 and name  HB1)
    or (resid 52 and name   HA) (resid   52 and name  HB3)
assign (resid 13 and name   HA) (resid   13 and name  HB2) 2.169 0.588 0.588 weight 1.000 
    or (resid 13 and name   HA) (resid   13 and name  HB1)
    or (resid 13 and name   HA) (resid   13 and name  HB3)
assign (resid 52 and name   HA) (resid    8 and name HG22) 2.660 0.884 0.884 weight 1.000 
    or (resid 52 and name   HA) (resid    8 and name HG21)
    or (resid 52 and name   HA) (resid    8 and name HG23)
assign (resid 89 and name   HN) (resid   88 and name   HA) 2.190 0.599 0.599 weight 1.000 
assign (resid  6 and name  HD1) (resid    6 and name  HD2) 1.920 0.461 0.461 weight 1.000 
assign (resid 48 and name  HD1) (resid   48 and name  HB2) 2.546 0.810 0.810 weight 1.000 
assign (resid 48 and name  HD1) (resid   48 and name  HG1) 2.712 0.920 0.920 weight 1.000 
assign (resid  6 and name  HD2) (resid    6 and name  HG1) 2.256 0.636 0.636 weight 1.000 
assign (resid  7 and name  HD2) (resid    7 and name  HB1) 2.799 0.979 0.979 weight 1.000 
    or (resid  7 and name  HD1) (resid    7 and name  HB1)
assign (resid 48 and name  HD2) (resid   13 and name  HB2) 2.994 1.120 1.120 weight 1.000 
    or (resid 48 and name  HD2) (resid   13 and name  HB1)
    or (resid 48 and name  HD2) (resid   13 and name  HB3)
assign (resid 48 and name  HD1) (resid   13 and name  HB2) 3.013 1.135 1.135 weight 1.000 
    or (resid 48 and name  HD1) (resid   13 and name  HB1)
    or (resid 48 and name  HD1) (resid   13 and name  HB3)
assign (resid 88 and name   HA) (resid   88 and name  HB2) 2.148 0.577 0.577 weight 1.000 
    or (resid 88 and name   HA) (resid   88 and name  HB1)
    or (resid 88 and name   HA) (resid   88 and name  HB3)
assign (resid 88 and name   HA) (resid    9 and name HD12) 2.526 0.797 0.797 weight 1.000 
    or (resid 88 and name   HA) (resid    9 and name HD11)
    or (resid 88 and name   HA) (resid    9 and name HD13)
assign (resid 18 and name  HA2) (resid   18 and name   HN) 2.859 1.021 1.021 weight 1.000 
assign (resid 21 and name  HB2) (resid   19 and name  HE1) 2.974 1.106 1.106 weight 1.000 
    or (resid 21 and name  HB2) (resid   19 and name  HE2)
assign (resid 21 and name  HB1) (resid   19 and name  HE1) 2.865 1.026 1.026 weight 1.000 
    or (resid 21 and name  HB1) (resid   19 and name  HE2)
assign (resid 21 and name   HA) (resid   21 and name  HB1) 2.921 1.067 1.067 weight 1.000 
assign (resid 46 and name  HA1) (resid   46 and name  HA2) 2.313 0.669 0.669 weight 1.000 
assign (resid 65 and name  HA2) (resid   62 and name  HB1) 2.904 1.054 1.054 weight 1.000 
assign (resid 57 and name  HA2) (resid   57 and name   HN) 2.460 0.757 0.757 weight 1.000 
assign (resid 57 and name   HN) (resid   57 and name  HA1) 2.373 0.704 0.704 weight 1.000 
assign (resid 54 and name  HB2) (resid   55 and name   HN) 3.018 1.139 1.139 weight 1.000 
assign (resid 54 and name  HB1) (resid   55 and name   HN) 3.129 1.224 1.224 weight 1.000 
assign (resid 47 and name   HN) (resid   47 and name  HA2) 2.980 1.110 1.110 weight 1.000 
assign (resid 54 and name   HN) (resid   53 and name  HA2) 2.564 0.822 0.822 weight 1.000 
assign (resid 54 and name   HN) (resid   53 and name  HA1) 2.489 0.775 0.775 weight 1.000 
assign (resid 54 and name   HN) (resid   54 and name  HB1) 2.344 0.687 0.687 weight 1.000 
assign (resid 53 and name   HN) (resid   53 and name  HA2) 2.317 0.671 0.671 weight 1.000 
assign (resid 53 and name   HN) (resid   53 and name  HA1) 2.208 0.610 0.610 weight 1.000 
assign (resid 84 and name  HA1) (resid   84 and name  HA2) 2.594 0.841 0.841 weight 1.000 
assign (resid 54 and name  HB2) (resid   54 and name   HA) 2.717 0.922 0.922 weight 1.000 
assign (resid 54 and name  HB1) (resid   54 and name   HA) 2.665 0.888 0.888 weight 1.000 
assign (resid 53 and name  HA1) (resid   53 and name  HA2) 2.078 0.540 0.540 weight 1.000 
assign (resid 57 and name  HA1) (resid   57 and name  HA2) 2.195 0.602 0.602 weight 1.000 
assign (resid 65 and name  HA1) (resid   65 and name  HA2) 2.271 0.645 0.645 weight 1.000 
assign (resid 57 and name  HA2) (resid   39 and name  HG2) 2.885 1.040 1.040 weight 1.000 
    or (resid 57 and name  HA2) (resid   39 and name  HG1)
assign (resid 57 and name  HA1) (resid   39 and name  HG2) 2.840 1.008 1.008 weight 1.000 
    or (resid 57 and name  HA1) (resid   39 and name  HG1)
assign (resid 57 and name  HA1) (resid   39 and name  HE2) 2.654 0.881 0.881 weight 1.000 
    or (resid 57 and name  HA1) (resid   39 and name  HE1)
    or (resid 57 and name  HA1) (resid   39 and name  HE3)
assign (resid 12 and name  HD1) (resid   12 and name  HD2) 1.914 0.458 0.458 weight 1.000 
assign (resid  5 and name  HD2) (resid    4 and name  HG1) 1.879 0.441 0.441 weight 1.000 
    or (resid  5 and name  HD1) (resid    4 and name  HG1)
assign (resid 25 and name  HD1) (resid   25 and name  HD2) 2.324 0.675 0.675 weight 1.000 
assign (resid 12 and name  HD2) (resid   12 and name  HB2) 2.421 0.733 0.733 weight 1.000 
assign (resid 12 and name  HD1) (resid   12 and name  HB1) 2.461 0.757 0.757 weight 1.000 
assign (resid 25 and name  HD2) (resid   25 and name  HG2) 2.763 0.954 0.954 weight 1.000 
    or (resid 25 and name  HD2) (resid   25 and name  HG1)
assign (resid 25 and name  HD1) (resid   25 and name  HG2) 2.690 0.905 0.905 weight 1.000 
    or (resid 25 and name  HD1) (resid   25 and name  HG1)
assign (resid 12 and name  HD2) (resid   12 and name  HG2) 2.558 0.818 0.818 weight 1.000 
assign (resid 12 and name  HD1) (resid   12 and name  HG2) 2.576 0.830 0.830 weight 1.000 
assign (resid 53 and name  HA2) (resid    8 and name HD12) 2.827 0.999 0.999 weight 1.000 
    or (resid 53 and name  HA2) (resid    8 and name HD11)
    or (resid 53 and name  HA2) (resid    8 and name HD13)
assign (resid 53 and name  HA1) (resid    8 and name HD12) 2.816 0.991 0.991 weight 1.000 
    or (resid 53 and name  HA1) (resid    8 and name HD11)
    or (resid 53 and name  HA1) (resid    8 and name HD13)
assign (resid 12 and name  HD2) (resid   12 and name  HG1) 2.515 0.790 0.790 weight 1.000 
assign (resid 12 and name  HD1) (resid   12 and name  HG1) 2.558 0.818 0.818 weight 1.000 
assign (resid 25 and name  HD2) (resid   25 and name  HB1) 2.684 0.901 0.901 weight 1.000 
assign (resid 54 and name  HB1) (resid   54 and name  HB2) 1.962 0.481 0.481 weight 1.000 
assign (resid 54 and name  HB2) (resid   54 and name HD12) 2.314 0.669 0.669 weight 1.000 
    or (resid 54 and name  HB2) (resid   54 and name HD11)
    or (resid 54 and name  HB2) (resid   54 and name HD13)
assign (resid 54 and name  HB1) (resid   54 and name HD12) 2.369 0.702 0.702 weight 1.000 
    or (resid 54 and name  HB1) (resid   54 and name HD11)
    or (resid 54 and name  HB1) (resid   54 and name HD13)
assign (resid 19 and name  HB2) (resid   20 and name   HN) 2.814 0.990 0.990 weight 1.000 
assign (resid 72 and name   HN) (resid   71 and name  HB1) 2.783 0.968 0.968 weight 1.000 
assign (resid 81 and name   HN) (resid   81 and name  HB2) 2.326 0.676 0.676 weight 1.000 
assign (resid 94 and name   HN) (resid   94 and name  HB2) 2.542 0.808 0.808 weight 1.000 
assign (resid 81 and name  HB2) (resid   82 and name   HN) 2.695 0.908 0.908 weight 1.000 
assign (resid 81 and name  HB1) (resid   82 and name   HN) 2.854 1.018 1.018 weight 1.000 
assign (resid 71 and name   HN) (resid   71 and name  HB1) 2.847 1.013 1.013 weight 1.000 
assign (resid 79 and name  HB2) (resid   80 and name   HN) 2.647 0.876 0.876 weight 1.000 
assign (resid 58 and name   HN) (resid   58 and name  HB2) 2.593 0.841 0.841 weight 1.000 
assign (resid 58 and name  HB1) (resid   58 and name   HN) 2.800 0.980 0.980 weight 1.000 
assign (resid 79 and name   HN) (resid   79 and name  HB1) 2.487 0.773 0.773 weight 1.000 
assign (resid 19 and name  HB1) (resid   19 and name  HD1) 2.582 0.833 0.833 weight 1.000 
    or (resid 19 and name  HB1) (resid   19 and name  HD2)
assign (resid 19 and name  HB2) (resid   19 and name  HD1) 2.539 0.806 0.806 weight 1.000 
    or (resid 19 and name  HB2) (resid   19 and name  HD2)
assign (resid 34 and name  HB1) (resid   34 and name  HD1) 2.645 0.874 0.874 weight 1.000 
    or (resid 34 and name  HB1) (resid   34 and name  HD2)
assign (resid 34 and name  HB2) (resid   34 and name  HD1) 2.594 0.841 0.841 weight 1.000 
    or (resid 34 and name  HB2) (resid   34 and name  HD2)
assign (resid 81 and name   HA) (resid   81 and name  HB2) 2.850 1.015 1.015 weight 1.000 
assign (resid 79 and name   HA) (resid   79 and name  HB2) 2.573 0.827 0.827 weight 1.000 
assign (resid 79 and name  HB1) (resid   79 and name   HA) 2.477 0.767 0.767 weight 1.000 
assign (resid 81 and name  HB1) (resid   78 and name   HA) 2.831 1.002 1.002 weight 1.000 
assign (resid 19 and name  HB1) (resid   19 and name  HB2) 2.476 0.766 0.766 weight 1.000 
assign (resid 79 and name  HB2) (resid   76 and name   HA) 2.794 0.976 0.976 weight 1.000 
assign (resid 58 and name  HB1) (resid   58 and name  HB2) 2.129 0.567 0.567 weight 1.000 
assign (resid 71 and name  HB1) (resid   75 and name  HG2) 2.753 0.948 0.948 weight 1.000 
    or (resid 71 and name  HB1) (resid   75 and name  HG1)
assign (resid 16 and name  HE2) (resid   16 and name  HB2) 2.825 0.998 0.998 weight 1.000 
    or (resid 16 and name  HE1) (resid   16 and name  HB2)
assign (resid 82 and name  HE2) (resid   82 and name  HB2) 2.316 0.671 0.671 weight 1.000 
    or (resid 82 and name  HE2) (resid   82 and name  HB1)
    or (resid 82 and name  HE1) (resid   82 and name  HB2)
    or (resid 82 and name  HE1) (resid   82 and name  HB1)
assign (resid 71 and name  HB1) (resid   75 and name  HB1) 2.487 0.773 0.773 weight 1.000 
assign (resid 79 and name  HB1) (resid   79 and name  HB2) 1.862 0.433 0.433 weight 1.000 
assign (resid 79 and name  HB1) (resid   63 and name   HB) 2.579 0.831 0.831 weight 1.000 
assign (resid 86 and name  HE2) (resid   86 and name  HD2) 1.946 0.473 0.473 weight 1.000 
    or (resid 86 and name  HE2) (resid   86 and name  HD1)
    or (resid 86 and name  HE1) (resid   86 and name  HD2)
    or (resid 86 and name  HE1) (resid   86 and name  HD1)
assign (resid 94 and name  HB2) (resid   94 and name  HB1) 1.562 0.305 0.305 weight 1.000 
assign (resid 81 and name  HB2) (resid   81 and name  HB1) 1.861 0.433 0.433 weight 1.000 
assign (resid 16 and name  HE2) (resid   16 and name  HG2) 2.329 0.678 0.678 weight 1.000 
    or (resid 16 and name  HE2) (resid   16 and name  HG1)
    or (resid 16 and name  HE1) (resid   16 and name  HG2)
    or (resid 16 and name  HE1) (resid   16 and name  HG1)
assign (resid 86 and name  HE2) (resid   86 and name  HG2) 2.187 0.598 0.598 weight 1.000 
    or (resid 86 and name  HE1) (resid   86 and name  HG2)
assign (resid 58 and name  HB1) (resid   91 and name HG21) 2.859 1.021 1.021 weight 1.000 
    or (resid 58 and name  HB1) (resid   91 and name HG22)
    or (resid 58 and name  HB1) (resid   91 and name HG23)
assign (resid 82 and name  HE2) (resid   79 and name HD12) 2.373 0.704 0.704 weight 1.000 
    or (resid 82 and name  HE2) (resid   79 and name HD11)
    or (resid 82 and name  HE2) (resid   79 and name HD13)
    or (resid 82 and name  HE1) (resid   79 and name HD12)
    or (resid 82 and name  HE1) (resid   79 and name HD11)
    or (resid 82 and name  HE1) (resid   79 and name HD13)
assign (resid 19 and name  HB1) (resid   43 and name HG12) 2.639 0.870 0.870 weight 1.000 
    or (resid 19 and name  HB1) (resid   43 and name HG11)
    or (resid 19 and name  HB1) (resid   43 and name HG13)
assign (resid 96 and name  HB2) (resid   94 and name HD22) 2.531 0.801 0.801 weight 1.000 
    or (resid 96 and name  HB2) (resid   94 and name HD21)
    or (resid 96 and name  HB2) (resid   94 and name HD23)
    or (resid 96 and name  HB2) (resid   94 and name HD12)
    or (resid 96 and name  HB2) (resid   94 and name HD11)
    or (resid 96 and name  HB2) (resid   94 and name HD13)
assign (resid 79 and name  HB2) (resid   79 and name HD22) 2.094 0.548 0.548 weight 1.000 
    or (resid 79 and name  HB2) (resid   79 and name HD21)
    or (resid 79 and name  HB2) (resid   79 and name HD23)
assign (resid 94 and name  HB2) (resid   94 and name HD22) 2.022 0.511 0.511 weight 1.000 
    or (resid 94 and name  HB2) (resid   94 and name HD21)
    or (resid 94 and name  HB2) (resid   94 and name HD23)
    or (resid 94 and name  HB2) (resid   94 and name HD12)
    or (resid 94 and name  HB2) (resid   94 and name HD11)
    or (resid 94 and name  HB2) (resid   94 and name HD13)
assign (resid 71 and name  HB2) (resid   76 and name HG12) 2.583 0.834 0.834 weight 1.000 
    or (resid 71 and name  HB2) (resid   76 and name HG11)
    or (resid 71 and name  HB2) (resid   76 and name HG13)
assign (resid 71 and name  HB1) (resid   76 and name HG12) 2.711 0.919 0.919 weight 1.000 
    or (resid 71 and name  HB1) (resid   76 and name HG11)
    or (resid 71 and name  HB1) (resid   76 and name HG13)
assign (resid 19 and name  HB2) (resid   54 and name HD12) 2.892 1.045 1.045 weight 1.000 
    or (resid 19 and name  HB2) (resid   54 and name HD11)
    or (resid 19 and name  HB2) (resid   54 and name HD13)
assign (resid 19 and name  HB1) (resid   54 and name HD12) 2.772 0.960 0.960 weight 1.000 
    or (resid 19 and name  HB1) (resid   54 and name HD11)
    or (resid 19 and name  HB1) (resid   54 and name HD13)
assign (resid 17 and name   HN) (resid   17 and name  HB1) 2.853 1.017 1.017 weight 1.000 
assign (resid 17 and name   HN) (resid   17 and name  HB2) 3.006 1.129 1.129 weight 1.000 
assign (resid 89 and name   HN) (resid   89 and name   HB) 2.396 0.718 0.718 weight 1.000 
assign (resid 72 and name   HN) (resid   75 and name  HG2) 3.027 1.145 1.145 weight 1.000 
    or (resid 72 and name   HN) (resid   75 and name  HG1)
assign (resid 60 and name   HN) (resid   60 and name   HB) 2.493 0.777 0.777 weight 1.000 
assign (resid 89 and name   HB) (resid    8 and name   HN) 2.954 1.091 1.091 weight 1.000 
assign (resid 80 and name   HB) (resid   81 and name   HN) 2.362 0.698 0.698 weight 1.000 
assign (resid 80 and name   HB) (resid   80 and name   HN) 2.171 0.589 0.589 weight 1.000 
assign (resid 17 and name  HB2) (resid   19 and name  HD1) 2.361 0.697 0.697 weight 1.000 
    or (resid 17 and name  HB2) (resid   19 and name  HD2)
assign (resid 27 and name  HB2) (resid   27 and name  HD1) 2.526 0.797 0.797 weight 1.000 
    or (resid 27 and name  HB2) (resid   27 and name  HD2)
assign (resid 27 and name  HB1) (resid   27 and name  HD1) 2.634 0.868 0.868 weight 1.000 
    or (resid 27 and name  HB1) (resid   27 and name  HD2)
assign (resid 10 and name   HB) (resid   17 and name  HD1) 2.873 1.032 1.032 weight 1.000 
    or (resid 10 and name   HB) (resid   17 and name  HD2)
assign (resid 17 and name  HB1) (resid   17 and name  HB2) 2.358 0.695 0.695 weight 1.000 
assign (resid 27 and name  HB1) (resid   27 and name  HB2) 2.101 0.552 0.552 weight 1.000 
assign (resid 80 and name   HB) (resid   77 and name   HA) 2.563 0.821 0.821 weight 1.000 
assign (resid 39 and name  HB2) (resid   39 and name  HG2) 2.294 0.658 0.658 weight 1.000 
    or (resid 39 and name  HB2) (resid   39 and name  HG1)
assign (resid 39 and name  HB1) (resid   39 and name  HG2) 2.292 0.656 0.656 weight 1.000 
    or (resid 39 and name  HB1) (resid   39 and name  HG1)
assign (resid 34 and name  HB1) (resid   34 and name  HB2) 2.320 0.673 0.673 weight 1.000 
assign (resid 17 and name  HB1) (resid   10 and name HG22) 2.863 1.025 1.025 weight 1.000 
    or (resid 17 and name  HB1) (resid   10 and name HG21)
    or (resid 17 and name  HB1) (resid   10 and name HG23)
assign (resid 10 and name   HB) (resid   10 and name HG22) 2.219 0.616 0.616 weight 1.000 
    or (resid 10 and name   HB) (resid   10 and name HG21)
    or (resid 10 and name   HB) (resid   10 and name HG23)
assign (resid 80 and name   HB) (resid   80 and name HG22) 1.870 0.437 0.437 weight 1.000 
    or (resid 80 and name   HB) (resid   80 and name HG21)
    or (resid 80 and name   HB) (resid   80 and name HG23)
assign (resid 17 and name   HN) (resid   16 and name  HB1) 2.955 1.092 1.092 weight 1.000 
assign (resid 42 and name  HB1) (resid   20 and name   HN) 3.096 1.198 1.198 weight 1.000 
assign (resid 22 and name  HB2) (resid   22 and name   HN) 2.845 1.012 1.012 weight 1.000 
assign (resid  9 and name   HN) (resid    9 and name   HB) 2.159 0.583 0.583 weight 1.000 
assign (resid 86 and name  HB2) (resid   87 and name   HN) 2.767 0.957 0.957 weight 1.000 
assign (resid 51 and name  HG2) (resid   51 and name   HN) 2.404 0.723 0.723 weight 1.000 
assign (resid 51 and name  HG1) (resid   51 and name   HN) 2.390 0.714 0.714 weight 1.000 
assign (resid 66 and name  HG2) (resid   66 and name   HN) 2.627 0.863 0.863 weight 1.000 
assign (resid 66 and name  HG1) (resid   66 and name   HN) 2.677 0.896 0.896 weight 1.000 
assign (resid 64 and name HD21) (resid   64 and name  HB2) 2.345 0.687 0.687 weight 1.000 
    or (resid 64 and name HD21) (resid   64 and name  HB1)
    or (resid 64 and name HD22) (resid   64 and name  HB2)
    or (resid 64 and name HD22) (resid   64 and name  HB1)
assign (resid 42 and name  HB2) (resid   42 and name   HN) 2.895 1.048 1.048 weight 1.000 
assign (resid 42 and name  HB1) (resid   42 and name   HN) 2.946 1.085 1.085 weight 1.000 
assign (resid 78 and name  HG1) (resid   78 and name   HN) 2.492 0.776 0.776 weight 1.000 
assign (resid 78 and name  HG2) (resid   78 and name   HN) 2.419 0.732 0.732 weight 1.000 
assign (resid 51 and name  HG2) (resid   51 and name   HA) 2.454 0.753 0.753 weight 1.000 
assign (resid 42 and name  HB1) (resid   42 and name  HB2) 2.168 0.588 0.588 weight 1.000 
assign (resid 86 and name  HB2) (resid   86 and name  HE2) 2.844 1.011 1.011 weight 1.000 
    or (resid 86 and name  HB2) (resid   86 and name  HE1)
assign (resid 86 and name  HB1) (resid   86 and name  HE2) 2.961 1.096 1.096 weight 1.000 
    or (resid 86 and name  HB1) (resid   86 and name  HE1)
assign (resid 62 and name  HB1) (resid   62 and name  HB2) 2.236 0.625 0.625 weight 1.000 
assign (resid 95 and name  HG2) (resid   93 and name  HB1) 2.066 0.534 0.534 weight 1.000 
    or (resid 95 and name  HG1) (resid   93 and name  HB1)
assign (resid 22 and name  HD2) (resid   22 and name  HB2) 2.841 1.009 1.009 weight 1.000 
assign (resid 16 and name  HB2) (resid   16 and name  HD2) 2.348 0.689 0.689 weight 1.000 
    or (resid 16 and name  HB2) (resid   16 and name  HD1)
assign (resid 42 and name  HB1) (resid   20 and name HG21) 2.890 1.044 1.044 weight 1.000 
    or (resid 42 and name  HB1) (resid   20 and name HG22)
    or (resid 42 and name  HB1) (resid   20 and name HG23)
assign (resid 86 and name  HB1) (resid   86 and name  HB2) 1.797 0.404 0.404 weight 1.000 
assign (resid 22 and name  HB2) (resid   22 and name  HB1) 2.090 0.546 0.546 weight 1.000 
assign (resid 66 and name  HG2) (resid   79 and name HD22) 2.534 0.803 0.803 weight 1.000 
    or (resid 66 and name  HG2) (resid   79 and name HD21)
    or (resid 66 and name  HG2) (resid   79 and name HD23)
assign (resid  9 and name   HB) (resid    9 and name HD12) 2.204 0.607 0.607 weight 1.000 
    or (resid  9 and name   HB) (resid    9 and name HD11)
    or (resid  9 and name   HB) (resid    9 and name HD13)
assign (resid 86 and name  HB1) (resid    9 and name HG22) 2.750 0.945 0.945 weight 1.000 
    or (resid 86 and name  HB1) (resid    9 and name HG21)
    or (resid 86 and name  HB1) (resid    9 and name HG23)
assign (resid  7 and name  HB1) (resid   89 and name   HN) 3.040 1.155 1.155 weight 1.000 
assign (resid 41 and name   HN) (resid   41 and name  HB2) 2.690 0.905 0.905 weight 1.000 
assign (resid 41 and name   HN) (resid   41 and name  HB1) 2.685 0.901 0.901 weight 1.000 
assign (resid  7 and name  HB2) (resid    8 and name   HN) 2.753 0.948 0.948 weight 1.000 
assign (resid  8 and name   HN) (resid    7 and name  HB1) 2.571 0.826 0.826 weight 1.000 
assign (resid 56 and name  HG1) (resid   56 and name   HN) 2.907 1.056 1.056 weight 1.000 
assign (resid 56 and name  HG2) (resid   56 and name   HN) 3.007 1.130 1.130 weight 1.000 
assign (resid 36 and name   HN) (resid   36 and name   HB) 2.399 0.720 0.720 weight 1.000 
assign (resid 69 and name   HN) (resid   67 and name  HB2) 2.563 0.821 0.821 weight 1.000 
    or (resid 69 and name   HN) (resid   67 and name  HB1)
assign (resid 43 and name   HB) (resid   43 and name   HA) 3.068 1.176 1.176 weight 1.000 
assign (resid 15 and name  HB2) (resid   15 and name   HA) 2.650 0.878 0.878 weight 1.000 
assign (resid 56 and name   HA) (resid   56 and name  HG1) 2.605 0.848 0.848 weight 1.000 
assign (resid 56 and name  HG2) (resid   56 and name   HA) 2.651 0.879 0.879 weight 1.000 
assign (resid  7 and name  HB2) (resid    7 and name  HD2) 2.858 1.021 1.021 weight 1.000 
    or (resid  7 and name  HB2) (resid    7 and name  HD1)
assign (resid 55 and name  HD2) (resid   55 and name  HB2) 2.300 0.661 0.661 weight 1.000 
    or (resid 55 and name  HD2) (resid   55 and name  HB1)
    or (resid 55 and name  HD1) (resid   55 and name  HB2)
    or (resid 55 and name  HD1) (resid   55 and name  HB1)
assign (resid 41 and name  HB1) (resid   41 and name  HB2) 2.340 0.685 0.685 weight 1.000 
assign (resid 37 and name  HB1) (resid   37 and name  HB2) 2.177 0.593 0.593 weight 1.000 
assign (resid 48 and name  HB2) (resid   48 and name  HB1) 1.985 0.493 0.493 weight 1.000 
assign (resid 48 and name  HB1) (resid   48 and name  HG1) 2.327 0.677 0.677 weight 1.000 
assign (resid 67 and name  HB2) (resid   67 and name  HG2) 1.951 0.476 0.476 weight 1.000 
    or (resid 67 and name  HB1) (resid   67 and name  HG2)
assign (resid 41 and name  HB1) (resid   22 and name  HD2) 2.941 1.081 1.081 weight 1.000 
assign (resid 93 and name  HB1) (resid   93 and name  HB2) 1.712 0.367 0.367 weight 1.000 
assign (resid 41 and name  HB2) (resid   22 and name  HD1) 2.776 0.963 0.963 weight 1.000 
assign (resid 15 and name  HB2) (resid   15 and name  HG1) 2.246 0.631 0.631 weight 1.000 
assign (resid  7 and name  HB1) (resid    7 and name  HB2) 1.853 0.429 0.429 weight 1.000 
assign (resid 41 and name  HB2) (resid   22 and name  HB1) 2.543 0.809 0.809 weight 1.000 
assign (resid 48 and name  HB1) (resid   10 and name HG22) 2.385 0.711 0.711 weight 1.000 
    or (resid 48 and name  HB1) (resid   10 and name HG21)
    or (resid 48 and name  HB1) (resid   10 and name HG23)
assign (resid 48 and name  HB2) (resid   10 and name HG22) 2.531 0.801 0.801 weight 1.000 
    or (resid 48 and name  HB2) (resid   10 and name HG21)
    or (resid 48 and name  HB2) (resid   10 and name HG23)
assign (resid 36 and name   HB) (resid   36 and name HG12) 2.044 0.522 0.522 weight 1.000 
    or (resid 36 and name   HB) (resid   36 and name HG11)
    or (resid 36 and name   HB) (resid   36 and name HG13)
assign (resid 37 and name  HB2) (resid   59 and name HD22) 2.355 0.693 0.693 weight 1.000 
    or (resid 37 and name  HB2) (resid   59 and name HD21)
    or (resid 37 and name  HB2) (resid   59 and name HD23)
    or (resid 37 and name  HB2) (resid   59 and name HD12)
    or (resid 37 and name  HB2) (resid   59 and name HD11)
    or (resid 37 and name  HB2) (resid   59 and name HD13)
assign (resid 87 and name   HB) (resid   87 and name HG22) 2.083 0.542 0.542 weight 1.000 
    or (resid 87 and name   HB) (resid   87 and name HG21)
    or (resid 87 and name   HB) (resid   87 and name HG23)
assign (resid 56 and name  HG2) (resid   43 and name HG22) 2.737 0.936 0.936 weight 1.000 
    or (resid 56 and name  HG2) (resid   43 and name HG21)
    or (resid 56 and name  HG2) (resid   43 and name HG23)
assign (resid 40 and name   HN) (resid   39 and name  HG2) 2.236 0.625 0.625 weight 1.000 
    or (resid 40 and name   HN) (resid   39 and name  HG1)
assign (resid 72 and name   HN) (resid   75 and name  HB2) 2.894 1.047 1.047 weight 1.000 
assign (resid 72 and name   HN) (resid   75 and name  HB1) 2.979 1.109 1.109 weight 1.000 
assign (resid 11 and name  HB2) (resid   11 and name   HN) 2.479 0.768 0.768 weight 1.000 
assign (resid 12 and name  HB2) (resid   12 and name   HN) 2.745 0.942 0.942 weight 1.000 
assign (resid 77 and name   HN) (resid   77 and name   HB) 2.163 0.585 0.585 weight 1.000 
assign (resid 77 and name   HB) (resid   78 and name   HN) 2.250 0.633 0.633 weight 1.000 
assign (resid 80 and name   HN) (resid   80 and name HG12) 2.429 0.738 0.738 weight 1.000 
assign (resid 86 and name  HD2) (resid   86 and name   HN) 2.850 1.015 1.015 weight 1.000 
    or (resid 86 and name  HD1) (resid   86 and name   HN)
assign (resid 76 and name   HN) (resid   75 and name  HB2) 2.400 0.720 0.720 weight 1.000 
assign (resid 78 and name  HB2) (resid   79 and name   HN) 2.573 0.827 0.827 weight 1.000 
assign (resid 78 and name  HB1) (resid   79 and name   HN) 2.511 0.788 0.788 weight 1.000 
assign (resid 11 and name  HB2) (resid   11 and name  HD2) 2.822 0.996 0.996 weight 1.000 
assign (resid 75 and name   HN) (resid   75 and name  HB2) 2.601 0.846 0.846 weight 1.000 
assign (resid 73 and name  HB2) (resid   73 and name  HD2) 3.073 1.180 1.180 weight 1.000 
assign (resid 95 and name  HB2) (resid   95 and name   HA) 2.996 1.122 1.122 weight 1.000 
assign (resid 51 and name   HA) (resid   51 and name  HB2) 2.168 0.587 0.587 weight 1.000 
    or (resid 51 and name   HA) (resid   51 and name  HB1)
assign (resid 75 and name   HA) (resid   75 and name  HB1) 2.655 0.881 0.881 weight 1.000 
assign (resid 12 and name  HB2) (resid   12 and name   HA) 2.955 1.092 1.092 weight 1.000 
assign (resid 12 and name   HA) (resid   12 and name  HB1) 2.950 1.088 1.088 weight 1.000 
assign (resid  6 and name  HB1) (resid    6 and name  HD2) 2.794 0.976 0.976 weight 1.000 
assign (resid  6 and name  HD1) (resid    6 and name  HB1) 2.378 0.707 0.707 weight 1.000 
assign (resid 80 and name HG11) (resid   80 and name   HA) 2.745 0.942 0.942 weight 1.000 
assign (resid  5 and name  HB2) (resid    5 and name  HD2) 2.481 0.769 0.769 weight 1.000 
    or (resid  5 and name  HB2) (resid    5 and name  HD1)
assign (resid  5 and name  HB1) (resid    5 and name  HD2) 2.521 0.794 0.794 weight 1.000 
    or (resid  5 and name  HB1) (resid    5 and name  HD1)
assign (resid 38 and name  HB1) (resid   38 and name  HB2) 2.330 0.679 0.679 weight 1.000 
assign (resid  6 and name  HB2) (resid    6 and name  HG1) 1.910 0.456 0.456 weight 1.000 
assign (resid  6 and name  HB1) (resid    6 and name  HB2) 1.727 0.373 0.373 weight 1.000 
assign (resid 80 and name HG11) (resid   80 and name HG12) 2.058 0.530 0.530 weight 1.000 
assign (resid 60 and name   HB) (resid   38 and name  HB2) 2.725 0.928 0.928 weight 1.000 
assign (resid 38 and name  HB1) (resid   60 and name   HB) 2.723 0.927 0.927 weight 1.000 
assign (resid 71 and name  HB2) (resid   75 and name  HB2) 2.544 0.809 0.809 weight 1.000 
assign (resid 73 and name  HB2) (resid   23 and name  HB2) 2.969 1.102 1.102 weight 1.000 
    or (resid 73 and name  HB2) (resid   23 and name  HB1)
    or (resid 73 and name  HB2) (resid   23 and name  HB3)
assign (resid 71 and name  HB1) (resid   75 and name  HB2) 2.503 0.783 0.783 weight 1.000 
assign (resid  7 and name  HB2) (resid   88 and name  HB2) 2.355 0.693 0.693 weight 1.000 
    or (resid  7 and name  HB2) (resid   88 and name  HB1)
    or (resid  7 and name  HB2) (resid   88 and name  HB3)
assign (resid 25 and name  HB2) (resid   25 and name  HG2) 2.107 0.555 0.555 weight 1.000 
    or (resid 25 and name  HB2) (resid   25 and name  HG1)
assign (resid 12 and name  HB2) (resid   12 and name  HG2) 2.632 0.866 0.866 weight 1.000 
assign (resid 12 and name  HB1) (resid   12 and name  HG2) 2.638 0.870 0.870 weight 1.000 
assign (resid 38 and name  HB1) (resid   60 and name HD12) 2.579 0.831 0.831 weight 1.000 
    or (resid 38 and name  HB1) (resid   60 and name HD11)
    or (resid 38 and name  HB1) (resid   60 and name HD13)
assign (resid 75 and name  HB2) (resid   71 and name HD12) 1.888 0.446 0.446 weight 1.000 
    or (resid 75 and name  HB2) (resid   71 and name HD11)
    or (resid 75 and name  HB2) (resid   71 and name HD13)
assign (resid 66 and name  HB2) (resid   79 and name HD22) 2.351 0.691 0.691 weight 1.000 
    or (resid 66 and name  HB2) (resid   79 and name HD21)
    or (resid 66 and name  HB2) (resid   79 and name HD23)
    or (resid 66 and name  HB1) (resid   79 and name HD22)
    or (resid 66 and name  HB1) (resid   79 and name HD21)
    or (resid 66 and name  HB1) (resid   79 and name HD23)
assign (resid 25 and name  HB1) (resid   25 and name  HB2) 2.232 0.623 0.623 weight 1.000 
assign (resid 12 and name  HB2) (resid   12 and name  HG1) 2.819 0.993 0.993 weight 1.000 
assign (resid 12 and name  HB1) (resid   12 and name  HG1) 2.812 0.988 0.988 weight 1.000 
assign (resid 68 and name   HB) (resid   68 and name HG22) 1.907 0.454 0.454 weight 1.000 
    or (resid 68 and name   HB) (resid   68 and name HG21)
    or (resid 68 and name   HB) (resid   68 and name HG23)
    or (resid 68 and name   HB) (resid   68 and name HG12)
    or (resid 68 and name   HB) (resid   68 and name HG11)
    or (resid 68 and name   HB) (resid   68 and name HG13)
assign (resid 76 and name   HB) (resid   76 and name HG22) 2.144 0.575 0.575 weight 1.000 
    or (resid 76 and name   HB) (resid   76 and name HG21)
    or (resid 76 and name   HB) (resid   76 and name HG23)
assign (resid 68 and name   HB) (resid   76 and name HG12) 2.273 0.646 0.646 weight 1.000 
    or (resid 68 and name   HB) (resid   76 and name HG11)
    or (resid 68 and name   HB) (resid   76 and name HG13)
assign (resid 76 and name   HB) (resid   76 and name HG12) 2.227 0.620 0.620 weight 1.000 
    or (resid 76 and name   HB) (resid   76 and name HG11)
    or (resid 76 and name   HB) (resid   76 and name HG13)
assign (resid 89 and name HG12) (resid   89 and name   HN) 2.930 1.073 1.073 weight 1.000 
assign (resid 89 and name HG11) (resid   89 and name   HN) 3.004 1.128 1.128 weight 1.000 
assign (resid  8 and name   HN) (resid    8 and name HG12) 2.628 0.864 0.864 weight 1.000 
assign (resid 24 and name HG12) (resid   24 and name   HN) 2.805 0.984 0.984 weight 1.000 
assign (resid 59 and name   HG) (resid   59 and name   HN) 2.801 0.981 0.981 weight 1.000 
assign (resid  9 and name   HN) (resid    9 and name HG12) 2.556 0.817 0.817 weight 1.000 
assign (resid 55 and name  HG1) (resid   55 and name   HN) 2.740 0.939 0.939 weight 1.000 
assign (resid 94 and name   HG) (resid   94 and name   HA) 2.876 1.034 1.034 weight 1.000 
assign (resid 67 and name  HG2) (resid   67 and name  HD2) 2.579 0.831 0.831 weight 1.000 
assign (resid 78 and name   HA) (resid   78 and name  HB1) 2.401 0.720 0.720 weight 1.000 
assign (resid 15 and name  HD2) (resid   15 and name   HA) 2.828 1.000 1.000 weight 1.000 
    or (resid 15 and name  HD1) (resid   15 and name   HA)
assign (resid  8 and name   HA) (resid    8 and name HG11) 2.762 0.953 0.953 weight 1.000 
assign (resid  6 and name  HG2) (resid    6 and name  HD2) 2.479 0.768 0.768 weight 1.000 
assign (resid 48 and name  HG2) (resid   48 and name  HD1) 2.918 1.064 1.064 weight 1.000 
assign (resid  6 and name  HG1) (resid    6 and name  HD1) 2.401 0.720 0.720 weight 1.000 
assign (resid  6 and name  HG2) (resid    6 and name  HD1) 2.336 0.682 0.682 weight 1.000 
assign (resid  7 and name  HG2) (resid    7 and name  HD2) 2.268 0.643 0.643 weight 1.000 
    or (resid  7 and name  HG2) (resid    7 and name  HD1)
assign (resid  7 and name  HG1) (resid    7 and name  HD2) 2.407 0.724 0.724 weight 1.000 
    or (resid  7 and name  HG1) (resid    7 and name  HD1)
assign (resid 73 and name  HB2) (resid   73 and name  HB1) 2.527 0.798 0.798 weight 1.000 
assign (resid  5 and name  HG2) (resid    5 and name  HD2) 2.209 0.610 0.610 weight 1.000 
    or (resid  5 and name  HG2) (resid    5 and name  HD1)
    or (resid  5 and name  HG1) (resid    5 and name  HD2)
    or (resid  5 and name  HG1) (resid    5 and name  HD1)
assign (resid 55 and name  HD2) (resid   55 and name  HG2) 2.174 0.591 0.591 weight 1.000 
    or (resid 55 and name  HD1) (resid   55 and name  HG2)
assign (resid 55 and name  HG1) (resid   55 and name  HD2) 2.213 0.612 0.612 weight 1.000 
    or (resid 55 and name  HG1) (resid   55 and name  HD1)
assign (resid 48 and name  HG2) (resid   48 and name  HB1) 2.636 0.869 0.869 weight 1.000 
assign (resid 24 and name HG12) (resid   37 and name  HB1) 2.861 1.023 1.023 weight 1.000 
assign (resid 24 and name HG11) (resid   37 and name  HB1) 2.669 0.891 0.891 weight 1.000 
assign (resid 75 and name  HB2) (resid   71 and name   HG) 2.953 1.090 1.090 weight 1.000 
assign (resid 48 and name  HG2) (resid   48 and name  HG1) 2.097 0.550 0.550 weight 1.000 
assign (resid 78 and name  HB1) (resid   78 and name  HG2) 1.925 0.463 0.463 weight 1.000 
assign (resid 56 and name  HB1) (resid   56 and name  HG1) 2.151 0.578 0.578 weight 1.000 
assign (resid 71 and name   HG) (resid   68 and name   HB) 2.909 1.058 1.058 weight 1.000 
assign (resid  9 and name   HB) (resid    9 and name HG12) 2.223 0.618 0.618 weight 1.000 
assign (resid  8 and name   HB) (resid    8 and name HG11) 2.256 0.636 0.636 weight 1.000 
assign (resid  9 and name   HB) (resid    9 and name HG11) 2.228 0.620 0.620 weight 1.000 
assign (resid  8 and name HG12) (resid    8 and name   HB) 2.173 0.590 0.590 weight 1.000 
assign (resid 89 and name HG12) (resid   89 and name   HB) 2.328 0.677 0.677 weight 1.000 
assign (resid 89 and name HG11) (resid   89 and name   HB) 2.368 0.701 0.701 weight 1.000 
assign (resid  7 and name  HG1) (resid    7 and name  HB1) 2.155 0.581 0.581 weight 1.000 
assign (resid  7 and name  HG2) (resid    7 and name  HB1) 2.184 0.596 0.596 weight 1.000 
assign (resid  8 and name HG11) (resid    8 and name HG12) 1.659 0.344 0.344 weight 1.000 
assign (resid  9 and name HG11) (resid    9 and name HG12) 1.713 0.367 0.367 weight 1.000 
assign (resid 60 and name HG12) (resid   91 and name HG21) 2.417 0.730 0.730 weight 1.000 
    or (resid 60 and name HG12) (resid   91 and name HG22)
    or (resid 60 and name HG12) (resid   91 and name HG23)
    or (resid 60 and name HG11) (resid   91 and name HG21)
    or (resid 60 and name HG11) (resid   91 and name HG22)
    or (resid 60 and name HG11) (resid   91 and name HG23)
assign (resid  8 and name HG12) (resid   91 and name HG21) 2.501 0.782 0.782 weight 1.000 
    or (resid  8 and name HG12) (resid   91 and name HG22)
    or (resid  8 and name HG12) (resid   91 and name HG23)
assign (resid 24 and name HG11) (resid   24 and name HG12) 1.827 0.417 0.417 weight 1.000 
assign (resid 94 and name   HG) (resid   94 and name HD22) 2.163 0.585 0.585 weight 1.000 
    or (resid 94 and name   HG) (resid   94 and name HD21)
    or (resid 94 and name   HG) (resid   94 and name HD23)
    or (resid 94 and name   HG) (resid   94 and name HD12)
    or (resid 94 and name   HG) (resid   94 and name HD11)
    or (resid 94 and name   HG) (resid   94 and name HD13)
assign (resid  8 and name HG11) (resid    8 and name HD12) 1.852 0.429 0.429 weight 1.000 
    or (resid  8 and name HG11) (resid    8 and name HD11)
    or (resid  8 and name HG11) (resid    8 and name HD13)
assign (resid 24 and name HG12) (resid   24 and name HG22) 1.856 0.431 0.431 weight 1.000 
    or (resid 24 and name HG12) (resid   24 and name HG21)
    or (resid 24 and name HG12) (resid   24 and name HG23)
assign (resid 56 and name  HB1) (resid   43 and name HG22) 2.548 0.812 0.812 weight 1.000 
    or (resid 56 and name  HB1) (resid   43 and name HG21)
    or (resid 56 and name  HB1) (resid   43 and name HG23)
assign (resid 10 and name HG12) (resid   10 and name HG11) 1.825 0.416 0.416 weight 1.000 
assign (resid 10 and name HG11) (resid   87 and name HG12) 2.922 1.067 1.067 weight 1.000 
    or (resid 10 and name HG11) (resid   87 and name HG11)
    or (resid 10 and name HG11) (resid   87 and name HG13)
assign (resid 89 and name HG11) (resid   87 and name HG12) 2.614 0.854 0.854 weight 1.000 
    or (resid 89 and name HG11) (resid   87 and name HG11)
    or (resid 89 and name HG11) (resid   87 and name HG13)
assign (resid 71 and name   HG) (resid   76 and name HG12) 2.778 0.965 0.965 weight 1.000 
    or (resid 71 and name   HG) (resid   76 and name HG11)
    or (resid 71 and name   HG) (resid   76 and name HG13)
assign (resid 22 and name   HN) (resid   21 and name HD12) 2.668 0.889 0.889 weight 1.000 
    or (resid 22 and name   HN) (resid   21 and name HD11)
    or (resid 22 and name   HN) (resid   21 and name HD13)
assign (resid 81 and name   HN) (resid   81 and name   HG) 2.253 0.634 0.634 weight 1.000 
assign (resid 81 and name HD12) (resid   81 and name   HN) 2.798 0.979 0.979 weight 1.000 
    or (resid 81 and name HD11) (resid   81 and name   HN)
    or (resid 81 and name HD13) (resid   81 and name   HN)
assign (resid 12 and name  HG2) (resid   12 and name   HN) 2.905 1.055 1.055 weight 1.000 
assign (resid 82 and name   HN) (resid   82 and name  HG1) 2.676 0.895 0.895 weight 1.000 
assign (resid 79 and name HD22) (resid   80 and name   HN) 2.964 1.098 1.098 weight 1.000 
    or (resid 79 and name HD21) (resid   80 and name   HN)
    or (resid 79 and name HD23) (resid   80 and name   HN)
assign (resid 21 and name HD22) (resid   19 and name  HE1) 2.685 0.901 0.901 weight 1.000 
    or (resid 21 and name HD22) (resid   19 and name  HE2)
    or (resid 21 and name HD21) (resid   19 and name  HE1)
    or (resid 21 and name HD21) (resid   19 and name  HE2)
    or (resid 21 and name HD23) (resid   19 and name  HE1)
    or (resid 21 and name HD23) (resid   19 and name  HE2)
assign (resid 21 and name HD12) (resid   19 and name  HE1) 2.479 0.768 0.768 weight 1.000 
    or (resid 21 and name HD12) (resid   19 and name  HE2)
    or (resid 21 and name HD11) (resid   19 and name  HE1)
    or (resid 21 and name HD11) (resid   19 and name  HE2)
    or (resid 21 and name HD13) (resid   19 and name  HE1)
    or (resid 21 and name HD13) (resid   19 and name  HE2)
assign (resid 54 and name HD12) (resid   19 and name  HD1) 2.617 0.856 0.856 weight 1.000 
    or (resid 54 and name HD12) (resid   19 and name  HD2)
    or (resid 54 and name HD11) (resid   19 and name  HD1)
    or (resid 54 and name HD11) (resid   19 and name  HD2)
    or (resid 54 and name HD13) (resid   19 and name  HD1)
    or (resid 54 and name HD13) (resid   19 and name  HD2)
assign (resid 15 and name  HG1) (resid   15 and name   HA) 2.879 1.036 1.036 weight 1.000 
assign (resid 15 and name  HG2) (resid   15 and name   HA) 2.906 1.055 1.055 weight 1.000 
assign (resid 79 and name HD22) (resid   79 and name   HA) 2.893 1.046 1.046 weight 1.000 
    or (resid 79 and name HD21) (resid   79 and name   HA)
    or (resid 79 and name HD23) (resid   79 and name   HA)
assign (resid 81 and name HD12) (resid   78 and name   HA) 2.906 1.055 1.055 weight 1.000 
    or (resid 81 and name HD11) (resid   78 and name   HA)
    or (resid 81 and name HD13) (resid   78 and name   HA)
assign (resid 77 and name   HA) (resid   21 and name HD22) 2.773 0.961 0.961 weight 1.000 
    or (resid 77 and name   HA) (resid   21 and name HD21)
    or (resid 77 and name   HA) (resid   21 and name HD23)
assign (resid 21 and name HD12) (resid   38 and name  HB2) 2.833 1.003 1.003 weight 1.000 
    or (resid 21 and name HD11) (resid   38 and name  HB2)
    or (resid 21 and name HD13) (resid   38 and name  HB2)
assign (resid 82 and name  HG2) (resid   82 and name  HE2) 2.601 0.846 0.846 weight 1.000 
    or (resid 82 and name  HG2) (resid   82 and name  HE1)
assign (resid 82 and name  HG1) (resid   82 and name  HE2) 2.589 0.838 0.838 weight 1.000 
    or (resid 82 and name  HG1) (resid   82 and name  HE1)
assign (resid 15 and name  HG2) (resid   15 and name  HE2) 2.555 0.816 0.816 weight 1.000 
    or (resid 15 and name  HG2) (resid   15 and name  HE1)
assign (resid 15 and name  HG1) (resid   15 and name  HE2) 2.658 0.883 0.883 weight 1.000 
    or (resid 15 and name  HG1) (resid   15 and name  HE1)
assign (resid 38 and name  HB1) (resid   21 and name HD12) 2.691 0.905 0.905 weight 1.000 
    or (resid 38 and name  HB1) (resid   21 and name HD11)
    or (resid 38 and name  HB1) (resid   21 and name HD13)
assign (resid 71 and name HD12) (resid   68 and name   HB) 2.172 0.590 0.590 weight 1.000 
    or (resid 71 and name HD11) (resid   68 and name   HB)
    or (resid 71 and name HD13) (resid   68 and name   HB)
assign (resid 82 and name  HG2) (resid   82 and name  HB2) 2.111 0.557 0.557 weight 1.000 
    or (resid 82 and name  HG2) (resid   82 and name  HB1)
assign (resid 82 and name  HG1) (resid   82 and name  HB2) 2.057 0.529 0.529 weight 1.000 
    or (resid 82 and name  HG1) (resid   82 and name  HB1)
assign (resid 15 and name  HG1) (resid   15 and name  HB1) 2.303 0.663 0.663 weight 1.000 
assign (resid 15 and name  HG2) (resid   15 and name  HB1) 2.271 0.644 0.644 weight 1.000 
assign (resid 16 and name  HG2) (resid   16 and name  HB2) 2.482 0.770 0.770 weight 1.000 
    or (resid 16 and name  HG1) (resid   16 and name  HB2)
assign (resid 21 and name HD12) (resid   21 and name   HG) 2.340 0.684 0.684 weight 1.000 
    or (resid 21 and name HD11) (resid   21 and name   HG)
    or (resid 21 and name HD13) (resid   21 and name   HG)
assign (resid 81 and name  HB2) (resid   81 and name HD12) 1.880 0.442 0.442 weight 1.000 
    or (resid 81 and name  HB2) (resid   81 and name HD11)
    or (resid 81 and name  HB2) (resid   81 and name HD13)
assign (resid 15 and name  HG1) (resid   15 and name  HD2) 1.814 0.411 0.411 weight 1.000 
    or (resid 15 and name  HG1) (resid   15 and name  HD1)
assign (resid 59 and name HD22) (resid   59 and name  HB2) 1.902 0.452 0.452 weight 1.000 
    or (resid 59 and name HD21) (resid   59 and name  HB2)
    or (resid 59 and name HD23) (resid   59 and name  HB2)
    or (resid 59 and name HD12) (resid   59 and name  HB2)
    or (resid 59 and name HD11) (resid   59 and name  HB2)
    or (resid 59 and name HD13) (resid   59 and name  HB2)
assign (resid 54 and name HD12) (resid   60 and name HG12) 2.748 0.944 0.944 weight 1.000 
    or (resid 54 and name HD12) (resid   60 and name HG11)
    or (resid 54 and name HD11) (resid   60 and name HG12)
    or (resid 54 and name HD11) (resid   60 and name HG11)
    or (resid 54 and name HD13) (resid   60 and name HG12)
    or (resid 54 and name HD13) (resid   60 and name HG11)
assign (resid 21 and name  HB1) (resid   21 and name HD22) 2.364 0.699 0.699 weight 1.000 
    or (resid 21 and name  HB1) (resid   21 and name HD21)
    or (resid 21 and name  HB1) (resid   21 and name HD23)
assign (resid 79 and name  HB1) (resid   79 and name HD22) 2.045 0.523 0.523 weight 1.000 
    or (resid 79 and name  HB1) (resid   79 and name HD21)
    or (resid 79 and name  HB1) (resid   79 and name HD23)
assign (resid 54 and name HD12) (resid   54 and name   HG) 2.007 0.503 0.503 weight 1.000 
    or (resid 54 and name HD11) (resid   54 and name   HG)
    or (resid 54 and name HD13) (resid   54 and name   HG)
assign (resid 79 and name HD22) (resid   79 and name   HG) 1.851 0.428 0.428 weight 1.000 
    or (resid 79 and name HD21) (resid   79 and name   HG)
    or (resid 79 and name HD23) (resid   79 and name   HG)
assign (resid 21 and name HD22) (resid   77 and name HG22) 2.118 0.561 0.561 weight 1.000 
    or (resid 21 and name HD22) (resid   77 and name HG21)
    or (resid 21 and name HD22) (resid   77 and name HG23)
    or (resid 21 and name HD21) (resid   77 and name HG22)
    or (resid 21 and name HD21) (resid   77 and name HG21)
    or (resid 21 and name HD21) (resid   77 and name HG23)
    or (resid 21 and name HD23) (resid   77 and name HG22)
    or (resid 21 and name HD23) (resid   77 and name HG21)
    or (resid 21 and name HD23) (resid   77 and name HG23)
assign (resid 71 and name HD12) (resid   76 and name HG12) 2.196 0.603 0.603 weight 1.000 
    or (resid 71 and name HD12) (resid   76 and name HG11)
    or (resid 71 and name HD12) (resid   76 and name HG13)
    or (resid 71 and name HD11) (resid   76 and name HG12)
    or (resid 71 and name HD11) (resid   76 and name HG11)
    or (resid 71 and name HD11) (resid   76 and name HG13)
    or (resid 71 and name HD13) (resid   76 and name HG12)
    or (resid 71 and name HD13) (resid   76 and name HG11)
    or (resid 71 and name HD13) (resid   76 and name HG13)
assign (resid 21 and name   HN) (resid   20 and name HG21) 2.417 0.730 0.730 weight 1.000 
    or (resid 21 and name   HN) (resid   20 and name HG22)
    or (resid 21 and name   HN) (resid   20 and name HG23)
assign (resid 41 and name   HN) (resid   40 and name HG22) 2.250 0.633 0.633 weight 1.000 
    or (resid 41 and name   HN) (resid   40 and name HG21)
    or (resid 41 and name   HN) (resid   40 and name HG23)
assign (resid 40 and name HG22) (resid   40 and name   HN) 2.723 0.927 0.927 weight 1.000 
    or (resid 40 and name HG21) (resid   40 and name   HN)
    or (resid 40 and name HG23) (resid   40 and name   HN)
assign (resid 74 and name   HN) (resid   74 and name HG21) 2.366 0.700 0.700 weight 1.000 
    or (resid 74 and name   HN) (resid   74 and name HG22)
    or (resid 74 and name   HN) (resid   74 and name HG23)
assign (resid 35 and name HG21) (resid   36 and name   HN) 2.531 0.801 0.801 weight 1.000 
    or (resid 35 and name HG22) (resid   36 and name   HN)
    or (resid 35 and name HG23) (resid   36 and name   HN)
assign (resid 55 and name   HN) (resid   54 and name HD22) 2.291 0.656 0.656 weight 1.000 
    or (resid 55 and name   HN) (resid   54 and name HD21)
    or (resid 55 and name   HN) (resid   54 and name HD23)
assign (resid 40 and name HG22) (resid   55 and name   HN) 3.024 1.143 1.143 weight 1.000 
    or (resid 40 and name HG21) (resid   55 and name   HN)
    or (resid 40 and name HG23) (resid   55 and name   HN)
assign (resid 88 and name   HN) (resid   87 and name HG22) 2.237 0.625 0.625 weight 1.000 
    or (resid 88 and name   HN) (resid   87 and name HG21)
    or (resid 88 and name   HN) (resid   87 and name HG23)
assign (resid 49 and name   HN) (resid   43 and name HG12) 2.929 1.072 1.072 weight 1.000 
    or (resid 49 and name   HN) (resid   43 and name HG11)
    or (resid 49 and name   HN) (resid   43 and name HG13)
assign (resid 64 and name HD21) (resid   87 and name HG22) 2.398 0.719 0.719 weight 1.000 
    or (resid 64 and name HD21) (resid   87 and name HG21)
    or (resid 64 and name HD21) (resid   87 and name HG23)
    or (resid 64 and name HD22) (resid   87 and name HG22)
    or (resid 64 and name HD22) (resid   87 and name HG21)
    or (resid 64 and name HD22) (resid   87 and name HG23)
assign (resid 71 and name HD22) (resid   71 and name   HN) 2.664 0.887 0.887 weight 1.000 
    or (resid 71 and name HD21) (resid   71 and name   HN)
    or (resid 71 and name HD23) (resid   71 and name   HN)
assign (resid 77 and name   HN) (resid   77 and name HG22) 1.964 0.482 0.482 weight 1.000 
    or (resid 77 and name   HN) (resid   77 and name HG21)
    or (resid 77 and name   HN) (resid   77 and name HG23)
assign (resid 76 and name HG22) (resid   77 and name   HN) 2.601 0.846 0.846 weight 1.000 
    or (resid 76 and name HG21) (resid   77 and name   HN)
    or (resid 76 and name HG23) (resid   77 and name   HN)
assign (resid 77 and name HG12) (resid   78 and name   HN) 2.268 0.643 0.643 weight 1.000 
    or (resid 77 and name HG11) (resid   78 and name   HN)
    or (resid 77 and name HG13) (resid   78 and name   HN)
assign (resid 79 and name   HN) (resid   79 and name HD12) 2.356 0.694 0.694 weight 1.000 
    or (resid 79 and name   HN) (resid   79 and name HD11)
    or (resid 79 and name   HN) (resid   79 and name HD13)
assign (resid 77 and name HG22) (resid   73 and name  HE1) 2.682 0.899 0.899 weight 1.000 
    or (resid 77 and name HG21) (resid   73 and name  HE1)
    or (resid 77 and name HG23) (resid   73 and name  HE1)
assign (resid 76 and name HG22) (resid   76 and name   HN) 2.536 0.804 0.804 weight 1.000 
    or (resid 76 and name HG21) (resid   76 and name   HN)
    or (resid 76 and name HG23) (resid   76 and name   HN)
assign (resid 76 and name   HN) (resid   76 and name HG12) 2.247 0.631 0.631 weight 1.000 
    or (resid 76 and name   HN) (resid   76 and name HG11)
    or (resid 76 and name   HN) (resid   76 and name HG13)
assign (resid 36 and name HG22) (resid   38 and name  HE1) 2.913 1.061 1.061 weight 1.000 
    or (resid 36 and name HG21) (resid   38 and name  HE1)
    or (resid 36 and name HG23) (resid   38 and name  HE1)
assign (resid 81 and name HD22) (resid   17 and name  HE1) 2.063 0.532 0.532 weight 1.000 
    or (resid 81 and name HD22) (resid   17 and name  HE2)
    or (resid 81 and name HD21) (resid   17 and name  HE1)
    or (resid 81 and name HD21) (resid   17 and name  HE2)
    or (resid 81 and name HD23) (resid   17 and name  HE1)
    or (resid 81 and name HD23) (resid   17 and name  HE2)
assign (resid 74 and name HG21) (resid   73 and name  HD2) 2.548 0.812 0.812 weight 1.000 
    or (resid 74 and name HG22) (resid   73 and name  HD2)
    or (resid 74 and name HG23) (resid   73 and name  HD2)
assign (resid 40 and name HG22) (resid   40 and name   HA) 2.509 0.787 0.787 weight 1.000 
    or (resid 40 and name HG21) (resid   40 and name   HA)
    or (resid 40 and name HG23) (resid   40 and name   HA)
assign (resid 43 and name HG22) (resid   43 and name   HA) 2.502 0.783 0.783 weight 1.000 
    or (resid 43 and name HG21) (resid   43 and name   HA)
    or (resid 43 and name HG23) (resid   43 and name   HA)
assign (resid 79 and name   HA) (resid   79 and name HD12) 1.922 0.462 0.462 weight 1.000 
    or (resid 79 and name   HA) (resid   79 and name HD11)
    or (resid 79 and name   HA) (resid   79 and name HD13)
assign (resid 43 and name HG12) (resid   50 and name   HA) 2.082 0.542 0.542 weight 1.000 
    or (resid 43 and name HG11) (resid   50 and name   HA)
    or (resid 43 and name HG13) (resid   50 and name   HA)
assign (resid 87 and name HG22) (resid   80 and name   HA) 2.420 0.732 0.732 weight 1.000 
    or (resid 87 and name HG21) (resid   80 and name   HA)
    or (resid 87 and name HG23) (resid   80 and name   HA)
assign (resid 43 and name HG22) (resid   56 and name   HA) 2.542 0.807 0.807 weight 1.000 
    or (resid 43 and name HG21) (resid   56 and name   HA)
    or (resid 43 and name HG23) (resid   56 and name   HA)
assign (resid 40 and name HG22) (resid   19 and name  HB2) 2.677 0.896 0.896 weight 1.000 
    or (resid 40 and name HG21) (resid   19 and name  HB2)
    or (resid 40 and name HG23) (resid   19 and name  HB2)
assign (resid 68 and name HG22) (resid   76 and name   HA) 2.732 0.933 0.933 weight 1.000 
    or (resid 68 and name HG21) (resid   76 and name   HA)
    or (resid 68 and name HG23) (resid   76 and name   HA)
    or (resid 68 and name HG12) (resid   76 and name   HA)
    or (resid 68 and name HG11) (resid   76 and name   HA)
    or (resid 68 and name HG13) (resid   76 and name   HA)
assign (resid 41 and name  HB2) (resid   20 and name HG21) 2.863 1.025 1.025 weight 1.000 
    or (resid 41 and name  HB2) (resid   20 and name HG22)
    or (resid 41 and name  HB2) (resid   20 and name HG23)
assign (resid 77 and name   HA) (resid   77 and name HG12) 2.134 0.569 0.569 weight 1.000 
    or (resid 77 and name   HA) (resid   77 and name HG11)
    or (resid 77 and name   HA) (resid   77 and name HG13)
assign (resid 76 and name HG22) (resid   77 and name   HA) 2.827 0.999 0.999 weight 1.000 
    or (resid 76 and name HG21) (resid   77 and name   HA)
    or (resid 76 and name HG23) (resid   77 and name   HA)
assign (resid 41 and name  HB1) (resid   20 and name HG21) 2.385 0.711 0.711 weight 1.000 
    or (resid 41 and name  HB1) (resid   20 and name HG22)
    or (resid 41 and name  HB1) (resid   20 and name HG23)
assign (resid 40 and name HG22) (resid   19 and name  HB1) 2.762 0.953 0.953 weight 1.000 
    or (resid 40 and name HG21) (resid   19 and name  HB1)
    or (resid 40 and name HG23) (resid   19 and name  HB1)
assign (resid 91 and name HG21) (resid   58 and name  HB2) 2.712 0.920 0.920 weight 1.000 
    or (resid 91 and name HG22) (resid   58 and name  HB2)
    or (resid 91 and name HG23) (resid   58 and name  HB2)
assign (resid 72 and name   HB) (resid   72 and name HG12) 2.003 0.502 0.502 weight 1.000 
    or (resid 72 and name   HB) (resid   72 and name HG11)
    or (resid 72 and name   HB) (resid   72 and name HG13)
assign (resid 35 and name HG21) (resid   28 and name  HG1) 2.955 1.092 1.092 weight 1.000 
    or (resid 35 and name HG22) (resid   28 and name  HG1)
    or (resid 35 and name HG23) (resid   28 and name  HG1)
assign (resid 40 and name HG22) (resid   40 and name   HB) 2.017 0.508 0.508 weight 1.000 
    or (resid 40 and name HG21) (resid   40 and name   HB)
    or (resid 40 and name HG23) (resid   40 and name   HB)
assign (resid 76 and name HG12) (resid   75 and name  HB2) 3.011 1.134 1.134 weight 1.000 
    or (resid 76 and name HG11) (resid   75 and name  HB2)
    or (resid 76 and name HG13) (resid   75 and name  HB2)
assign (resid 75 and name  HG2) (resid   72 and name HG12) 2.640 0.871 0.871 weight 1.000 
    or (resid 75 and name  HG2) (resid   72 and name HG11)
    or (resid 75 and name  HG2) (resid   72 and name HG13)
    or (resid 75 and name  HG1) (resid   72 and name HG12)
    or (resid 75 and name  HG1) (resid   72 and name HG11)
    or (resid 75 and name  HG1) (resid   72 and name HG13)
assign (resid 56 and name  HG1) (resid   43 and name HG22) 2.498 0.780 0.780 weight 1.000 
    or (resid 56 and name  HG1) (resid   43 and name HG21)
    or (resid 56 and name  HG1) (resid   43 and name HG23)
assign (resid 33 and name   HB) (resid   33 and name HG22) 1.775 0.394 0.394 weight 1.000 
    or (resid 33 and name   HB) (resid   33 and name HG21)
    or (resid 33 and name   HB) (resid   33 and name HG23)
assign (resid 77 and name   HB) (resid   77 and name HG22) 1.926 0.464 0.464 weight 1.000 
    or (resid 77 and name   HB) (resid   77 and name HG21)
    or (resid 77 and name   HB) (resid   77 and name HG23)
assign (resid 36 and name HG22) (resid   36 and name   HB) 1.938 0.469 0.469 weight 1.000 
    or (resid 36 and name HG21) (resid   36 and name   HB)
    or (resid 36 and name HG23) (resid   36 and name   HB)
assign (resid 76 and name HG12) (resid   75 and name  HB1) 2.695 0.908 0.908 weight 1.000 
    or (resid 76 and name HG11) (resid   75 and name  HB1)
    or (resid 76 and name HG13) (resid   75 and name  HB1)
assign (resid 86 and name  HG2) (resid   86 and name  HB2) 2.450 0.751 0.751 weight 1.000 
assign (resid 86 and name  HG1) (resid   86 and name  HB2) 2.488 0.774 0.774 weight 1.000 
assign (resid 43 and name HG22) (resid   43 and name   HB) 1.799 0.404 0.404 weight 1.000 
    or (resid 43 and name HG21) (resid   43 and name   HB)
    or (resid 43 and name HG23) (resid   43 and name   HB)
assign (resid 86 and name  HG1) (resid   86 and name  HD2) 2.099 0.551 0.551 weight 1.000 
    or (resid 86 and name  HG1) (resid   86 and name  HD1)
assign (resid 63 and name HG12) (resid   79 and name  HB1) 2.140 0.573 0.573 weight 1.000 
    or (resid 63 and name HG11) (resid   79 and name  HB1)
    or (resid 63 and name HG13) (resid   79 and name  HB1)
assign (resid 54 and name HD22) (resid   91 and name HG21) 1.887 0.445 0.445 weight 1.000 
    or (resid 54 and name HD22) (resid   91 and name HG22)
    or (resid 54 and name HD22) (resid   91 and name HG23)
    or (resid 54 and name HD21) (resid   91 and name HG21)
    or (resid 54 and name HD21) (resid   91 and name HG22)
    or (resid 54 and name HD21) (resid   91 and name HG23)
    or (resid 54 and name HD23) (resid   91 and name HG21)
    or (resid 54 and name HD23) (resid   91 and name HG22)
    or (resid 54 and name HD23) (resid   91 and name HG23)
assign (resid 20 and name HG21) (resid   22 and name  HG2) 1.945 0.473 0.473 weight 1.000 
    or (resid 20 and name HG22) (resid   22 and name  HG2)
    or (resid 20 and name HG23) (resid   22 and name  HG2)
assign (resid 76 and name HG12) (resid   68 and name HG22) 1.940 0.471 0.471 weight 1.000 
    or (resid 76 and name HG12) (resid   68 and name HG21)
    or (resid 76 and name HG12) (resid   68 and name HG23)
    or (resid 76 and name HG12) (resid   68 and name HG12)
    or (resid 76 and name HG12) (resid   68 and name HG11)
    or (resid 76 and name HG12) (resid   68 and name HG13)
    or (resid 76 and name HG11) (resid   68 and name HG22)
    or (resid 76 and name HG11) (resid   68 and name HG21)
    or (resid 76 and name HG11) (resid   68 and name HG23)
    or (resid 76 and name HG11) (resid   68 and name HG12)
    or (resid 76 and name HG11) (resid   68 and name HG11)
    or (resid 76 and name HG11) (resid   68 and name HG13)
    or (resid 76 and name HG13) (resid   68 and name HG22)
    or (resid 76 and name HG13) (resid   68 and name HG21)
    or (resid 76 and name HG13) (resid   68 and name HG23)
    or (resid 76 and name HG13) (resid   68 and name HG12)
    or (resid 76 and name HG13) (resid   68 and name HG11)
    or (resid 76 and name HG13) (resid   68 and name HG13)
assign (resid 74 and name HG21) (resid   77 and name HG22) 2.717 0.922 0.922 weight 1.000 
    or (resid 74 and name HG21) (resid   77 and name HG21)
    or (resid 74 and name HG21) (resid   77 and name HG23)
    or (resid 74 and name HG22) (resid   77 and name HG22)
    or (resid 74 and name HG22) (resid   77 and name HG21)
    or (resid 74 and name HG22) (resid   77 and name HG23)
    or (resid 74 and name HG23) (resid   77 and name HG22)
    or (resid 74 and name HG23) (resid   77 and name HG21)
    or (resid 74 and name HG23) (resid   77 and name HG23)
assign (resid 77 and name HG22) (resid   77 and name HG12) 1.786 0.399 0.399 weight 1.000 
    or (resid 77 and name HG22) (resid   77 and name HG11)
    or (resid 77 and name HG22) (resid   77 and name HG13)
    or (resid 77 and name HG21) (resid   77 and name HG12)
    or (resid 77 and name HG21) (resid   77 and name HG11)
    or (resid 77 and name HG21) (resid   77 and name HG13)
    or (resid 77 and name HG23) (resid   77 and name HG12)
    or (resid 77 and name HG23) (resid   77 and name HG11)
    or (resid 77 and name HG23) (resid   77 and name HG13)
assign (resid 76 and name HG22) (resid   76 and name HG12) 1.912 0.457 0.457 weight 1.000 
    or (resid 76 and name HG22) (resid   76 and name HG11)
    or (resid 76 and name HG22) (resid   76 and name HG13)
    or (resid 76 and name HG21) (resid   76 and name HG12)
    or (resid 76 and name HG21) (resid   76 and name HG11)
    or (resid 76 and name HG21) (resid   76 and name HG13)
    or (resid 76 and name HG23) (resid   76 and name HG12)
    or (resid 76 and name HG23) (resid   76 and name HG11)
    or (resid 76 and name HG23) (resid   76 and name HG13)
assign (resid 54 and name HD12) (resid   54 and name HD22) 1.841 0.424 0.424 weight 1.000 
    or (resid 54 and name HD12) (resid   54 and name HD21)
    or (resid 54 and name HD12) (resid   54 and name HD23)
    or (resid 54 and name HD11) (resid   54 and name HD22)
    or (resid 54 and name HD11) (resid   54 and name HD21)
    or (resid 54 and name HD11) (resid   54 and name HD23)
    or (resid 54 and name HD13) (resid   54 and name HD22)
    or (resid 54 and name HD13) (resid   54 and name HD21)
    or (resid 54 and name HD13) (resid   54 and name HD23)
assign (resid 40 and name HG22) (resid   54 and name HD12) 2.080 0.541 0.541 weight 1.000 
    or (resid 40 and name HG22) (resid   54 and name HD11)
    or (resid 40 and name HG22) (resid   54 and name HD13)
    or (resid 40 and name HG21) (resid   54 and name HD12)
    or (resid 40 and name HG21) (resid   54 and name HD11)
    or (resid 40 and name HG21) (resid   54 and name HD13)
    or (resid 40 and name HG23) (resid   54 and name HD12)
    or (resid 40 and name HG23) (resid   54 and name HD11)
    or (resid 40 and name HG23) (resid   54 and name HD13)
assign (resid 40 and name HG12) (resid   57 and name   HN) 2.582 0.834 0.834 weight 1.000 
    or (resid 40 and name HG11) (resid   57 and name   HN)
    or (resid 40 and name HG13) (resid   57 and name   HN)
assign (resid 92 and name HG21) (resid   92 and name   HN) 2.430 0.738 0.738 weight 1.000 
    or (resid 92 and name HG22) (resid   92 and name   HN)
    or (resid 92 and name HG23) (resid   92 and name   HN)
assign (resid 27 and name   HN) (resid   26 and name HG12) 2.666 0.889 0.889 weight 1.000 
    or (resid 27 and name   HN) (resid   26 and name HG11)
    or (resid 27 and name   HN) (resid   26 and name HG13)
assign (resid 40 and name HG12) (resid   40 and name   HN) 2.134 0.569 0.569 weight 1.000 
    or (resid 40 and name HG11) (resid   40 and name   HN)
    or (resid 40 and name HG13) (resid   40 and name   HN)
assign (resid 72 and name   HN) (resid   72 and name HG22) 2.071 0.536 0.536 weight 1.000 
    or (resid 72 and name   HN) (resid   72 and name HG21)
    or (resid 72 and name   HN) (resid   72 and name HG23)
assign (resid 27 and name   HN) (resid   26 and name HG22) 2.927 1.071 1.071 weight 1.000 
    or (resid 27 and name   HN) (resid   26 and name HG21)
    or (resid 27 and name   HN) (resid   26 and name HG23)
assign (resid 23 and name  HB2) (resid   24 and name   HN) 2.717 0.923 0.923 weight 1.000 
    or (resid 23 and name  HB1) (resid   24 and name   HN)
    or (resid 23 and name  HB3) (resid   24 and name   HN)
assign (resid  8 and name   HN) (resid   88 and name  HB2) 3.155 1.245 1.245 weight 1.000 
    or (resid  8 and name   HN) (resid   88 and name  HB1)
    or (resid  8 and name   HN) (resid   88 and name  HB3)
assign (resid 10 and name   HN) (resid   87 and name HG12) 2.682 0.899 0.899 weight 1.000 
    or (resid 10 and name   HN) (resid   87 and name HG11)
    or (resid 10 and name   HN) (resid   87 and name HG13)
assign (resid 63 and name   HN) (resid   63 and name HG22) 2.597 0.843 0.843 weight 1.000 
    or (resid 63 and name   HN) (resid   63 and name HG21)
    or (resid 63 and name   HN) (resid   63 and name HG23)
assign (resid 11 and name   HN) (resid   10 and name HG22) 2.259 0.638 0.638 weight 1.000 
    or (resid 11 and name   HN) (resid   10 and name HG21)
    or (resid 11 and name   HN) (resid   10 and name HG23)
assign (resid 87 and name   HN) (resid   87 and name HG12) 2.175 0.591 0.591 weight 1.000 
    or (resid 87 and name   HN) (resid   87 and name HG11)
    or (resid 87 and name   HN) (resid   87 and name HG13)
assign (resid 51 and name   HN) (resid   52 and name  HB2) 2.982 1.111 1.111 weight 1.000 
    or (resid 51 and name   HN) (resid   52 and name  HB1)
    or (resid 51 and name   HN) (resid   52 and name  HB3)
assign (resid 23 and name   HN) (resid   23 and name  HB2) 2.407 0.724 0.724 weight 1.000 
    or (resid 23 and name   HN) (resid   23 and name  HB1)
    or (resid 23 and name   HN) (resid   23 and name  HB3)
assign (resid 74 and name   HN) (resid   72 and name HG22) 2.458 0.755 0.755 weight 1.000 
    or (resid 74 and name   HN) (resid   72 and name HG21)
    or (resid 74 and name   HN) (resid   72 and name HG23)
assign (resid 88 and name   HN) (resid   88 and name  HB2) 2.147 0.576 0.576 weight 1.000 
    or (resid 88 and name   HN) (resid   88 and name  HB1)
    or (resid 88 and name   HN) (resid   88 and name  HB3)
assign (resid 49 and name   HN) (resid   49 and name  HB2) 2.060 0.530 0.530 weight 1.000 
    or (resid 49 and name   HN) (resid   49 and name  HB1)
    or (resid 49 and name   HN) (resid   49 and name  HB3)
assign (resid 49 and name   HN) (resid   10 and name HG22) 2.708 0.917 0.917 weight 1.000 
    or (resid 49 and name   HN) (resid   10 and name HG21)
    or (resid 49 and name   HN) (resid   10 and name HG23)
assign (resid 88 and name   HN) (resid   87 and name HG12) 2.912 1.060 1.060 weight 1.000 
    or (resid 88 and name   HN) (resid   87 and name HG11)
    or (resid 88 and name   HN) (resid   87 and name HG13)
assign (resid 33 and name   HN) (resid   33 and name HG12) 2.121 0.562 0.562 weight 1.000 
    or (resid 33 and name   HN) (resid   33 and name HG11)
    or (resid 33 and name   HN) (resid   33 and name HG13)
assign (resid 64 and name HD21) (resid   63 and name HG12) 2.533 0.802 0.802 weight 1.000 
    or (resid 64 and name HD21) (resid   63 and name HG11)
    or (resid 64 and name HD21) (resid   63 and name HG13)
    or (resid 64 and name HD22) (resid   63 and name HG12)
    or (resid 64 and name HD22) (resid   63 and name HG11)
    or (resid 64 and name HD22) (resid   63 and name HG13)
assign (resid 52 and name   HN) (resid   52 and name  HB2) 1.856 0.431 0.431 weight 1.000 
    or (resid 52 and name   HN) (resid   52 and name  HB1)
    or (resid 52 and name   HN) (resid   52 and name  HB3)
assign (resid 33 and name HG12) (resid   34 and name   HN) 2.724 0.928 0.928 weight 1.000 
    or (resid 33 and name HG11) (resid   34 and name   HN)
    or (resid 33 and name HG13) (resid   34 and name   HN)
assign (resid 33 and name HG22) (resid   34 and name   HN) 2.267 0.642 0.642 weight 1.000 
    or (resid 33 and name HG21) (resid   34 and name   HN)
    or (resid 33 and name HG23) (resid   34 and name   HN)
assign (resid 62 and name   HN) (resid   61 and name HG21) 2.729 0.931 0.931 weight 1.000 
    or (resid 62 and name   HN) (resid   61 and name HG22)
    or (resid 62 and name   HN) (resid   61 and name HG23)
assign (resid 53 and name   HN) (resid   52 and name  HB2) 2.539 0.806 0.806 weight 1.000 
    or (resid 53 and name   HN) (resid   52 and name  HB1)
    or (resid 53 and name   HN) (resid   52 and name  HB3)
assign (resid 40 and name HG12) (resid   58 and name   HN) 2.861 1.024 1.024 weight 1.000 
    or (resid 40 and name HG11) (resid   58 and name   HN)
    or (resid 40 and name HG13) (resid   58 and name   HN)
assign (resid 76 and name   HN) (resid   72 and name HG22) 2.677 0.896 0.896 weight 1.000 
    or (resid 76 and name   HN) (resid   72 and name HG21)
    or (resid 76 and name   HN) (resid   72 and name HG23)
assign (resid 23 and name  HB2) (resid   38 and name  HE1) 2.842 1.010 1.010 weight 1.000 
    or (resid 23 and name  HB1) (resid   38 and name  HE1)
    or (resid 23 and name  HB3) (resid   38 and name  HE1)
assign (resid 10 and name HG22) (resid   17 and name  HD1) 2.165 0.586 0.586 weight 1.000 
    or (resid 10 and name HG22) (resid   17 and name  HD2)
    or (resid 10 and name HG21) (resid   17 and name  HD1)
    or (resid 10 and name HG21) (resid   17 and name  HD2)
    or (resid 10 and name HG23) (resid   17 and name  HD1)
    or (resid 10 and name HG23) (resid   17 and name  HD2)
assign (resid 75 and name   HN) (resid   72 and name HG22) 1.979 0.490 0.490 weight 1.000 
    or (resid 75 and name   HN) (resid   72 and name HG21)
    or (resid 75 and name   HN) (resid   72 and name HG23)
assign (resid 49 and name  HB2) (resid   19 and name  HD1) 2.109 0.556 0.556 weight 1.000 
    or (resid 49 and name  HB2) (resid   19 and name  HD2)
    or (resid 49 and name  HB1) (resid   19 and name  HD1)
    or (resid 49 and name  HB1) (resid   19 and name  HD2)
    or (resid 49 and name  HB3) (resid   19 and name  HD1)
    or (resid 49 and name  HB3) (resid   19 and name  HD2)
assign (resid 26 and name HG22) (resid   37 and name  HD2) 2.529 0.799 0.799 weight 1.000 
    or (resid 26 and name HG21) (resid   37 and name  HD2)
    or (resid 26 and name HG23) (resid   37 and name  HD2)
assign (resid 87 and name HG12) (resid   17 and name  HD1) 2.646 0.875 0.875 weight 1.000 
    or (resid 87 and name HG12) (resid   17 and name  HD2)
    or (resid 87 and name HG11) (resid   17 and name  HD1)
    or (resid 87 and name HG11) (resid   17 and name  HD2)
    or (resid 87 and name HG13) (resid   17 and name  HD1)
    or (resid 87 and name HG13) (resid   17 and name  HD2)
assign (resid 87 and name HG12) (resid   17 and name  HE1) 2.556 0.817 0.817 weight 1.000 
    or (resid 87 and name HG12) (resid   17 and name  HE2)
    or (resid 87 and name HG11) (resid   17 and name  HE1)
    or (resid 87 and name HG11) (resid   17 and name  HE2)
    or (resid 87 and name HG13) (resid   17 and name  HE1)
    or (resid 87 and name HG13) (resid   17 and name  HE2)
assign (resid 23 and name  HB2) (resid   23 and name   HA) 3.124 1.220 1.220 weight 1.000 
    or (resid 23 and name  HB1) (resid   23 and name   HA)
    or (resid 23 and name  HB3) (resid   23 and name   HA)
assign (resid 61 and name HG21) (resid   61 and name   HB) 2.452 0.751 0.751 weight 1.000 
    or (resid 61 and name HG22) (resid   61 and name   HB)
    or (resid 61 and name HG23) (resid   61 and name   HB)
assign (resid 40 and name HG12) (resid   40 and name   HA) 2.538 0.805 0.805 weight 1.000 
    or (resid 40 and name HG11) (resid   40 and name   HA)
    or (resid 40 and name HG13) (resid   40 and name   HA)
assign (resid 63 and name HG12) (resid   80 and name   HA) 2.483 0.771 0.771 weight 1.000 
    or (resid 63 and name HG11) (resid   80 and name   HA)
    or (resid 63 and name HG13) (resid   80 and name   HA)
assign (resid 73 and name  HB1) (resid   23 and name  HB2) 2.659 0.884 0.884 weight 1.000 
    or (resid 73 and name  HB1) (resid   23 and name  HB1)
    or (resid 73 and name  HB1) (resid   23 and name  HB3)
assign (resid 19 and name  HB2) (resid   49 and name  HB2) 2.768 0.958 0.958 weight 1.000 
    or (resid 19 and name  HB2) (resid   49 and name  HB1)
    or (resid 19 and name  HB2) (resid   49 and name  HB3)
assign (resid 88 and name  HB2) (resid   64 and name  HB2) 3.031 1.149 1.149 weight 1.000 
    or (resid 88 and name  HB2) (resid   64 and name  HB1)
    or (resid 88 and name  HB1) (resid   64 and name  HB2)
    or (resid 88 and name  HB1) (resid   64 and name  HB1)
    or (resid 88 and name  HB3) (resid   64 and name  HB2)
    or (resid 88 and name  HB3) (resid   64 and name  HB1)
assign (resid 17 and name  HB2) (resid   49 and name  HB2) 2.919 1.065 1.065 weight 1.000 
    or (resid 17 and name  HB2) (resid   49 and name  HB1)
    or (resid 17 and name  HB2) (resid   49 and name  HB3)
assign (resid 17 and name  HB2) (resid   10 and name HG22) 2.567 0.824 0.824 weight 1.000 
    or (resid 17 and name  HB2) (resid   10 and name HG21)
    or (resid 17 and name  HB2) (resid   10 and name HG23)
assign (resid 64 and name  HB2) (resid   63 and name HG12) 2.666 0.888 0.888 weight 1.000 
    or (resid 64 and name  HB2) (resid   63 and name HG11)
    or (resid 64 and name  HB2) (resid   63 and name HG13)
    or (resid 64 and name  HB1) (resid   63 and name HG12)
    or (resid 64 and name  HB1) (resid   63 and name HG11)
    or (resid 64 and name  HB1) (resid   63 and name HG13)
assign (resid 13 and name  HB2) (resid   48 and name  HB1) 2.884 1.039 1.039 weight 1.000 
    or (resid 13 and name  HB1) (resid   48 and name  HB1)
    or (resid 13 and name  HB3) (resid   48 and name  HB1)
assign (resid 49 and name  HB2) (resid   19 and name  HB1) 2.397 0.718 0.718 weight 1.000 
    or (resid 49 and name  HB1) (resid   19 and name  HB1)
    or (resid 49 and name  HB3) (resid   19 and name  HB1)
assign (resid 28 and name  HG2) (resid   33 and name HG22) 2.670 0.891 0.891 weight 1.000 
    or (resid 28 and name  HG2) (resid   33 and name HG21)
    or (resid 28 and name  HG2) (resid   33 and name HG23)
assign (resid 58 and name  HB2) (resid   40 and name HG12) 2.499 0.780 0.780 weight 1.000 
    or (resid 58 and name  HB2) (resid   40 and name HG11)
    or (resid 58 and name  HB2) (resid   40 and name HG13)
assign (resid 72 and name   HB) (resid   72 and name HG22) 2.015 0.508 0.508 weight 1.000 
    or (resid 72 and name   HB) (resid   72 and name HG21)
    or (resid 72 and name   HB) (resid   72 and name HG23)
assign (resid 48 and name  HG2) (resid   13 and name  HB2) 2.507 0.786 0.786 weight 1.000 
    or (resid 48 and name  HG2) (resid   13 and name  HB1)
    or (resid 48 and name  HG2) (resid   13 and name  HB3)
assign (resid 49 and name  HB2) (resid   48 and name  HB2) 2.785 0.970 0.970 weight 1.000 
    or (resid 49 and name  HB1) (resid   48 and name  HB2)
    or (resid 49 and name  HB3) (resid   48 and name  HB2)
assign (resid 40 and name HG12) (resid   40 and name   HB) 1.996 0.498 0.498 weight 1.000 
    or (resid 40 and name HG11) (resid   40 and name   HB)
    or (resid 40 and name HG13) (resid   40 and name   HB)
assign (resid 48 and name  HG1) (resid   13 and name  HB2) 2.418 0.731 0.731 weight 1.000 
    or (resid 48 and name  HG1) (resid   13 and name  HB1)
    or (resid 48 and name  HG1) (resid   13 and name  HB3)
assign (resid 75 and name  HG2) (resid   72 and name HG22) 1.923 0.462 0.462 weight 1.000 
    or (resid 75 and name  HG2) (resid   72 and name HG21)
    or (resid 75 and name  HG2) (resid   72 and name HG23)
    or (resid 75 and name  HG1) (resid   72 and name HG22)
    or (resid 75 and name  HG1) (resid   72 and name HG21)
    or (resid 75 and name  HG1) (resid   72 and name HG23)
assign (resid  7 and name  HG2) (resid   88 and name  HB2) 2.149 0.577 0.577 weight 1.000 
    or (resid  7 and name  HG2) (resid   88 and name  HB1)
    or (resid  7 and name  HG2) (resid   88 and name  HB3)
assign (resid 33 and name HG12) (resid   33 and name   HB) 1.805 0.407 0.407 weight 1.000 
    or (resid 33 and name HG11) (resid   33 and name   HB)
    or (resid 33 and name HG13) (resid   33 and name   HB)
assign (resid 87 and name   HB) (resid   87 and name HG12) 2.079 0.540 0.540 weight 1.000 
    or (resid 87 and name   HB) (resid   87 and name HG11)
    or (resid 87 and name   HB) (resid   87 and name HG13)
assign (resid 63 and name HG22) (resid   63 and name   HB) 1.895 0.449 0.449 weight 1.000 
    or (resid 63 and name HG21) (resid   63 and name   HB)
    or (resid 63 and name HG23) (resid   63 and name   HB)
assign (resid 92 and name HG21) (resid   59 and name  HB2) 2.221 0.616 0.616 weight 1.000 
    or (resid 92 and name HG22) (resid   59 and name  HB2)
    or (resid 92 and name HG23) (resid   59 and name  HB2)
assign (resid 10 and name   HB) (resid   87 and name HG12) 2.026 0.513 0.513 weight 1.000 
    or (resid 10 and name   HB) (resid   87 and name HG11)
    or (resid 10 and name   HB) (resid   87 and name HG13)
assign (resid 59 and name  HB1) (resid   92 and name HG21) 2.288 0.654 0.654 weight 1.000 
    or (resid 59 and name  HB1) (resid   92 and name HG22)
    or (resid 59 and name  HB1) (resid   92 and name HG23)
assign (resid 89 and name HG12) (resid   87 and name HG12) 2.349 0.690 0.690 weight 1.000 
    or (resid 89 and name HG12) (resid   87 and name HG11)
    or (resid 89 and name HG12) (resid   87 and name HG13)
assign (resid 87 and name HG12) (resid   10 and name HG22) 2.439 0.744 0.744 weight 1.000 
    or (resid 87 and name HG12) (resid   10 and name HG21)
    or (resid 87 and name HG12) (resid   10 and name HG23)
    or (resid 87 and name HG11) (resid   10 and name HG22)
    or (resid 87 and name HG11) (resid   10 and name HG21)
    or (resid 87 and name HG11) (resid   10 and name HG23)
    or (resid 87 and name HG13) (resid   10 and name HG22)
    or (resid 87 and name HG13) (resid   10 and name HG21)
    or (resid 87 and name HG13) (resid   10 and name HG23)
assign (resid 88 and name  HB2) (resid    9 and name HD12) 1.847 0.426 0.426 weight 1.000 
    or (resid 88 and name  HB2) (resid    9 and name HD11)
    or (resid 88 and name  HB2) (resid    9 and name HD13)
    or (resid 88 and name  HB1) (resid    9 and name HD12)
    or (resid 88 and name  HB1) (resid    9 and name HD11)
    or (resid 88 and name  HB1) (resid    9 and name HD13)
    or (resid 88 and name  HB3) (resid    9 and name HD12)
    or (resid 88 and name  HB3) (resid    9 and name HD11)
    or (resid 88 and name  HB3) (resid    9 and name HD13)
assign (resid 36 and name HG22) (resid   23 and name  HB2) 2.023 0.512 0.512 weight 1.000 
    or (resid 36 and name HG22) (resid   23 and name  HB1)
    or (resid 36 and name HG22) (resid   23 and name  HB3)
    or (resid 36 and name HG21) (resid   23 and name  HB2)
    or (resid 36 and name HG21) (resid   23 and name  HB1)
    or (resid 36 and name HG21) (resid   23 and name  HB3)
    or (resid 36 and name HG23) (resid   23 and name  HB2)
    or (resid 36 and name HG23) (resid   23 and name  HB1)
    or (resid 36 and name HG23) (resid   23 and name  HB3)
assign (resid 87 and name HG22) (resid   87 and name HG12) 1.798 0.404 0.404 weight 1.000 
    or (resid 87 and name HG22) (resid   87 and name HG11)
    or (resid 87 and name HG22) (resid   87 and name HG13)
    or (resid 87 and name HG21) (resid   87 and name HG12)
    or (resid 87 and name HG21) (resid   87 and name HG11)
    or (resid 87 and name HG21) (resid   87 and name HG13)
    or (resid 87 and name HG23) (resid   87 and name HG12)
    or (resid 87 and name HG23) (resid   87 and name HG11)
    or (resid 87 and name HG23) (resid   87 and name HG13)
assign (resid 10 and name HG22) (resid   10 and name HG12) 1.788 0.400 0.400 weight 1.000 
    or (resid 10 and name HG21) (resid   10 and name HG12)
    or (resid 10 and name HG23) (resid   10 and name HG12)
assign (resid 54 and name HD12) (resid   49 and name  HB2) 1.987 0.493 0.493 weight 1.000 
    or (resid 54 and name HD12) (resid   49 and name  HB1)
    or (resid 54 and name HD12) (resid   49 and name  HB3)
    or (resid 54 and name HD11) (resid   49 and name  HB2)
    or (resid 54 and name HD11) (resid   49 and name  HB1)
    or (resid 54 and name HD11) (resid   49 and name  HB3)
    or (resid 54 and name HD13) (resid   49 and name  HB2)
    or (resid 54 and name HD13) (resid   49 and name  HB1)
    or (resid 54 and name HD13) (resid   49 and name  HB3)
assign (resid 40 and name HG12) (resid   54 and name HD12) 2.107 0.555 0.555 weight 1.000 
    or (resid 40 and name HG12) (resid   54 and name HD11)
    or (resid 40 and name HG12) (resid   54 and name HD13)
    or (resid 40 and name HG11) (resid   54 and name HD12)
    or (resid 40 and name HG11) (resid   54 and name HD11)
    or (resid 40 and name HG11) (resid   54 and name HD13)
    or (resid 40 and name HG13) (resid   54 and name HD12)
    or (resid 40 and name HG13) (resid   54 and name HD11)
    or (resid 40 and name HG13) (resid   54 and name HD13)
assign (resid 10 and name   HN) (resid    9 and name HG22) 2.455 0.754 0.754 weight 1.000 
    or (resid 10 and name   HN) (resid    9 and name HG21)
    or (resid 10 and name   HN) (resid    9 and name HG23)
assign (resid 49 and name  HB2) (resid   54 and name   HN) 2.730 0.932 0.932 weight 1.000 
    or (resid 49 and name  HB1) (resid   54 and name   HN)
    or (resid 49 and name  HB3) (resid   54 and name   HN)
assign (resid  8 and name HG22) (resid   54 and name   HN) 2.461 0.757 0.757 weight 1.000 
    or (resid  8 and name HG21) (resid   54 and name   HN)
    or (resid  8 and name HG23) (resid   54 and name   HN)
assign (resid 39 and name  HE2) (resid   41 and name  HE3) 2.606 0.849 0.849 weight 1.000 
    or (resid 39 and name  HE1) (resid   41 and name  HE3)
    or (resid 39 and name  HE3) (resid   41 and name  HE3)
assign (resid 39 and name  HE2) (resid   41 and name  HZ3) 2.632 0.866 0.866 weight 1.000 
    or (resid 39 and name  HE1) (resid   41 and name  HZ3)
    or (resid 39 and name  HE3) (resid   41 and name  HZ3)
assign (resid 80 and name HG22) (resid   83 and name  HB1) 2.991 1.118 1.118 weight 1.000 
    or (resid 80 and name HG21) (resid   83 and name  HB1)
    or (resid 80 and name HG23) (resid   83 and name  HB1)
assign (resid  8 and name HG22) (resid    8 and name   HA) 2.243 0.629 0.629 weight 1.000 
    or (resid  8 and name HG21) (resid    8 and name   HA)
    or (resid  8 and name HG23) (resid    8 and name   HA)
assign (resid  8 and name HG22) (resid   54 and name   HA) 2.688 0.903 0.903 weight 1.000 
    or (resid  8 and name HG21) (resid   54 and name   HA)
    or (resid  8 and name HG23) (resid   54 and name   HA)
assign (resid 80 and name   HA) (resid   80 and name HG22) 2.276 0.647 0.647 weight 1.000 
    or (resid 80 and name   HA) (resid   80 and name HG21)
    or (resid 80 and name   HA) (resid   80 and name HG23)
assign (resid 86 and name  HE2) (resid    9 and name HG22) 2.429 0.738 0.738 weight 1.000 
    or (resid 86 and name  HE2) (resid    9 and name HG21)
    or (resid 86 and name  HE2) (resid    9 and name HG23)
    or (resid 86 and name  HE1) (resid    9 and name HG22)
    or (resid 86 and name  HE1) (resid    9 and name HG21)
    or (resid 86 and name  HE1) (resid    9 and name HG23)
assign (resid 75 and name  HB1) (resid   72 and name HG22) 2.417 0.730 0.730 weight 1.000 
    or (resid 75 and name  HB1) (resid   72 and name HG21)
    or (resid 75 and name  HB1) (resid   72 and name HG23)
assign (resid  8 and name   HB) (resid    8 and name HG22) 1.866 0.435 0.435 weight 1.000 
    or (resid  8 and name   HB) (resid    8 and name HG21)
    or (resid  8 and name   HB) (resid    8 and name HG23)
assign (resid  9 and name   HB) (resid    9 and name HG22) 1.811 0.410 0.410 weight 1.000 
    or (resid  9 and name   HB) (resid    9 and name HG21)
    or (resid  9 and name   HB) (resid    9 and name HG23)
assign (resid 89 and name   HB) (resid   89 and name HG22) 1.880 0.442 0.442 weight 1.000 
    or (resid 89 and name   HB) (resid   89 and name HG21)
    or (resid 89 and name   HB) (resid   89 and name HG23)
assign (resid 60 and name   HB) (resid   60 and name HG22) 1.817 0.413 0.413 weight 1.000 
    or (resid 60 and name   HB) (resid   60 and name HG21)
    or (resid 60 and name   HB) (resid   60 and name HG23)
assign (resid 39 and name  HE2) (resid   24 and name HG12) 2.610 0.851 0.851 weight 1.000 
    or (resid 39 and name  HE1) (resid   24 and name HG12)
    or (resid 39 and name  HE3) (resid   24 and name HG12)
assign (resid  8 and name HG22) (resid   52 and name  HB2) 1.711 0.366 0.366 weight 1.000 
    or (resid  8 and name HG22) (resid   52 and name  HB1)
    or (resid  8 and name HG22) (resid   52 and name  HB3)
    or (resid  8 and name HG21) (resid   52 and name  HB2)
    or (resid  8 and name HG21) (resid   52 and name  HB1)
    or (resid  8 and name HG21) (resid   52 and name  HB3)
    or (resid  8 and name HG23) (resid   52 and name  HB2)
    or (resid  8 and name HG23) (resid   52 and name  HB1)
    or (resid  8 and name HG23) (resid   52 and name  HB3)
assign (resid  9 and name HG22) (resid    9 and name HG12) 1.851 0.428 0.428 weight 1.000 
    or (resid  9 and name HG21) (resid    9 and name HG12)
    or (resid  9 and name HG23) (resid    9 and name HG12)
assign (resid  9 and name HG22) (resid    9 and name HG11) 1.972 0.486 0.486 weight 1.000 
    or (resid  9 and name HG21) (resid    9 and name HG11)
    or (resid  9 and name HG23) (resid    9 and name HG11)
assign (resid 49 and name  HB2) (resid   10 and name HG22) 2.268 0.643 0.643 weight 1.000 
    or (resid 49 and name  HB2) (resid   10 and name HG21)
    or (resid 49 and name  HB2) (resid   10 and name HG23)
    or (resid 49 and name  HB1) (resid   10 and name HG22)
    or (resid 49 and name  HB1) (resid   10 and name HG21)
    or (resid 49 and name  HB1) (resid   10 and name HG23)
    or (resid 49 and name  HB3) (resid   10 and name HG22)
    or (resid 49 and name  HB3) (resid   10 and name HG21)
    or (resid 49 and name  HB3) (resid   10 and name HG23)
assign (resid 89 and name HG11) (resid   89 and name HG22) 2.204 0.607 0.607 weight 1.000 
    or (resid 89 and name HG11) (resid   89 and name HG21)
    or (resid 89 and name HG11) (resid   89 and name HG23)
assign (resid 39 and name  HE2) (resid   24 and name HD12) 1.837 0.422 0.422 weight 1.000 
    or (resid 39 and name  HE2) (resid   24 and name HD11)
    or (resid 39 and name  HE2) (resid   24 and name HD13)
    or (resid 39 and name  HE1) (resid   24 and name HD12)
    or (resid 39 and name  HE1) (resid   24 and name HD11)
    or (resid 39 and name  HE1) (resid   24 and name HD13)
    or (resid 39 and name  HE3) (resid   24 and name HD12)
    or (resid 39 and name  HE3) (resid   24 and name HD11)
    or (resid 39 and name  HE3) (resid   24 and name HD13)
assign (resid 43 and name HG12) (resid   49 and name  HB2) 1.912 0.457 0.457 weight 1.000 
    or (resid 43 and name HG12) (resid   49 and name  HB1)
    or (resid 43 and name HG12) (resid   49 and name  HB3)
    or (resid 43 and name HG11) (resid   49 and name  HB2)
    or (resid 43 and name HG11) (resid   49 and name  HB1)
    or (resid 43 and name HG11) (resid   49 and name  HB3)
    or (resid 43 and name HG13) (resid   49 and name  HB2)
    or (resid 43 and name HG13) (resid   49 and name  HB1)
    or (resid 43 and name HG13) (resid   49 and name  HB3)
assign (resid 80 and name HG22) (resid   87 and name HG12) 2.326 0.676 0.676 weight 1.000 
    or (resid 80 and name HG22) (resid   87 and name HG11)
    or (resid 80 and name HG22) (resid   87 and name HG13)
    or (resid 80 and name HG21) (resid   87 and name HG12)
    or (resid 80 and name HG21) (resid   87 and name HG11)
    or (resid 80 and name HG21) (resid   87 and name HG13)
    or (resid 80 and name HG23) (resid   87 and name HG12)
    or (resid 80 and name HG23) (resid   87 and name HG11)
    or (resid 80 and name HG23) (resid   87 and name HG13)
assign (resid 60 and name   HN) (resid   60 and name HD12) 2.646 0.875 0.875 weight 1.000 
    or (resid 60 and name   HN) (resid   60 and name HD11)
    or (resid 60 and name   HN) (resid   60 and name HD13)
assign (resid 80 and name HD12) (resid   81 and name   HN) 2.891 1.045 1.045 weight 1.000 
    or (resid 80 and name HD11) (resid   81 and name   HN)
    or (resid 80 and name HD13) (resid   81 and name   HN)
assign (resid 10 and name HD12) (resid   10 and name   HN) 2.857 1.020 1.020 weight 1.000 
    or (resid 10 and name HD11) (resid   10 and name   HN)
    or (resid 10 and name HD13) (resid   10 and name   HN)
assign (resid 54 and name   HN) (resid   10 and name HD12) 3.060 1.170 1.170 weight 1.000 
    or (resid 54 and name   HN) (resid   10 and name HD11)
    or (resid 54 and name   HN) (resid   10 and name HD13)
assign (resid 60 and name HD12) (resid   19 and name  HE1) 2.289 0.655 0.655 weight 1.000 
    or (resid 60 and name HD12) (resid   19 and name  HE2)
    or (resid 60 and name HD11) (resid   19 and name  HE1)
    or (resid 60 and name HD11) (resid   19 and name  HE2)
    or (resid 60 and name HD13) (resid   19 and name  HE1)
    or (resid 60 and name HD13) (resid   19 and name  HE2)
assign (resid 10 and name HD12) (resid   19 and name  HE1) 2.352 0.692 0.692 weight 1.000 
    or (resid 10 and name HD12) (resid   19 and name  HE2)
    or (resid 10 and name HD11) (resid   19 and name  HE1)
    or (resid 10 and name HD11) (resid   19 and name  HE2)
    or (resid 10 and name HD13) (resid   19 and name  HE1)
    or (resid 10 and name HD13) (resid   19 and name  HE2)
assign (resid 10 and name HD12) (resid   10 and name   HA) 3.060 1.170 1.170 weight 1.000 
    or (resid 10 and name HD11) (resid   10 and name   HA)
    or (resid 10 and name HD13) (resid   10 and name   HA)
assign (resid 10 and name HD12) (resid   49 and name   HA) 2.416 0.729 0.729 weight 1.000 
    or (resid 10 and name HD11) (resid   49 and name   HA)
    or (resid 10 and name HD13) (resid   49 and name   HA)
assign (resid 76 and name   HA) (resid   80 and name HD12) 3.020 1.140 1.140 weight 1.000 
    or (resid 76 and name   HA) (resid   80 and name HD11)
    or (resid 76 and name   HA) (resid   80 and name HD13)
assign (resid 77 and name   HA) (resid   80 and name HD12) 2.366 0.700 0.700 weight 1.000 
    or (resid 77 and name   HA) (resid   80 and name HD11)
    or (resid 77 and name   HA) (resid   80 and name HD13)
assign (resid 38 and name  HB2) (resid   60 and name HD12) 2.982 1.111 1.111 weight 1.000 
    or (resid 38 and name  HB2) (resid   60 and name HD11)
    or (resid 38 and name  HB2) (resid   60 and name HD13)
assign (resid 10 and name HD12) (resid   17 and name  HB2) 2.963 1.097 1.097 weight 1.000 
    or (resid 10 and name HD11) (resid   17 and name  HB2)
    or (resid 10 and name HD13) (resid   17 and name  HB2)
assign (resid 37 and name  HB1) (resid   24 and name HD12) 2.772 0.960 0.960 weight 1.000 
    or (resid 37 and name  HB1) (resid   24 and name HD11)
    or (resid 37 and name  HB1) (resid   24 and name HD13)
assign (resid 80 and name HG12) (resid   80 and name HD12) 1.779 0.396 0.396 weight 1.000 
    or (resid 80 and name HG12) (resid   80 and name HD11)
    or (resid 80 and name HG12) (resid   80 and name HD13)
assign (resid 10 and name HD12) (resid    8 and name   HB) 2.500 0.781 0.781 weight 1.000 
    or (resid 10 and name HD11) (resid    8 and name   HB)
    or (resid 10 and name HD13) (resid    8 and name   HB)
assign (resid 10 and name HD12) (resid   10 and name HG11) 1.739 0.378 0.378 weight 1.000 
    or (resid 10 and name HD11) (resid   10 and name HG11)
    or (resid 10 and name HD13) (resid   10 and name HG11)
assign (resid 10 and name HD12) (resid   10 and name HG22) 1.909 0.456 0.456 weight 1.000 
    or (resid 10 and name HD12) (resid   10 and name HG21)
    or (resid 10 and name HD12) (resid   10 and name HG23)
    or (resid 10 and name HD11) (resid   10 and name HG22)
    or (resid 10 and name HD11) (resid   10 and name HG21)
    or (resid 10 and name HD11) (resid   10 and name HG23)
    or (resid 10 and name HD13) (resid   10 and name HG22)
    or (resid 10 and name HD13) (resid   10 and name HG21)
    or (resid 10 and name HD13) (resid   10 and name HG23)
assign (resid 77 and name HG22) (resid   80 and name HD12) 2.668 0.890 0.890 weight 1.000 
    or (resid 77 and name HG22) (resid   80 and name HD11)
    or (resid 77 and name HG22) (resid   80 and name HD13)
    or (resid 77 and name HG21) (resid   80 and name HD12)
    or (resid 77 and name HG21) (resid   80 and name HD11)
    or (resid 77 and name HG21) (resid   80 and name HD13)
    or (resid 77 and name HG23) (resid   80 and name HD12)
    or (resid 77 and name HG23) (resid   80 and name HD11)
    or (resid 77 and name HG23) (resid   80 and name HD13)
assign (resid 60 and name HD12) (resid   54 and name HD12) 2.801 0.981 0.981 weight 1.000 
    or (resid 60 and name HD12) (resid   54 and name HD11)
    or (resid 60 and name HD12) (resid   54 and name HD13)
    or (resid 60 and name HD11) (resid   54 and name HD12)
    or (resid 60 and name HD11) (resid   54 and name HD11)
    or (resid 60 and name HD11) (resid   54 and name HD13)
    or (resid 60 and name HD13) (resid   54 and name HD12)
    or (resid 60 and name HD13) (resid   54 and name HD11)
    or (resid 60 and name HD13) (resid   54 and name HD13)
assign (resid 54 and name HD12) (resid   10 and name HD12) 2.115 0.559 0.559 weight 1.000 
    or (resid 54 and name HD12) (resid   10 and name HD11)
    or (resid 54 and name HD12) (resid   10 and name HD13)
    or (resid 54 and name HD11) (resid   10 and name HD12)
    or (resid 54 and name HD11) (resid   10 and name HD11)
    or (resid 54 and name HD11) (resid   10 and name HD13)
    or (resid 54 and name HD13) (resid   10 and name HD12)
    or (resid 54 and name HD13) (resid   10 and name HD11)
    or (resid 54 and name HD13) (resid   10 and name HD13)
assign (resid  8 and name   HN) (resid    8 and name HD12) 2.759 0.951 0.951 weight 1.000 
    or (resid  8 and name   HN) (resid    8 and name HD11)
    or (resid  8 and name   HN) (resid    8 and name HD13)
assign (resid  9 and name HD12) (resid    9 and name   HN) 2.527 0.798 0.798 weight 1.000 
    or (resid  9 and name HD11) (resid    9 and name   HN)
    or (resid  9 and name HD13) (resid    9 and name   HN)
assign (resid  8 and name HD12) (resid   55 and name   HN) 2.886 1.041 1.041 weight 1.000 
    or (resid  8 and name HD11) (resid   55 and name   HN)
    or (resid  8 and name HD13) (resid   55 and name   HN)
assign (resid  8 and name HD12) (resid   54 and name   HN) 2.925 1.069 1.069 weight 1.000 
    or (resid  8 and name HD11) (resid   54 and name   HN)
    or (resid  8 and name HD13) (resid   54 and name   HN)
assign (resid 89 and name HD12) (resid   19 and name  HE1) 2.104 0.553 0.553 weight 1.000 
    or (resid 89 and name HD12) (resid   19 and name  HE2)
    or (resid 89 and name HD11) (resid   19 and name  HE1)
    or (resid 89 and name HD11) (resid   19 and name  HE2)
    or (resid 89 and name HD13) (resid   19 and name  HE1)
    or (resid 89 and name HD13) (resid   19 and name  HE2)
assign (resid  8 and name HD12) (resid   54 and name   HA) 2.334 0.681 0.681 weight 1.000 
    or (resid  8 and name HD11) (resid   54 and name   HA)
    or (resid  8 and name HD13) (resid   54 and name   HA)
assign (resid 89 and name HD12) (resid   80 and name HG12) 2.427 0.736 0.736 weight 1.000 
    or (resid 89 and name HD11) (resid   80 and name HG12)
    or (resid 89 and name HD13) (resid   80 and name HG12)
assign (resid 89 and name HD12) (resid   89 and name   HB) 2.229 0.621 0.621 weight 1.000 
    or (resid 89 and name HD11) (resid   89 and name   HB)
    or (resid 89 and name HD13) (resid   89 and name   HB)
assign (resid  9 and name HG11) (resid    9 and name HD12) 1.849 0.427 0.427 weight 1.000 
    or (resid  9 and name HG11) (resid    9 and name HD11)
    or (resid  9 and name HG11) (resid    9 and name HD13)
assign (resid 89 and name HD12) (resid   89 and name HG12) 2.068 0.535 0.535 weight 1.000 
    or (resid 89 and name HD11) (resid   89 and name HG12)
    or (resid 89 and name HD13) (resid   89 and name HG12)
assign (resid 89 and name HD12) (resid   87 and name HG12) 2.080 0.541 0.541 weight 1.000 
    or (resid 89 and name HD12) (resid   87 and name HG11)
    or (resid 89 and name HD12) (resid   87 and name HG13)
    or (resid 89 and name HD11) (resid   87 and name HG12)
    or (resid 89 and name HD11) (resid   87 and name HG11)
    or (resid 89 and name HD11) (resid   87 and name HG13)
    or (resid 89 and name HD13) (resid   87 and name HG12)
    or (resid 89 and name HD13) (resid   87 and name HG11)
    or (resid 89 and name HD13) (resid   87 and name HG13)
assign (resid 89 and name HD12) (resid   54 and name HD12) 2.578 0.831 0.831 weight 1.000 
    or (resid 89 and name HD12) (resid   54 and name HD11)
    or (resid 89 and name HD12) (resid   54 and name HD13)
    or (resid 89 and name HD11) (resid   54 and name HD12)
    or (resid 89 and name HD11) (resid   54 and name HD11)
    or (resid 89 and name HD11) (resid   54 and name HD13)
    or (resid 89 and name HD13) (resid   54 and name HD12)
    or (resid 89 and name HD13) (resid   54 and name HD11)
    or (resid 89 and name HD13) (resid   54 and name HD13)
assign (resid 41 and name  HB2) (resid   42 and name   HN) 3.122 1.218 1.218 weight 1.000 
assign (resid  6 and name  HB2) (resid    6 and name  HD2) 3.065 1.174 1.174 weight 1.000 
assign (resid 48 and name  HD2) (resid   49 and name   HN) 3.284 1.348 1.348 weight 1.000 
assign (resid 54 and name   HG) (resid   54 and name   HN) 3.235 1.309 1.309 weight 1.000 
assign (resid 96 and name  HB2) (resid   96 and name   HN) 3.037 1.153 1.153 weight 1.000 
assign (resid 35 and name   HB) (resid   37 and name  HD2) 3.179 1.263 1.263 weight 1.000 
assign (resid 35 and name   HB) (resid   28 and name  HG2) 3.133 1.227 1.227 weight 1.000 
assign (resid 35 and name   HB) (resid   26 and name HG22) 3.037 1.153 1.153 weight 1.000 
    or (resid 35 and name   HB) (resid   26 and name HG21)
    or (resid 35 and name   HB) (resid   26 and name HG23)
assign (resid 72 and name   HB) (resid   75 and name   HN) 3.350 1.403 1.403 weight 1.000 
assign (resid 61 and name   HA) (resid   62 and name   HN) 2.968 1.101 1.101 weight 1.000 
assign (resid  6 and name   HA) (resid    6 and name  HG1) 2.891 1.045 1.045 weight 1.000 
assign (resid 28 and name   HA) (resid   28 and name  HB2) 2.352 0.691 0.691 weight 1.000 
assign (resid  5 and name   HA) (resid    5 and name  HB2) 2.273 0.646 0.646 weight 1.000 
assign (resid 88 and name   HA) (resid    7 and name  HB1) 2.716 0.922 0.922 weight 1.000 
assign (resid 60 and name HD12) (resid   60 and name   HB) 1.884 0.444 0.444 weight 1.000 
    or (resid 60 and name HD11) (resid   60 and name   HB)
    or (resid 60 and name HD13) (resid   60 and name   HB)
assign (resid 22 and name  HB1) (resid   22 and name   HN) 3.099 1.201 1.201 weight 1.000 
assign (resid 41 and name  HB2) (resid   22 and name  HB2) 3.262 1.330 1.330 weight 1.000 
assign (resid 86 and name  HB2) (resid   86 and name   HN) 3.187 1.270 1.270 weight 1.000 
assign (resid 86 and name   HN) (resid   86 and name  HB1) 3.209 1.287 1.287 weight 1.000 
assign (resid 28 and name  HG1) (resid   28 and name  HB2) 1.864 0.434 0.434 weight 1.000 
assign (resid 28 and name  HG1) (resid   28 and name  HB1) 1.942 0.471 0.471 weight 1.000 
assign (resid 95 and name  HB2) (resid   95 and name   HN) 3.074 1.181 1.181 weight 1.000 
assign (resid 12 and name  HG1) (resid   12 and name   HN) 3.063 1.173 1.173 weight 1.000 
assign (resid 55 and name   HN) (resid   54 and name HD12) 3.118 1.215 1.215 weight 1.000 
    or (resid 55 and name   HN) (resid   54 and name HD11)
    or (resid 55 and name   HN) (resid   54 and name HD13)
assign (resid 54 and name HD12) (resid   40 and name   HB) 3.135 1.228 1.228 weight 1.000 
    or (resid 54 and name HD11) (resid   40 and name   HB)
    or (resid 54 and name HD13) (resid   40 and name   HB)
assign (resid 54 and name HD12) (resid   19 and name  HE1) 2.682 0.899 0.899 weight 1.000 
    or (resid 54 and name HD12) (resid   19 and name  HE2)
    or (resid 54 and name HD11) (resid   19 and name  HE1)
    or (resid 54 and name HD11) (resid   19 and name  HE2)
    or (resid 54 and name HD13) (resid   19 and name  HE1)
    or (resid 54 and name HD13) (resid   19 and name  HE2)
assign (resid 86 and name  HG1) (resid   86 and name  HB1) 2.247 0.631 0.631 weight 1.000 
assign (resid 86 and name  HG2) (resid   86 and name  HB1) 2.053 0.527 0.527 weight 1.000 
assign (resid 35 and name HG21) (resid   28 and name  HG2) 2.969 1.102 1.102 weight 1.000 
    or (resid 35 and name HG22) (resid   28 and name  HG2)
    or (resid 35 and name HG23) (resid   28 and name  HG2)
assign (resid 23 and name  HB2) (resid   22 and name   HA) 3.122 1.218 1.218 weight 1.000 
    or (resid 23 and name  HB1) (resid   22 and name   HA)
    or (resid 23 and name  HB3) (resid   22 and name   HA)
assign (resid 86 and name  HB2) (resid    9 and name HG22) 2.363 0.698 0.698 weight 1.000 
    or (resid 86 and name  HB2) (resid    9 and name HG21)
    or (resid 86 and name  HB2) (resid    9 and name HG23)
assign (resid 10 and name HD12) (resid   19 and name  HD1) 2.420 0.732 0.732 weight 1.000 
    or (resid 10 and name HD12) (resid   19 and name  HD2)
    or (resid 10 and name HD11) (resid   19 and name  HD1)
    or (resid 10 and name HD11) (resid   19 and name  HD2)
    or (resid 10 and name HD13) (resid   19 and name  HD1)
    or (resid 10 and name HD13) (resid   19 and name  HD2)
assign (resid  8 and name HG12) (resid    8 and name HD12) 1.751 0.383 0.383 weight 1.000 
    or (resid  8 and name HG12) (resid    8 and name HD11)
    or (resid  8 and name HG12) (resid    8 and name HD13)
assign (resid 60 and name HG22) (resid   60 and name   HA) 1.989 0.494 0.494 weight 1.000 
    or (resid 60 and name HG21) (resid   60 and name   HA)
    or (resid 60 and name HG23) (resid   60 and name   HA)
assign (resid 31 and name   HA) (resid   31 and name  HB1) 2.728 0.930 0.930 weight 1.000 
assign (resid 78 and name  HB2) (resid   78 and name   HA) 2.051 0.526 0.526 weight 1.000 
assign (resid 78 and name   HA) (resid   78 and name  HG1) 2.373 0.704 0.704 weight 1.000 
assign (resid 82 and name   HA) (resid   82 and name  HG1) 2.235 0.624 0.624 weight 1.000 
assign (resid 69 and name   HA) (resid   69 and name  HB1) 2.592 0.840 0.840 weight 1.000 
assign (resid 12 and name  HB1) (resid   12 and name  HD2) 2.449 0.750 0.750 weight 1.000 
assign (resid 16 and name  HE2) (resid   16 and name  HB1) 2.591 0.839 0.839 weight 1.000 
    or (resid 16 and name  HE1) (resid   16 and name  HB1)
assign (resid 11 and name   HA) (resid   11 and name  HB1) 2.542 0.807 0.807 weight 1.000 
assign (resid 34 and name   HA) (resid   34 and name  HB1) 2.641 0.872 0.872 weight 1.000 
assign (resid 12 and name  HB2) (resid   12 and name  HD1) 2.426 0.736 0.736 weight 1.000 
assign (resid 52 and name  HB2) (resid   49 and name   HA) 2.033 0.516 0.516 weight 1.000 
    or (resid 52 and name  HB1) (resid   49 and name   HA)
    or (resid 52 and name  HB3) (resid   49 and name   HA)
assign (resid 41 and name  HB1) (resid   22 and name  HD1) 2.807 0.985 0.985 weight 1.000 
assign (resid 28 and name   HA) (resid   28 and name  HG2) 2.940 1.080 1.080 weight 1.000 
assign (resid 89 and name HD12) (resid   89 and name HG11) 2.103 0.553 0.553 weight 1.000 
    or (resid 89 and name HD11) (resid   89 and name HG11)
    or (resid 89 and name HD13) (resid   89 and name HG11)
assign (resid 80 and name   HA) (resid   80 and name HG12) 2.222 0.617 0.617 weight 1.000 
assign (resid 63 and name   HA) (resid   63 and name HG12) 2.059 0.530 0.530 weight 1.000 
    or (resid 63 and name   HA) (resid   63 and name HG11)
    or (resid 63 and name   HA) (resid   63 and name HG13)
assign (resid 79 and name  HB2) (resid   79 and name HD12) 2.184 0.596 0.596 weight 1.000 
    or (resid 79 and name  HB2) (resid   79 and name HD11)
    or (resid 79 and name  HB2) (resid   79 and name HD13)
assign (resid 79 and name   HG) (resid   79 and name HD12) 1.958 0.479 0.479 weight 1.000 
    or (resid 79 and name   HG) (resid   79 and name HD11)
    or (resid 79 and name   HG) (resid   79 and name HD13)
assign (resid 94 and name HD22) (resid   39 and name  HE2) 1.918 0.460 0.460 weight 1.000 
    or (resid 94 and name HD22) (resid   39 and name  HE1)
    or (resid 94 and name HD22) (resid   39 and name  HE3)
    or (resid 94 and name HD21) (resid   39 and name  HE2)
    or (resid 94 and name HD21) (resid   39 and name  HE1)
    or (resid 94 and name HD21) (resid   39 and name  HE3)
    or (resid 94 and name HD23) (resid   39 and name  HE2)
    or (resid 94 and name HD23) (resid   39 and name  HE1)
    or (resid 94 and name HD23) (resid   39 and name  HE3)
    or (resid 94 and name HD12) (resid   39 and name  HE2)
    or (resid 94 and name HD12) (resid   39 and name  HE1)
    or (resid 94 and name HD12) (resid   39 and name  HE3)
    or (resid 94 and name HD11) (resid   39 and name  HE2)
    or (resid 94 and name HD11) (resid   39 and name  HE1)
    or (resid 94 and name HD11) (resid   39 and name  HE3)
    or (resid 94 and name HD13) (resid   39 and name  HE2)
    or (resid 94 and name HD13) (resid   39 and name  HE1)
    or (resid 94 and name HD13) (resid   39 and name  HE3)
assign (resid 79 and name HD22) (resid   76 and name   HA) 2.106 0.554 0.554 weight 1.000 
    or (resid 79 and name HD21) (resid   76 and name   HA)
    or (resid 79 and name HD23) (resid   76 and name   HA)
assign (resid  9 and name HG22) (resid   11 and name  HD2) 3.171 1.257 1.257 weight 1.000 
    or (resid  9 and name HG21) (resid   11 and name  HD2)
    or (resid  9 and name HG23) (resid   11 and name  HD2)
assign (resid 59 and name   HA) (resid   59 and name  HB2) 2.843 1.011 1.011 weight 1.000 
assign (resid 27 and name   HN) (resid   27 and name  HD1) 2.944 1.083 1.083 weight 1.000 
    or (resid 27 and name   HN) (resid   27 and name  HD2)
assign (resid 36 and name HG12) (resid   34 and name  HD1) 2.525 0.797 0.797 weight 1.000 
    or (resid 36 and name HG12) (resid   34 and name  HD2)
    or (resid 36 and name HG11) (resid   34 and name  HD1)
    or (resid 36 and name HG11) (resid   34 and name  HD2)
    or (resid 36 and name HG13) (resid   34 and name  HD1)
    or (resid 36 and name HG13) (resid   34 and name  HD2)
assign (resid 17 and name  HD1) (resid   17 and name   HN) 3.029 1.147 1.147 weight 1.000 
    or (resid 17 and name  HD2) (resid   17 and name   HN)
assign (resid 20 and name   HN) (resid   19 and name  HD1) 3.106 1.206 1.206 weight 1.000 
    or (resid 20 and name   HN) (resid   19 and name  HD2)
assign (resid 80 and name HG22) (resid   17 and name  HD1) 2.264 0.641 0.641 weight 1.000 
    or (resid 80 and name HG22) (resid   17 and name  HD2)
    or (resid 80 and name HG21) (resid   17 and name  HD1)
    or (resid 80 and name HG21) (resid   17 and name  HD2)
    or (resid 80 and name HG23) (resid   17 and name  HD1)
    or (resid 80 and name HG23) (resid   17 and name  HD2)
assign (resid 40 and name HG22) (resid   19 and name  HD1) 2.389 0.713 0.713 weight 1.000 
    or (resid 40 and name HG22) (resid   19 and name  HD2)
    or (resid 40 and name HG21) (resid   19 and name  HD1)
    or (resid 40 and name HG21) (resid   19 and name  HD2)
    or (resid 40 and name HG23) (resid   19 and name  HD1)
    or (resid 40 and name HG23) (resid   19 and name  HD2)
assign (resid 19 and name  HE1) (resid   17 and name  HB2) 3.141 1.234 1.234 weight 1.000 
    or (resid 19 and name  HE2) (resid   17 and name  HB2)
assign (resid 19 and name  HE1) (resid   17 and name  HB1) 3.166 1.253 1.253 weight 1.000 
    or (resid 19 and name  HE2) (resid   17 and name  HB1)
assign (resid 19 and name  HE1) (resid   49 and name  HB2) 3.053 1.165 1.165 weight 1.000 
    or (resid 19 and name  HE1) (resid   49 and name  HB1)
    or (resid 19 and name  HE1) (resid   49 and name  HB3)
    or (resid 19 and name  HE2) (resid   49 and name  HB2)
    or (resid 19 and name  HE2) (resid   49 and name  HB1)
    or (resid 19 and name  HE2) (resid   49 and name  HB3)
assign (resid 19 and name  HE1) (resid   87 and name HG12) 3.263 1.330 1.330 weight 1.000 
    or (resid 19 and name  HE1) (resid   87 and name HG11)
    or (resid 19 and name  HE1) (resid   87 and name HG13)
    or (resid 19 and name  HE2) (resid   87 and name HG12)
    or (resid 19 and name  HE2) (resid   87 and name HG11)
    or (resid 19 and name  HE2) (resid   87 and name HG13)
assign (resid 73 and name  HD2) (resid   77 and name HG22) 3.263 1.330 1.330 weight 1.000 
    or (resid 73 and name  HD2) (resid   77 and name HG21)
    or (resid 73 and name  HD2) (resid   77 and name HG23)
assign (resid 41 and name  HB2) (resid   41 and name  HD1) 3.198 1.278 1.278 weight 1.000 
assign (resid 41 and name  HB1) (resid   41 and name  HD1) 2.823 0.996 0.996 weight 1.000 
assign (resid 20 and name HG21) (resid   41 and name  HD1) 2.397 0.718 0.718 weight 1.000 
    or (resid 20 and name HG22) (resid   41 and name  HD1)
    or (resid 20 and name HG23) (resid   41 and name  HD1)
assign (resid 41 and name  HZ3) (resid   41 and name  HE3) 2.317 0.671 0.671 weight 1.000 
assign (resid 24 and name HG22) (resid   41 and name  HZ3) 3.059 1.170 1.170 weight 1.000 
    or (resid 24 and name HG21) (resid   41 and name  HZ3)
    or (resid 24 and name HG23) (resid   41 and name  HZ3)
assign (resid 11 and name   HN) (resid   11 and name  HD2) 2.905 1.055 1.055 weight 1.000 
assign (resid 11 and name  HB1) (resid   11 and name  HD2) 2.651 0.878 0.878 weight 1.000 
assign (resid 41 and name  HE3) (resid   39 and name  HG2) 3.195 1.276 1.276 weight 1.000 
    or (resid 41 and name  HE3) (resid   39 and name  HG1)
assign (resid 26 and name   HB) (resid   37 and name  HD2) 2.797 0.978 0.978 weight 1.000 
assign (resid 41 and name  HE3) (resid   22 and name  HB1) 3.106 1.206 1.206 weight 1.000 
assign (resid 87 and name   HN) (resid   17 and name  HE1) 2.893 1.046 1.046 weight 1.000 
    or (resid 87 and name   HN) (resid   17 and name  HE2)
assign (resid 17 and name  HE1) (resid   12 and name   HN) 2.988 1.116 1.116 weight 1.000 
    or (resid 17 and name  HE2) (resid   12 and name   HN)
assign (resid 34 and name   HN) (resid   34 and name  HE1) 3.091 1.194 1.194 weight 1.000 
    or (resid 34 and name   HN) (resid   34 and name  HE2)
assign (resid 17 and name  HD1) (resid   17 and name  HE1) 1.958 0.479 0.479 weight 1.000 
    or (resid 17 and name  HD1) (resid   17 and name  HE2)
    or (resid 17 and name  HD2) (resid   17 and name  HE1)
    or (resid 17 and name  HD2) (resid   17 and name  HE2)
assign (resid 27 and name  HD1) (resid   27 and name  HE1) 2.035 0.518 0.518 weight 1.000 
    or (resid 27 and name  HD1) (resid   27 and name  HE2)
    or (resid 27 and name  HD2) (resid   27 and name  HE1)
    or (resid 27 and name  HD2) (resid   27 and name  HE2)
assign (resid 27 and name  HE1) (resid   27 and name  HB1) 3.204 1.283 1.283 weight 1.000 
    or (resid 27 and name  HE2) (resid   27 and name  HB1)
assign (resid 38 and name  HD2) (resid   68 and name   HB) 3.169 1.255 1.255 weight 1.000 
assign (resid 17 and name  HE1) (resid   81 and name   HG) 2.888 1.043 1.043 weight 1.000 
    or (resid 17 and name  HE2) (resid   81 and name   HG)
assign (resid 17 and name  HE1) (resid   12 and name  HB1) 2.782 0.968 0.968 weight 1.000 
    or (resid 17 and name  HE2) (resid   12 and name  HB1)
assign (resid 80 and name HG22) (resid   17 and name  HE1) 2.136 0.571 0.571 weight 1.000 
    or (resid 80 and name HG22) (resid   17 and name  HE2)
    or (resid 80 and name HG21) (resid   17 and name  HE1)
    or (resid 80 and name HG21) (resid   17 and name  HE2)
    or (resid 80 and name HG23) (resid   17 and name  HE1)
    or (resid 80 and name HG23) (resid   17 and name  HE2)
assign (resid 38 and name  HD2) (resid   68 and name HG22) 2.314 0.670 0.670 weight 1.000 
    or (resid 38 and name  HD2) (resid   68 and name HG21)
    or (resid 38 and name  HD2) (resid   68 and name HG23)
    or (resid 38 and name  HD2) (resid   68 and name HG12)
    or (resid 38 and name  HD2) (resid   68 and name HG11)
    or (resid 38 and name  HD2) (resid   68 and name HG13)
assign (resid 41 and name  HH2) (resid   41 and name  HZ2) 2.222 0.617 0.617 weight 1.000 
assign (resid 62 and name  HD2) (resid   67 and name  HG1) 3.108 1.208 1.208 weight 1.000 
assign (resid 62 and name  HD2) (resid   67 and name  HB2) 3.223 1.298 1.298 weight 1.000 
    or (resid 62 and name  HD2) (resid   67 and name  HB1)
assign (resid 38 and name  HE1) (resid   76 and name HG12) 3.451 1.489 1.489 weight 1.000 
    or (resid 38 and name  HE1) (resid   76 and name HG11)
    or (resid 38 and name  HE1) (resid   76 and name HG13)
assign (resid 62 and name  HD2) (resid   62 and name   HA) 3.560 1.584 1.584 weight 1.000 
assign (resid 62 and name  HD2) (resid   67 and name  HD2) 3.403 1.447 1.447 weight 1.000 
assign (resid 73 and name  HD2) (resid   73 and name  HB1) 3.600 1.620 1.620 weight 1.000 
assign (resid 38 and name  HD2) (resid   76 and name HG12) 3.123 1.219 1.219 weight 1.000 
    or (resid 38 and name  HD2) (resid   76 and name HG11)
    or (resid 38 and name  HD2) (resid   76 and name HG13)
assign (resid 41 and name   HN) (resid   42 and name   HN) 2.756 0.949 0.949 weight 1.000 
assign (resid 41 and name   HN) (resid   21 and name   HA) 2.962 1.097 1.097 weight 1.000 
assign (resid 41 and name   HN) (resid   20 and name HG21) 3.107 1.206 1.206 weight 1.000 
    or (resid 41 and name   HN) (resid   20 and name HG22)
    or (resid 41 and name   HN) (resid   20 and name HG23)
assign (resid 21 and name   HN) (resid   19 and name  HD1) 3.703 1.714 1.714 weight 1.000 
    or (resid 21 and name   HN) (resid   19 and name  HD2)
assign (resid 21 and name   HN) (resid   21 and name   HA) 2.902 1.052 1.052 weight 1.000 
assign (resid 23 and name   HN) (resid   22 and name   HA) 2.503 0.783 0.783 weight 1.000 
assign (resid 21 and name   HN) (resid   20 and name   HA) 2.304 0.663 0.663 weight 1.000 
assign (resid 21 and name   HN) (resid   41 and name  HB1) 3.609 1.628 1.628 weight 1.000 
assign (resid 21 and name   HN) (resid   21 and name  HB2) 2.623 0.860 0.860 weight 1.000 
assign (resid 21 and name   HN) (resid   21 and name  HB1) 2.703 0.914 0.914 weight 1.000 
assign (resid 88 and name   HN) (resid   89 and name   HN) 3.418 1.460 1.460 weight 1.000 
assign (resid  9 and name   HN) (resid    8 and name   HN) 2.909 1.058 1.058 weight 1.000 
assign (resid 88 and name   HN) (resid   64 and name HD21) 3.308 1.368 1.368 weight 1.000 
    or (resid 88 and name   HN) (resid   64 and name HD22)
assign (resid 88 and name   HN) (resid   88 and name   HA) 2.887 1.042 1.042 weight 1.000 
assign (resid  9 and name   HN) (resid    9 and name   HA) 2.761 0.953 0.953 weight 1.000 
assign (resid  9 and name   HN) (resid   52 and name   HA) 3.406 1.450 1.450 weight 1.000 
assign (resid 88 and name   HN) (resid   87 and name   HA) 2.203 0.607 0.607 weight 1.000 
assign (resid 88 and name   HN) (resid   64 and name  HB2) 3.529 1.557 1.557 weight 1.000 
    or (resid 88 and name   HN) (resid   64 and name  HB1)
assign (resid 64 and name   HN) (resid   65 and name   HN) 2.966 1.100 1.100 weight 1.000 
assign (resid 88 and name   HN) (resid   64 and name   HN) 2.887 1.042 1.042 weight 1.000 
assign (resid 64 and name   HN) (resid   64 and name HD21) 3.515 1.544 1.544 weight 1.000 
    or (resid 64 and name   HN) (resid   64 and name HD22)
assign (resid 27 and name   HN) (resid   27 and name   HA) 2.989 1.116 1.116 weight 1.000 
assign (resid 64 and name   HN) (resid   65 and name  HA1) 3.592 1.613 1.613 weight 1.000 
assign (resid 64 and name   HN) (resid   64 and name  HB2) 2.765 0.956 0.956 weight 1.000 
    or (resid 64 and name   HN) (resid   64 and name  HB1)
assign (resid 27 and name   HN) (resid   27 and name  HB1) 2.582 0.833 0.833 weight 1.000 
assign (resid 64 and name   HN) (resid   66 and name  HG2) 3.609 1.628 1.628 weight 1.000 
assign (resid 64 and name   HN) (resid   63 and name   HB) 3.196 1.277 1.277 weight 1.000 
assign (resid 27 and name   HN) (resid   26 and name   HB) 3.211 1.289 1.289 weight 1.000 
assign (resid 64 and name   HN) (resid   88 and name  HB2) 2.543 0.809 0.809 weight 1.000 
    or (resid 64 and name   HN) (resid   88 and name  HB1)
    or (resid 64 and name   HN) (resid   88 and name  HB3)
assign (resid 89 and name   HN) (resid   87 and name HG12) 3.575 1.598 1.598 weight 1.000 
    or (resid 89 and name   HN) (resid   87 and name HG11)
    or (resid 89 and name   HN) (resid   87 and name HG13)
assign (resid 37 and name   HN) (resid   38 and name   HN) 3.529 1.557 1.557 weight 1.000 
assign (resid 10 and name   HN) (resid   17 and name  HD1) 3.644 1.660 1.660 weight 1.000 
    or (resid 10 and name   HN) (resid   17 and name  HD2)
assign (resid 10 and name   HN) (resid   88 and name   HA) 2.831 1.002 1.002 weight 1.000 
assign (resid 11 and name   HN) (resid   11 and name   HA) 2.744 0.941 0.941 weight 1.000 
assign (resid 10 and name   HN) (resid    9 and name   HA) 2.153 0.580 0.580 weight 1.000 
assign (resid 37 and name   HN) (resid   36 and name   HA) 2.131 0.567 0.567 weight 1.000 
assign (resid 10 and name   HN) (resid   10 and name   HA) 2.795 0.977 0.977 weight 1.000 
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    or (resid 44 and name   HN) (resid   43 and name HG11)
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    or (resid 36 and name   HN) (resid   36 and name HG11)
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    or (resid 40 and name   HN) (resid   60 and name HD11)
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    or (resid 36 and name   HN) (resid   36 and name HG21)
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    or (resid 28 and name   HN) (resid   33 and name HG21)
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    or (resid 75 and name   HN) (resid   76 and name HG11)
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    or (resid 42 and name   HN) (resid   40 and name HG21)
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    or (resid 63 and name   HN) (resid   68 and name HG11)
    or (resid 63 and name   HN) (resid   68 and name HG13)
assign (resid 86 and name   HN) (resid   86 and name  HG1) 2.682 0.899 0.899 weight 1.000 
assign (resid 96 and name HD21) (resid   96 and name  HB2) 3.219 1.295 1.295 weight 1.000 
assign (resid 68 and name   HN) (resid   69 and name  HB1) 3.368 1.418 1.418 weight 1.000 
assign (resid 18 and name   HN) (resid   16 and name  HB1) 2.693 0.907 0.907 weight 1.000 
assign (resid 47 and name   HN) (resid   44 and name  HB1) 3.075 1.182 1.182 weight 1.000 
! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! pred.tab
!
! settings: min phiError=None, min psiError=None, errorFactor=2.0
!

! Talos derived phi restraint:
assign (resid   4 and name C)
       (resid   5 and name N)
       (resid   5 and name CA)
       (resid   5 and name C)
       1.0 -87  29 2

! Talos derived phi restraint:
assign (resid   7 and name C)
       (resid   8 and name N)
       (resid   8 and name CA)
       (resid   8 and name C)
       1.0 -96  46 2

! Talos derived phi restraint:
assign (resid   8 and name C)
       (resid   9 and name N)
       (resid   9 and name CA)
       (resid   9 and name C)
       1.0 -97  29 2

! Talos derived phi restraint:
assign (resid   9 and name C)
       (resid  10 and name N)
       (resid  10 and name CA)
       (resid  10 and name C)
       1.0 -102  16 2

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

! Talos derived phi restraint:
assign (resid  11 and name C)
       (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       1.0 -96  46 2

! Talos derived phi restraint:
assign (resid  12 and name C)
       (resid  13 and name N)
       (resid  13 and name CA)
       (resid  13 and name C)
       1.0 -92  58 2

! Talos derived phi restraint:
assign (resid  19 and name C)
       (resid  20 and name N)
       (resid  20 and name CA)
       (resid  20 and name C)
       1.0 -114  31 2

! Talos derived phi restraint:
assign (resid  20 and name C)
       (resid  21 and name N)
       (resid  21 and name CA)
       (resid  21 and name C)
       1.0 -112  17 2

! Talos derived phi restraint:
assign (resid  21 and name C)
       (resid  22 and name N)
       (resid  22 and name CA)
       (resid  22 and name C)
       1.0 -124  16 2

! Talos derived phi restraint:
assign (resid  22 and name C)
       (resid  23 and name N)
       (resid  23 and name CA)
       (resid  23 and name C)
       1.0 -111  31 2

! Talos derived phi restraint:
assign (resid  23 and name C)
       (resid  24 and name N)
       (resid  24 and name CA)
       (resid  24 and name C)
       1.0 -133  30 2

! Talos derived phi restraint:
assign (resid  25 and name C)
       (resid  26 and name N)
       (resid  26 and name CA)
       (resid  26 and name C)
       1.0 -125  22 2

! Talos derived phi restraint:
assign (resid  26 and name C)
       (resid  27 and name N)
       (resid  27 and name CA)
       (resid  27 and name C)
       1.0 -89  41 2

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

! Talos derived phi restraint:
assign (resid  33 and name C)
       (resid  34 and name N)
       (resid  34 and name CA)
       (resid  34 and name C)
       1.0 -137  37 2

! Talos derived phi restraint:
assign (resid  35 and name C)
       (resid  36 and name N)
       (resid  36 and name CA)
       (resid  36 and name C)
       1.0 -109  48 2

! Talos derived phi restraint:
assign (resid  36 and name C)
       (resid  37 and name N)
       (resid  37 and name CA)
       (resid  37 and name C)
       1.0 -122  30 2

! Talos derived phi restraint:
assign (resid  37 and name C)
       (resid  38 and name N)
       (resid  38 and name CA)
       (resid  38 and name C)
       1.0 -111  27 2

! Talos derived phi restraint:
assign (resid  38 and name C)
       (resid  39 and name N)
       (resid  39 and name CA)
       (resid  39 and name C)
       1.0 -128  40 2

! Talos derived phi restraint:
assign (resid  39 and name C)
       (resid  40 and name N)
       (resid  40 and name CA)
       (resid  40 and name C)
       1.0 -75  26 2

! Talos derived phi restraint:
assign (resid  40 and name C)
       (resid  41 and name N)
       (resid  41 and name CA)
       (resid  41 and name C)
       1.0 -101  39 2

! Talos derived phi restraint:
assign (resid  41 and name C)
       (resid  42 and name N)
       (resid  42 and name CA)
       (resid  42 and name C)
       1.0 -154  22 2

! Talos derived phi restraint:
assign (resid  42 and name C)
       (resid  43 and name N)
       (resid  43 and name CA)
       (resid  43 and name C)
       1.0 -118  35 2

! Talos derived phi restraint:
assign (resid  43 and name C)
       (resid  44 and name N)
       (resid  44 and name CA)
       (resid  44 and name C)
       1.0 -70  29 2

! Talos derived phi restraint:
assign (resid  47 and name C)
       (resid  48 and name N)
       (resid  48 and name CA)
       (resid  48 and name C)
       1.0 -58  25 2

! Talos derived phi restraint:
assign (resid  48 and name C)
       (resid  49 and name N)
       (resid  49 and name CA)
       (resid  49 and name C)
       1.0 -67  13 2

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

! Talos derived phi restraint:
assign (resid  51 and name C)
       (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       1.0 -88  29 2

! Talos derived phi restraint:
assign (resid  53 and name C)
       (resid  54 and name N)
       (resid  54 and name CA)
       (resid  54 and name C)
       1.0 -82  39 2

! Talos derived phi restraint:
assign (resid  54 and name C)
       (resid  55 and name N)
       (resid  55 and name CA)
       (resid  55 and name C)
       1.0 -116  54 2

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

! Talos derived phi restraint:
assign (resid  56 and name C)
       (resid  57 and name N)
       (resid  57 and name CA)
       (resid  57 and name C)
       1.0  94  19 2

! Talos derived phi restraint:
assign (resid  61 and name C)
       (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       1.0 -131  55 2

! Talos derived phi restraint:
assign (resid  62 and name C)
       (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
       1.0 -108  33 2

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

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

! Talos derived phi restraint:
assign (resid  65 and name C)
       (resid  66 and name N)
       (resid  66 and name CA)
       (resid  66 and name C)
       1.0 -97  39 2

! Talos derived phi restraint:
assign (resid  67 and name C)
       (resid  68 and name N)
       (resid  68 and name CA)
       (resid  68 and name C)
       1.0 -107  36 2

! Talos derived phi restraint:
assign (resid  68 and name C)
       (resid  69 and name N)
       (resid  69 and name CA)
       (resid  69 and name C)
       1.0 -73  43 2

! Talos derived phi restraint:
assign (resid  72 and name C)
       (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       1.0 -61  17 2

! Talos derived phi restraint:
assign (resid  73 and name C)
       (resid  74 and name N)
       (resid  74 and name CA)
       (resid  74 and name C)
       1.0 -61  13 2

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

! Talos derived phi restraint:
assign (resid  75 and name C)
       (resid  76 and name N)
       (resid  76 and name CA)
       (resid  76 and name C)
       1.0 -65  14 2

! Talos derived phi restraint:
assign (resid  76 and name C)
       (resid  77 and name N)
       (resid  77 and name CA)
       (resid  77 and name C)
       1.0 -62  12 2

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

! Talos derived phi restraint:
assign (resid  78 and name C)
       (resid  79 and name N)
       (resid  79 and name CA)
       (resid  79 and name C)
       1.0 -63   5 2

! Talos derived phi restraint:
assign (resid  79 and name C)
       (resid  80 and name N)
       (resid  80 and name CA)
       (resid  80 and name C)
       1.0 -65   7 2

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

! Talos derived phi restraint:
assign (resid  81 and name C)
       (resid  82 and name N)
       (resid  82 and name CA)
       (resid  82 and name C)
       1.0 -67   9 2

! Talos derived phi restraint:
assign (resid  82 and name C)
       (resid  83 and name N)
       (resid  83 and name CA)
       (resid  83 and name C)
       1.0 -70  24 2

! Talos derived phi restraint:
assign (resid  85 and name C)
       (resid  86 and name N)
       (resid  86 and name CA)
       (resid  86 and name C)
       1.0 -124  41 2

! Talos derived phi restraint:
assign (resid  86 and name C)
       (resid  87 and name N)
       (resid  87 and name CA)
       (resid  87 and name C)
       1.0 -139  30 2

! Talos derived phi restraint:
assign (resid  87 and name C)
       (resid  88 and name N)
       (resid  88 and name CA)
       (resid  88 and name C)
       1.0 -111  35 2

! Talos derived phi restraint:
assign (resid  88 and name C)
       (resid  89 and name N)
       (resid  89 and name CA)
       (resid  89 and name C)
       1.0 -113  35 2

! Talos derived phi restraint:
assign (resid  89 and name C)
       (resid  90 and name N)
       (resid  90 and name CA)
       (resid  90 and name C)
       1.0 -95  38 2

! Talos derived phi restraint:
assign (resid  90 and name C)
       (resid  91 and name N)
       (resid  91 and name CA)
       (resid  91 and name C)
       1.0 -120  32 2

! Talos derived phi restraint:
assign (resid  91 and name C)
       (resid  92 and name N)
       (resid  92 and name CA)
       (resid  92 and name C)
       1.0 -136  42 2

! Talos derived psi restraint:
assign (resid   5 and name N)
       (resid   5 and name CA)
       (resid   5 and name C)
       (resid   6 and name N)
       1.0 131  40 2

! Talos derived psi restraint:
assign (resid   8 and name N)
       (resid   8 and name CA)
       (resid   8 and name C)
       (resid   9 and name N)
       1.0 122  31 2

! Talos derived psi restraint:
assign (resid   9 and name N)
       (resid   9 and name CA)
       (resid   9 and name C)
       (resid  10 and name N)
       1.0 119  24 2

! Talos derived psi restraint:
assign (resid  10 and name N)
       (resid  10 and name CA)
       (resid  10 and name C)
       (resid  11 and name N)
       1.0 122  19 2

! Talos derived psi restraint:
assign (resid  11 and name N)
       (resid  11 and name CA)
       (resid  11 and name C)
       (resid  12 and name N)
       1.0 130  22 2

! Talos derived psi restraint:
assign (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       (resid  13 and name N)
       1.0 127  47 2

! Talos derived psi restraint:
assign (resid  13 and name N)
       (resid  13 and name CA)
       (resid  13 and name C)
       (resid  14 and name N)
       1.0 133  31 2

! Talos derived psi restraint:
assign (resid  20 and name N)
       (resid  20 and name CA)
       (resid  20 and name C)
       (resid  21 and name N)
       1.0 126  20 2

! Talos derived psi restraint:
assign (resid  21 and name N)
       (resid  21 and name CA)
       (resid  21 and name C)
       (resid  22 and name N)
       1.0 144  25 2

! Talos derived psi restraint:
assign (resid  22 and name N)
       (resid  22 and name CA)
       (resid  22 and name C)
       (resid  23 and name N)
       1.0 128  15 2

! Talos derived psi restraint:
assign (resid  23 and name N)
       (resid  23 and name CA)
       (resid  23 and name C)
       (resid  24 and name N)
       1.0 128  21 2

! Talos derived psi restraint:
assign (resid  24 and name N)
       (resid  24 and name CA)
       (resid  24 and name C)
       (resid  25 and name N)
       1.0 151  27 2

! Talos derived psi restraint:
assign (resid  26 and name N)
       (resid  26 and name CA)
       (resid  26 and name C)
       (resid  27 and name N)
       1.0 133  33 2

! Talos derived psi restraint:
assign (resid  27 and name N)
       (resid  27 and name CA)
       (resid  27 and name C)
       (resid  28 and name N)
       1.0 127  20 2

! Talos derived psi restraint:
assign (resid  28 and name N)
       (resid  28 and name CA)
       (resid  28 and name C)
       (resid  29 and name N)
       1.0 108  38 2

! Talos derived psi restraint:
assign (resid  34 and name N)
       (resid  34 and name CA)
       (resid  34 and name C)
       (resid  35 and name N)
       1.0 152  23 2

! Talos derived psi restraint:
assign (resid  36 and name N)
       (resid  36 and name CA)
       (resid  36 and name C)
       (resid  37 and name N)
       1.0 133  28 2

! Talos derived psi restraint:
assign (resid  37 and name N)
       (resid  37 and name CA)
       (resid  37 and name C)
       (resid  38 and name N)
       1.0 144  28 2

! Talos derived psi restraint:
assign (resid  38 and name N)
       (resid  38 and name CA)
       (resid  38 and name C)
       (resid  39 and name N)
       1.0 125  17 2

! Talos derived psi restraint:
assign (resid  39 and name N)
       (resid  39 and name CA)
       (resid  39 and name C)
       (resid  40 and name N)
       1.0 134  31 2

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

! Talos derived psi restraint:
assign (resid  41 and name N)
       (resid  41 and name CA)
       (resid  41 and name C)
       (resid  42 and name N)
       1.0 -36  17 2

! Talos derived psi restraint:
assign (resid  42 and name N)
       (resid  42 and name CA)
       (resid  42 and name C)
       (resid  43 and name N)
       1.0 142  25 2

! Talos derived psi restraint:
assign (resid  43 and name N)
       (resid  43 and name CA)
       (resid  43 and name C)
       (resid  44 and name N)
       1.0 127  24 2

! Talos derived psi restraint:
assign (resid  44 and name N)
       (resid  44 and name CA)
       (resid  44 and name C)
       (resid  45 and name N)
       1.0 132  17 2

! Talos derived psi restraint:
assign (resid  48 and name N)
       (resid  48 and name CA)
       (resid  48 and name C)
       (resid  49 and name N)
       1.0 -38  18 2

! Talos derived psi restraint:
assign (resid  49 and name N)
       (resid  49 and name CA)
       (resid  49 and name C)
       (resid  50 and name N)
       1.0 -39  14 2

! Talos derived psi restraint:
assign (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       (resid  52 and name N)
       1.0 -28  27 2

! Talos derived psi restraint:
assign (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       (resid  53 and name N)
       1.0  -5  55 2

! Talos derived psi restraint:
assign (resid  54 and name N)
       (resid  54 and name CA)
       (resid  54 and name C)
       (resid  55 and name N)
       1.0 133  22 2

! Talos derived psi restraint:
assign (resid  55 and name N)
       (resid  55 and name CA)
       (resid  55 and name C)
       (resid  56 and name N)
       1.0 143  39 2

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

! Talos derived psi restraint:
assign (resid  57 and name N)
       (resid  57 and name CA)
       (resid  57 and name C)
       (resid  58 and name N)
       1.0 -14  22 2

! Talos derived psi restraint:
assign (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       (resid  63 and name N)
       1.0 153  24 2

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

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

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

! Talos derived psi restraint:
assign (resid  66 and name N)
       (resid  66 and name CA)
       (resid  66 and name C)
       (resid  67 and name N)
       1.0 126  43 2

! Talos derived psi restraint:
assign (resid  68 and name N)
       (resid  68 and name CA)
       (resid  68 and name C)
       (resid  69 and name N)
       1.0  15  44 2

! Talos derived psi restraint:
assign (resid  69 and name N)
       (resid  69 and name CA)
       (resid  69 and name C)
       (resid  70 and name N)
       1.0 137  23 2

! Talos derived psi restraint:
assign (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       (resid  74 and name N)
       1.0 -42  11 2

! Talos derived psi restraint:
assign (resid  74 and name N)
       (resid  74 and name CA)
       (resid  74 and name C)
       (resid  75 and name N)
       1.0 -35  15 2

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

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

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

! Talos derived psi restraint:
assign (resid  78 and name N)
       (resid  78 and name CA)
       (resid  78 and name C)
       (resid  79 and name N)
       1.0 -43   7 2

! Talos derived psi restraint:
assign (resid  79 and name N)
       (resid  79 and name CA)
       (resid  79 and name C)
       (resid  80 and name N)
       1.0 -41  15 2

! Talos derived psi restraint:
assign (resid  80 and name N)
       (resid  80 and name CA)
       (resid  80 and name C)
       (resid  81 and name N)
       1.0 -41   7 2

! Talos derived psi restraint:
assign (resid  81 and name N)
       (resid  81 and name CA)
       (resid  81 and name C)
       (resid  82 and name N)
       1.0 -40  23 2

! Talos derived psi restraint:
assign (resid  82 and name N)
       (resid  82 and name CA)
       (resid  82 and name C)
       (resid  83 and name N)
       1.0 -24  32 2

! Talos derived psi restraint:
assign (resid  83 and name N)
       (resid  83 and name CA)
       (resid  83 and name C)
       (resid  84 and name N)
       1.0 -23  29 2

! Talos derived psi restraint:
assign (resid  86 and name N)
       (resid  86 and name CA)
       (resid  86 and name C)
       (resid  87 and name N)
       1.0 152  20 2

! Talos derived psi restraint:
assign (resid  87 and name N)
       (resid  87 and name CA)
       (resid  87 and name C)
       (resid  88 and name N)
       1.0 139  32 2

! Talos derived psi restraint:
assign (resid  88 and name N)
       (resid  88 and name CA)
       (resid  88 and name C)
       (resid  89 and name N)
       1.0 125  24 2

! Talos derived psi restraint:
assign (resid  89 and name N)
       (resid  89 and name CA)
       (resid  89 and name C)
       (resid  90 and name N)
       1.0 115  17 2

! Talos derived psi restraint:
assign (resid  90 and name N)
       (resid  90 and name CA)
       (resid  90 and name C)
       (resid  91 and name N)
       1.0 131  38 2

! Talos derived psi restraint:
assign (resid  91 and name N)
       (resid  91 and name CA)
       (resid  91 and name C)
       (resid  92 and name N)
       1.0 149  23 2

! Talos derived psi restraint:
assign (resid  92 and name N)
       (resid  92 and name CA)
       (resid  92 and name C)
       (resid  93 and name N)
       1.0 139  25 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1   2.051  20.517  -0.307
    2    H2   GLY   1           HT2      GLY   1   1.899  21.499  -1.674
    3    H3   GLY   1           HT3      GLY   1   2.294  19.865  -1.846
    4    HA2  GLY   1           HA1      GLY   1  -0.277  20.948  -0.848
    5    HA3  GLY   1           HA2      GLY   1  -0.008  20.206  -2.418
    6    H    GLY   2           HN       GLY   2  -0.850  19.696   0.812
    7    HA2  GLY   2           HA2      GLY   2  -0.084  16.935   0.984
    8    HA3  GLY   2           HA1      GLY   2  -1.135  17.796   2.096
    9    H    SER   3           HN       SER   3  -3.269  18.522   0.765
   10    HA   SER   3           HA       SER   3  -4.411  15.989  -0.136
   11    HB2  SER   3           HB2      SER   3  -5.908  18.557   0.398
   12    HB3  SER   3           HB1      SER   3  -6.536  16.905   0.396
   13    HG   SER   3           HG       SER   3  -5.289  16.499   2.260
   14    H    MET   4           HN       MET   4  -4.040  15.698  -2.245
   15    HA   MET   4           HA       MET   4  -5.065  17.703  -4.109
   16    HB2  MET   4           HB2      MET   4  -2.689  18.198  -3.989
   17    HB3  MET   4           HB1      MET   4  -2.288  16.509  -4.249
   18    HG2  MET   4           HG2      MET   4  -1.907  17.671  -6.276
   19    HG3  MET   4           HG1      MET   4  -3.342  16.671  -6.491
   20    HE1  MET   4           HE1      MET   4  -3.691  18.105  -8.690
   21    HE2  MET   4           HE2      MET   4  -2.422  19.283  -8.354
   22    HE3  MET   4           HE3      MET   4  -4.062  19.828  -8.708
   23    H    ARG   5           HN       ARG   5  -3.721  14.460  -3.657
   24    HA   ARG   5           HA       ARG   5  -5.019  13.495  -6.061
   25    HB2  ARG   5           HB2      ARG   5  -3.044  12.419  -4.124
   26    HB3  ARG   5           HB1      ARG   5  -4.033  11.257  -4.993
   27    HG2  ARG   5           HG2      ARG   5  -2.017  11.520  -6.206
   28    HG3  ARG   5           HG1      ARG   5  -3.283  12.341  -7.117
   29    HD2  ARG   5           HD2      ARG   5  -2.548  14.487  -6.111
   30    HD3  ARG   5           HD1      ARG   5  -1.221  13.626  -5.331
   31    HE   ARG   5           HE       ARG   5  -1.393  13.360  -8.219
   32   HH11  ARG   5          HH11      ARG   5   0.036  15.057  -5.508
   33   HH12  ARG   5          HH12      ARG   5   1.403  15.614  -6.419
   34   HH21  ARG   5          HH21      ARG   5   0.413  14.089  -9.416
   35   HH22  ARG   5          HH22      ARG   5   1.614  15.072  -8.639
   36    HA   PRO   6           HA       PRO   6  -8.724  12.400  -3.849
   37    HB2  PRO   6           HB2      PRO   6  -9.860  10.927  -5.828
   38    HB3  PRO   6           HB1      PRO   6  -9.818  12.687  -5.842
   39    HG2  PRO   6           HG2      PRO   6  -8.022  10.737  -7.213
   40    HG3  PRO   6           HG1      PRO   6  -8.805  12.188  -7.845
   41    HD2  PRO   6           HD2      PRO   6  -6.232  12.197  -7.087
   42    HD3  PRO   6           HD1      PRO   6  -7.275  13.613  -6.845
   43    HA   PRO   7           HA       PRO   7  -7.454   8.392  -2.319
   44    HB2  PRO   7           HB2      PRO   7  -9.857   8.431  -0.675
   45    HB3  PRO   7           HB1      PRO   7  -8.168   8.514  -0.174
   46    HG2  PRO   7           HG2      PRO   7  -9.879  10.607   0.025
   47    HG3  PRO   7           HG1      PRO   7  -8.134  10.807  -0.229
   48    HD2  PRO   7           HD2      PRO   7 -10.373  10.994  -2.207
   49    HD3  PRO   7           HD1      PRO   7  -8.905  11.982  -2.065
   50    H    ILE   8           HN       ILE   8  -8.075   6.285  -2.447
   51    HA   ILE   8           HA       ILE   8 -10.247   5.677  -4.276
   52    HB   ILE   8           HB       ILE   8  -8.132   3.867  -3.124
   53   HG12  ILE   8          HG12      ILE   8  -7.394   5.868  -4.596
   54   HG13  ILE   8          HG11      ILE   8  -6.776   4.269  -4.972
   55   HG21  ILE   8          HG21      ILE   8 -10.152   3.512  -5.312
   56   HG22  ILE   8          HG22      ILE   8  -9.920   2.539  -3.860
   57   HG23  ILE   8          HG23      ILE   8  -8.725   2.487  -5.155
   58   HD11  ILE   8          HD11      ILE   8  -7.453   5.589  -6.951
   59   HD12  ILE   8          HD12      ILE   8  -9.117   5.536  -6.366
   60   HD13  ILE   8          HD13      ILE   8  -8.285   4.040  -6.806
   61    H    ILE   9           HN       ILE   9 -12.081   5.860  -2.941
   62    HA   ILE   9           HA       ILE   9 -12.242   4.652  -0.373
   63    HB   ILE   9           HB       ILE   9 -14.356   5.745  -2.230
   64   HG12  ILE   9          HG12      ILE   9 -14.471   7.591  -0.848
   65   HG13  ILE   9          HG11      ILE   9 -13.710   6.778   0.498
   66   HG21  ILE   9          HG21      ILE   9 -14.659   4.293   0.347
   67   HG22  ILE   9          HG22      ILE   9 -15.658   4.234  -1.106
   68   HG23  ILE   9          HG23      ILE   9 -15.749   5.630  -0.029
   69   HD11  ILE   9          HD11      ILE   9 -11.567   6.907  -0.700
   70   HD12  ILE   9          HD12      ILE   9 -12.271   8.491  -0.381
   71   HD13  ILE   9          HD13      ILE   9 -12.372   7.789  -1.997
   72    H    ILE  10           HN       ILE  10 -11.802   2.516  -0.404
   73    HA   ILE  10           HA       ILE  10 -13.216   0.719  -2.202
   74    HB   ILE  10           HB       ILE  10 -11.184   0.078  -0.070
   75   HG12  ILE  10          HG12      ILE  10 -10.654   0.322  -3.019
   76   HG13  ILE  10          HG11      ILE  10 -10.488   1.695  -1.937
   77   HG21  ILE  10          HG21      ILE  10 -12.403  -1.876  -0.704
   78   HG22  ILE  10          HG22      ILE  10 -10.837  -1.945  -1.515
   79   HG23  ILE  10          HG23      ILE  10 -12.274  -1.467  -2.416
   80   HD11  ILE  10          HD11      ILE  10  -8.807   0.463  -0.661
   81   HD12  ILE  10          HD12      ILE  10  -8.353   0.645  -2.356
   82   HD13  ILE  10          HD13      ILE  10  -8.975  -0.898  -1.770
   83    H    HIS  11           HN       HIS  11 -14.762  -0.667  -1.594
   84    HA   HIS  11           HA       HIS  11 -15.928  -0.326   1.053
   85    HB2  HIS  11           HB2      HIS  11 -16.816  -1.615  -1.517
   86    HB3  HIS  11           HB1      HIS  11 -17.677  -1.929  -0.014
   87    HD2  HIS  11           HD2      HIS  11 -17.086   1.504   0.653
   88    HE1  HIS  11           HE1      HIS  11 -20.176   1.658  -2.232
   89    HE2  HIS  11           HE2      HIS  11 -18.772   3.016  -0.618
   90    H    ARG  12           HN       ARG  12 -16.329  -2.020   2.462
   91    HA   ARG  12           HA       ARG  12 -14.354  -4.026   2.674
   92    HB2  ARG  12           HB2      ARG  12 -15.765  -4.759   4.606
   93    HB3  ARG  12           HB1      ARG  12 -15.383  -3.046   4.623
   94    HG2  ARG  12           HG2      ARG  12 -17.545  -2.439   3.969
   95    HG3  ARG  12           HG1      ARG  12 -17.940  -4.081   3.465
   96    HD2  ARG  12           HD2      ARG  12 -17.794  -4.801   5.799
   97    HD3  ARG  12           HD1      ARG  12 -17.474  -3.144   6.291
   98    HE   ARG  12           HE       ARG  12 -19.866  -3.309   4.771
   99   HH11  ARG  12          HH11      ARG  12 -18.568  -3.963   7.955
  100   HH12  ARG  12          HH12      ARG  12 -20.100  -3.814   8.750
  101   HH21  ARG  12          HH21      ARG  12 -21.891  -3.107   5.821
  102   HH22  ARG  12          HH22      ARG  12 -21.990  -3.333   7.538
  103    H    ALA  13           HN       ALA  13 -14.337  -6.094   1.968
  104    HA   ALA  13           HA       ALA  13 -16.844  -7.189   0.864
  105    HB1  ALA  13           HB1      ALA  13 -13.995  -7.507  -0.034
  106    HB2  ALA  13           HB2      ALA  13 -15.389  -6.950  -0.962
  107    HB3  ALA  13           HB3      ALA  13 -15.254  -8.647  -0.506
  108    H    GLY  14           HN       GLY  14 -17.043  -7.694   3.267
  109    HA2  GLY  14           HA2      GLY  14 -17.329  -9.523   4.689
  110    HA3  GLY  14           HA1      GLY  14 -16.233 -10.453   3.672
  111    H    LYS  15           HN       LYS  15 -13.979  -9.166   3.620
  112    HA   LYS  15           HA       LYS  15 -13.136  -8.139   6.156
  113    HB2  LYS  15           HB2      LYS  15 -12.861 -10.256   6.980
  114    HB3  LYS  15           HB1      LYS  15 -12.607 -10.943   5.397
  115    HG2  LYS  15           HG2      LYS  15 -10.589 -11.128   6.671
  116    HG3  LYS  15           HG1      LYS  15 -10.352  -9.962   5.376
  117    HD2  LYS  15           HD2      LYS  15 -10.792  -8.144   6.977
  118    HD3  LYS  15           HD1      LYS  15 -10.881  -9.342   8.267
  119    HE2  LYS  15           HE2      LYS  15  -8.674  -8.229   8.115
  120    HE3  LYS  15           HE1      LYS  15  -8.589  -9.975   7.901
  121    HZ1  LYS  15           HZ1      LYS  15  -8.300  -9.723   5.587
  122    HZ2  LYS  15           HZ2      LYS  15  -7.235  -8.633   6.309
  123    HZ3  LYS  15           HZ3      LYS  15  -8.674  -8.072   5.619
  124    H    LYS  16           HN       LYS  16 -12.133  -9.617   3.112
  125    HA   LYS  16           HA       LYS  16  -9.756  -7.989   2.934
  126    HB2  LYS  16           HB2      LYS  16 -10.966  -9.721   0.794
  127    HB3  LYS  16           HB1      LYS  16  -9.313  -9.171   0.888
  128    HG2  LYS  16           HG2      LYS  16 -10.626 -11.084   2.799
  129    HG3  LYS  16           HG1      LYS  16  -9.566 -11.536   1.462
  130    HD2  LYS  16           HD2      LYS  16  -8.557  -9.512   3.339
  131    HD3  LYS  16           HD1      LYS  16  -8.695 -11.155   3.962
  132    HE2  LYS  16           HE2      LYS  16  -7.127 -10.227   1.561
  133    HE3  LYS  16           HE1      LYS  16  -6.480 -10.848   3.078
  134    HZ1  LYS  16           HZ1      LYS  16  -6.382 -12.589   1.511
  135    HZ2  LYS  16           HZ2      LYS  16  -7.970 -12.343   0.999
  136    HZ3  LYS  16           HZ3      LYS  16  -7.667 -12.970   2.538
  137    H    TYR  17           HN       TYR  17  -9.322  -6.556   1.141
  138    HA   TYR  17           HA       TYR  17 -11.737  -5.104   0.307
  139    HB2  TYR  17           HB2      TYR  17  -8.851  -4.220   0.421
  140    HB3  TYR  17           HB1      TYR  17 -10.175  -3.227  -0.179
  141    HD1  TYR  17           HD1      TYR  17 -11.897  -2.385   1.369
  142    HD2  TYR  17           HD2      TYR  17  -8.551  -4.606   2.751
  143    HE1  TYR  17           HE1      TYR  17 -12.373  -1.642   3.664
  144    HE2  TYR  17           HE2      TYR  17  -8.999  -3.893   5.040
  145    HH   TYR  17           HH       TYR  17 -10.409  -1.578   6.025
  146    H    GLY  18           HN       GLY  18  -9.533  -7.302  -0.856
  147    HA2  GLY  18           HA2      GLY  18  -9.799  -8.235  -3.023
  148    HA3  GLY  18           HA1      GLY  18 -10.399  -6.688  -3.569
  149    H    PHE  19           HN       PHE  19  -7.565  -6.477  -1.703
  150    HA   PHE  19           HA       PHE  19  -5.907  -6.711  -4.073
  151    HB2  PHE  19           HB2      PHE  19  -4.959  -4.563  -4.014
  152    HB3  PHE  19           HB1      PHE  19  -6.687  -4.351  -3.966
  153    HD1  PHE  19           HD1      PHE  19  -7.786  -3.544  -1.907
  154    HD2  PHE  19           HD2      PHE  19  -3.555  -3.899  -2.213
  155    HE1  PHE  19           HE1      PHE  19  -7.517  -2.067   0.046
  156    HE2  PHE  19           HE2      PHE  19  -3.279  -2.435  -0.258
  157    HZ   PHE  19           HZ       PHE  19  -5.267  -1.512   0.871
  158    H    THR  20           HN       THR  20  -3.689  -6.349  -3.728
  159    HA   THR  20           HA       THR  20  -2.777  -7.602  -1.219
  160    HB   THR  20           HB       THR  20  -1.511  -7.560  -3.960
  161    HG1  THR  20           HG1      THR  20  -3.294  -9.044  -3.586
  162   HG21  THR  20          HG21      THR  20   0.230  -9.019  -3.042
  163   HG22  THR  20          HG22      THR  20  -0.493  -8.886  -1.440
  164   HG23  THR  20          HG23      THR  20   0.227  -7.466  -2.203
  165    H    LEU  21           HN       LEU  21  -1.593  -6.400   0.097
  166    HA   LEU  21           HA       LEU  21  -0.492  -3.889  -0.926
  167    HB2  LEU  21           HB2      LEU  21  -2.028  -3.752   1.014
  168    HB3  LEU  21           HB1      LEU  21  -0.949  -4.782   1.926
  169    HG   LEU  21           HG       LEU  21   0.772  -3.069   1.902
  170   HD11  LEU  21          HD11      LEU  21   0.393  -2.072  -0.253
  171   HD12  LEU  21          HD12      LEU  21   0.260  -0.825   0.987
  172   HD13  LEU  21          HD13      LEU  21  -1.195  -1.497   0.252
  173   HD21  LEU  21          HD21      LEU  21  -0.797  -2.985   3.709
  174   HD22  LEU  21          HD22      LEU  21  -1.950  -2.087   2.723
  175   HD23  LEU  21          HD23      LEU  21  -0.429  -1.335   3.205
  176    H    ARG  22           HN       ARG  22   1.680  -3.592  -0.995
  177    HA   ARG  22           HA       ARG  22   3.345  -5.656   0.264
  178    HB2  ARG  22           HB2      ARG  22   3.449  -4.672  -2.577
  179    HB3  ARG  22           HB1      ARG  22   4.808  -5.481  -1.825
  180    HG2  ARG  22           HG2      ARG  22   2.857  -7.257  -1.281
  181    HG3  ARG  22           HG1      ARG  22   2.249  -6.558  -2.774
  182    HD2  ARG  22           HD2      ARG  22   3.597  -8.451  -3.333
  183    HD3  ARG  22           HD1      ARG  22   4.438  -6.991  -3.835
  184    HE   ARG  22           HE       ARG  22   5.384  -7.606  -1.303
  185   HH11  ARG  22          HH11      ARG  22   5.298  -9.099  -4.461
  186   HH12  ARG  22          HH12      ARG  22   6.780  -9.971  -4.243
  187   HH21  ARG  22          HH21      ARG  22   7.352  -8.773  -0.992
  188   HH22  ARG  22          HH22      ARG  22   7.949  -9.781  -2.273
  189    H    ALA  23           HN       ALA  23   4.945  -4.905   1.402
  190    HA   ALA  23           HA       ALA  23   5.472  -2.046   1.413
  191    HB1  ALA  23           HB1      ALA  23   6.550  -4.196   3.232
  192    HB2  ALA  23           HB2      ALA  23   5.085  -3.266   3.538
  193    HB3  ALA  23           HB3      ALA  23   6.653  -2.454   3.484
  194    H    ILE  24           HN       ILE  24   6.581  -1.818  -0.513
  195    HA   ILE  24           HA       ILE  24   8.928  -3.376  -1.121
  196    HB   ILE  24           HB       ILE  24   9.197  -1.805  -3.026
  197   HG12  ILE  24          HG12      ILE  24   6.531  -0.607  -2.325
  198   HG13  ILE  24          HG11      ILE  24   8.010   0.090  -1.672
  199   HG21  ILE  24          HG21      ILE  24   6.496  -3.082  -2.648
  200   HG22  ILE  24          HG22      ILE  24   7.928  -3.790  -3.396
  201   HG23  ILE  24          HG23      ILE  24   7.083  -2.462  -4.192
  202   HD11  ILE  24          HD11      ILE  24   7.415  -0.286  -4.594
  203   HD12  ILE  24          HD12      ILE  24   8.837   0.496  -3.904
  204   HD13  ILE  24          HD13      ILE  24   7.243   1.223  -3.699
  205    H    ARG  25           HN       ARG  25  11.066  -2.381  -1.447
  206    HA   ARG  25           HA       ARG  25  11.482   0.051   0.103
  207    HB2  ARG  25           HB2      ARG  25  12.956  -0.817   1.639
  208    HB3  ARG  25           HB1      ARG  25  11.829  -2.153   1.472
  209    HG2  ARG  25           HG2      ARG  25  14.410  -1.995  -0.064
  210    HG3  ARG  25           HG1      ARG  25  14.282  -2.736   1.529
  211    HD2  ARG  25           HD2      ARG  25  12.413  -4.161   0.513
  212    HD3  ARG  25           HD1      ARG  25  13.011  -3.602  -1.048
  213    HE   ARG  25           HE       ARG  25  14.777  -4.984   0.872
  214   HH11  ARG  25          HH11      ARG  25  13.437  -4.652  -2.341
  215   HH12  ARG  25          HH12      ARG  25  14.394  -5.932  -3.013
  216   HH21  ARG  25          HH21      ARG  25  16.017  -6.681   0.014
  217   HH22  ARG  25          HH22      ARG  25  15.846  -7.122  -1.665
  218    H    VAL  26           HN       VAL  26  12.883   1.388  -0.740
  219    HA   VAL  26           HA       VAL  26  14.713   0.418  -2.844
  220    HB   VAL  26           HB       VAL  26  13.195   3.032  -2.680
  221   HG11  VAL  26          HG11      VAL  26  15.438   2.252  -4.535
  222   HG12  VAL  26          HG12      VAL  26  15.417   3.586  -3.382
  223   HG13  VAL  26          HG13      VAL  26  14.366   3.626  -4.799
  224   HG21  VAL  26          HG21      VAL  26  12.336   2.353  -4.885
  225   HG22  VAL  26          HG22      VAL  26  11.915   1.203  -3.615
  226   HG23  VAL  26          HG23      VAL  26  13.221   0.835  -4.743
  227    H    TYR  27           HN       TYR  27  16.799   0.629  -2.213
  228    HA   TYR  27           HA       TYR  27  17.470   1.937   0.194
  229    HB2  TYR  27           HB2      TYR  27  19.059   0.695  -1.990
  230    HB3  TYR  27           HB1      TYR  27  19.865   1.613  -0.745
  231    HD1  TYR  27           HD1      TYR  27  19.868   0.839   1.581
  232    HD2  TYR  27           HD2      TYR  27  18.093  -1.478  -1.519
  233    HE1  TYR  27           HE1      TYR  27  19.857  -1.126   3.057
  234    HE2  TYR  27           HE2      TYR  27  18.077  -3.449  -0.046
  235    HH   TYR  27           HH       TYR  27  19.305  -4.267   1.944
  236    H    MET  28           HN       MET  28  18.370   3.815   0.621
  237    HA   MET  28           HA       MET  28  18.023   5.959  -1.201
  238    HB2  MET  28           HB2      MET  28  18.999   5.630   1.600
  239    HB3  MET  28           HB1      MET  28  19.390   7.112   0.757
  240    HG2  MET  28           HG2      MET  28  16.612   6.039   1.132
  241    HG3  MET  28           HG1      MET  28  17.367   7.268   2.134
  242    HE1  MET  28           HE1      MET  28  14.574   7.840   0.794
  243    HE2  MET  28           HE2      MET  28  14.840   9.470   0.177
  244    HE3  MET  28           HE3      MET  28  15.472   9.013   1.757
  245    H    GLY  29           HN       GLY  29  19.478   6.965  -2.476
  246    HA2  GLY  29           HA2      GLY  29  21.983   5.631  -2.968
  247    HA3  GLY  29           HA1      GLY  29  21.346   7.014  -3.841
  248    H    ASP  30           HN       ASP  30  22.554   6.248  -0.574
  249    HA   ASP  30           HA       ASP  30  24.678   8.131  -0.752
  250    HB2  ASP  30           HB2      ASP  30  23.128   9.871  -0.412
  251    HB3  ASP  30           HB1      ASP  30  22.207   8.942   0.763
  252    H    SER  31           HN       SER  31  22.514   6.800   1.769
  253    HA   SER  31           HA       SER  31  24.929   5.804   3.123
  254    HB2  SER  31           HB2      SER  31  22.193   6.335   4.307
  255    HB3  SER  31           HB1      SER  31  23.631   5.837   5.194
  256    HG   SER  31           HG       SER  31  23.516   8.217   3.647
  257    H    ASP  32           HN       ASP  32  23.351   4.087   4.874
  258    HA   ASP  32           HA       ASP  32  23.009   1.829   3.031
  259    HB2  ASP  32           HB2      ASP  32  24.559   1.800   5.099
  260    HB3  ASP  32           HB1      ASP  32  23.079   1.670   6.038
  261    H    VAL  33           HN       VAL  33  21.306   4.084   4.744
  262    HA   VAL  33           HA       VAL  33  19.066   2.682   5.669
  263    HB   VAL  33           HB       VAL  33  19.497   4.925   6.427
  264   HG11  VAL  33          HG11      VAL  33  19.593   6.825   5.096
  265   HG12  VAL  33          HG12      VAL  33  18.745   6.045   3.762
  266   HG13  VAL  33          HG13      VAL  33  20.415   5.611   4.117
  267   HG21  VAL  33          HG21      VAL  33  17.326   5.897   6.277
  268   HG22  VAL  33          HG22      VAL  33  17.141   4.142   6.325
  269   HG23  VAL  33          HG23      VAL  33  16.978   5.008   4.792
  270    H    TYR  34           HN       TYR  34  17.026   2.458   4.808
  271    HA   TYR  34           HA       TYR  34  16.937   2.521   1.873
  272    HB2  TYR  34           HB2      TYR  34  15.293   0.667   2.002
  273    HB3  TYR  34           HB1      TYR  34  16.871   0.232   2.637
  274    HD1  TYR  34           HD1      TYR  34  17.189  -0.115   5.042
  275    HD2  TYR  34           HD2      TYR  34  13.353   0.778   3.439
  276    HE1  TYR  34           HE1      TYR  34  16.147  -0.865   7.135
  277    HE2  TYR  34           HE2      TYR  34  12.300   0.036   5.532
  278    HH   TYR  34           HH       TYR  34  14.244  -0.886   8.335
  279    H    THR  35           HN       THR  35  14.648   2.507   1.078
  280    HA   THR  35           HA       THR  35  13.019   4.392   2.634
  281    HB   THR  35           HB       THR  35  12.888   4.432  -0.344
  282    HG1  THR  35           HG1      THR  35  15.072   4.548  -0.188
  283   HG21  THR  35          HG21      THR  35  12.319   6.695  -0.033
  284   HG22  THR  35          HG22      THR  35  13.028   6.735   1.582
  285   HG23  THR  35          HG23      THR  35  11.525   5.852   1.301
  286    H    VAL  36           HN       VAL  36  11.513   3.001   3.404
  287    HA   VAL  36           HA       VAL  36  10.408   0.938   1.698
  288    HB   VAL  36           HB       VAL  36  10.840   0.318   3.991
  289   HG11  VAL  36          HG11      VAL  36   9.547   1.317   5.857
  290   HG12  VAL  36          HG12      VAL  36   8.960   2.549   4.740
  291   HG13  VAL  36          HG13      VAL  36  10.682   2.436   5.104
  292   HG21  VAL  36          HG21      VAL  36   8.683  -0.609   4.613
  293   HG22  VAL  36          HG22      VAL  36   8.922  -0.721   2.870
  294   HG23  VAL  36          HG23      VAL  36   7.867   0.525   3.536
  295    H    HIS  37           HN       HIS  37   8.556   1.002   0.663
  296    HA   HIS  37           HA       HIS  37   6.688   3.212   1.190
  297    HB2  HIS  37           HB2      HIS  37   7.615   2.123  -1.470
  298    HB3  HIS  37           HB1      HIS  37   6.215   3.160  -1.290
  299    HD2  HIS  37           HD2      HIS  37  10.006   3.363  -1.616
  300    HE1  HIS  37           HE1      HIS  37   8.596   7.255  -0.761
  301    HE2  HIS  37           HE2      HIS  37  10.521   5.900  -1.688
  302    H    HIS  38           HN       HIS  38   4.498   2.727   0.756
  303    HA   HIS  38           HA       HIS  38   3.937  -0.151   0.813
  304    HB2  HIS  38           HB2      HIS  38   2.264   2.167   1.818
  305    HB3  HIS  38           HB1      HIS  38   1.774   0.474   1.865
  306    HD2  HIS  38           HD2      HIS  38   3.738   3.003   3.922
  307    HE1  HIS  38           HE1      HIS  38   4.550  -0.822   5.538
  308    HE2  HIS  38           HE2      HIS  38   4.975   1.661   5.773
  309    H    MET  39           HN       MET  39   3.525  -0.843  -1.154
  310    HA   MET  39           HA       MET  39   1.717   0.764  -2.827
  311    HB2  MET  39           HB2      MET  39   3.766   0.962  -3.934
  312    HB3  MET  39           HB1      MET  39   4.250  -0.681  -3.535
  313    HG2  MET  39           HG2      MET  39   1.859  -0.551  -5.208
  314    HG3  MET  39           HG1      MET  39   3.281   0.177  -5.955
  315    HE1  MET  39           HE1      MET  39   5.581  -2.644  -6.780
  316    HE2  MET  39           HE2      MET  39   5.696  -1.161  -5.833
  317    HE3  MET  39           HE3      MET  39   4.825  -1.162  -7.374
  318    H    VAL  40           HN       VAL  40   0.060  -0.242  -3.761
  319    HA   VAL  40           HA       VAL  40  -0.608  -2.901  -2.959
  320    HB   VAL  40           HB       VAL  40  -2.542  -1.688  -3.202
  321   HG11  VAL  40          HG11      VAL  40  -2.918  -0.060  -5.079
  322   HG12  VAL  40          HG12      VAL  40  -1.235  -0.314  -5.535
  323   HG13  VAL  40          HG13      VAL  40  -1.629   0.361  -3.953
  324   HG21  VAL  40          HG21      VAL  40  -3.660  -2.229  -5.388
  325   HG22  VAL  40          HG22      VAL  40  -2.953  -3.609  -4.542
  326   HG23  VAL  40          HG23      VAL  40  -2.120  -2.901  -5.924
  327    H    TRP  41           HN       TRP  41   0.054  -4.682  -3.935
  328    HA   TRP  41           HA       TRP  41   1.606  -4.475  -6.385
  329    HB2  TRP  41           HB2      TRP  41   2.496  -5.661  -4.420
  330    HB3  TRP  41           HB1      TRP  41   1.154  -6.805  -4.508
  331    HD1  TRP  41           HD1      TRP  41   1.479  -8.863  -6.073
  332    HE1  TRP  41           HE1      TRP  41   3.354  -9.644  -7.665
  333    HE3  TRP  41           HE3      TRP  41   4.355  -4.641  -6.065
  334    HZ2  TRP  41           HZ2      TRP  41   5.736  -8.602  -8.763
  335    HZ3  TRP  41           HZ3      TRP  41   6.419  -4.615  -7.409
  336    HH2  TRP  41           HH2      TRP  41   7.092  -6.554  -8.728
  337    H    HIS  42           HN       HIS  42  -1.509  -5.653  -5.407
  338    HA   HIS  42           HA       HIS  42  -2.136  -6.239  -8.150
  339    HB2  HIS  42           HB2      HIS  42  -1.028  -8.345  -7.443
  340    HB3  HIS  42           HB1      HIS  42  -2.188  -8.505  -6.131
  341    HD2  HIS  42           HD2      HIS  42  -1.946  -9.024  -9.968
  342    HE1  HIS  42           HE1      HIS  42  -5.717 -10.404  -8.638
  343    HE2  HIS  42           HE2      HIS  42  -4.198 -10.119 -10.646
  344    H    VAL  43           HN       VAL  43  -4.304  -6.314  -8.545
  345    HA   VAL  43           HA       VAL  43  -6.114  -5.999  -6.251
  346    HB   VAL  43           HB       VAL  43  -6.402  -4.520  -8.876
  347   HG11  VAL  43          HG11      VAL  43  -8.497  -4.957  -7.733
  348   HG12  VAL  43          HG12      VAL  43  -8.104  -3.240  -7.663
  349   HG13  VAL  43          HG13      VAL  43  -7.850  -4.259  -6.247
  350   HG21  VAL  43          HG21      VAL  43  -4.448  -3.676  -7.672
  351   HG22  VAL  43          HG22      VAL  43  -5.435  -3.442  -6.231
  352   HG23  VAL  43          HG23      VAL  43  -5.758  -2.493  -7.680
  353    H    GLU  44           HN       GLU  44  -7.628  -7.570  -6.287
  354    HA   GLU  44           HA       GLU  44  -7.811  -9.525  -8.223
  355    HB2  GLU  44           HB2      GLU  44  -9.941  -8.620  -6.283
  356    HB3  GLU  44           HB1      GLU  44  -9.834 -10.173  -7.061
  357    HG2  GLU  44           HG2      GLU  44  -7.848  -9.086  -5.099
  358    HG3  GLU  44           HG1      GLU  44  -9.113 -10.254  -4.732
  359    H    ASP  45           HN       ASP  45  -8.899  -9.720 -10.080
  360    HA   ASP  45           HA       ASP  45  -9.912  -7.465 -11.404
  361    HB2  ASP  45           HB2      ASP  45  -9.480 -10.254 -12.016
  362    HB3  ASP  45           HB1      ASP  45 -11.027  -9.717 -12.667
  363    H    GLY  46           HN       GLY  46 -11.721  -6.423 -11.043
  364    HA2  GLY  46           HA2      GLY  46 -14.012  -6.097 -10.849
  365    HA3  GLY  46           HA1      GLY  46 -14.223  -7.839 -10.743
  366    H    GLY  47           HN       GLY  47 -11.841  -6.712  -8.639
  367    HA2  GLY  47           HA2      GLY  47 -13.432  -7.366  -6.346
  368    HA3  GLY  47           HA1      GLY  47 -11.763  -6.811  -6.336
  369    HA   PRO  48           HA       PRO  48 -14.943  -3.527  -4.798
  370    HB2  PRO  48           HB2      PRO  48 -13.048  -3.816  -2.515
  371    HB3  PRO  48           HB1      PRO  48 -14.792  -3.530  -2.471
  372    HG2  PRO  48           HG2      PRO  48 -13.891  -5.903  -1.894
  373    HG3  PRO  48           HG1      PRO  48 -15.222  -5.757  -3.049
  374    HD2  PRO  48           HD2      PRO  48 -12.320  -6.162  -3.614
  375    HD3  PRO  48           HD1      PRO  48 -13.715  -7.026  -4.259
  376    H    ALA  49           HN       ALA  49 -11.526  -3.865  -4.074
  377    HA   ALA  49           HA       ALA  49 -10.887  -1.141  -4.126
  378    HB1  ALA  49           HB1      ALA  49  -9.109  -3.504  -4.729
  379    HB2  ALA  49           HB2      ALA  49  -9.366  -2.759  -3.153
  380    HB3  ALA  49           HB3      ALA  49  -8.539  -1.862  -4.428
  381    H    SER  50           HN       SER  50 -10.992  -3.509  -6.710
  382    HA   SER  50           HA       SER  50  -9.829  -1.912  -8.726
  383    HB2  SER  50           HB2      SER  50 -10.464  -4.471  -8.664
  384    HB3  SER  50           HB1      SER  50 -11.989  -3.896  -9.329
  385    HG   SER  50           HG       SER  50  -9.539  -4.128 -10.525
  386    H    GLU  51           HN       GLU  51 -13.055  -2.333  -7.484
  387    HA   GLU  51           HA       GLU  51 -14.377  -0.753  -9.455
  388    HB2  GLU  51           HB2      GLU  51 -15.285  -1.458  -6.654
  389    HB3  GLU  51           HB1      GLU  51 -16.312  -0.855  -7.950
  390    HG2  GLU  51           HG2      GLU  51 -15.662  -2.901  -9.256
  391    HG3  GLU  51           HG1      GLU  51 -14.917  -3.504  -7.780
  392    H    ALA  52           HN       ALA  52 -12.983  -0.163  -6.335
  393    HA   ALA  52           HA       ALA  52 -13.868   2.502  -6.008
  394    HB1  ALA  52           HB1      ALA  52 -11.421   1.193  -4.844
  395    HB2  ALA  52           HB2      ALA  52 -13.052   1.026  -4.196
  396    HB3  ALA  52           HB3      ALA  52 -12.271   2.607  -4.220
  397    H    GLY  53           HN       GLY  53 -11.274   1.032  -7.787
  398    HA2  GLY  53           HA2      GLY  53 -10.429   2.352  -9.665
  399    HA3  GLY  53           HA1      GLY  53 -10.371   3.712  -8.564
  400    H    LEU  54           HN       LEU  54  -9.355   1.094  -6.826
  401    HA   LEU  54           HA       LEU  54  -6.670   2.020  -6.748
  402    HB2  LEU  54           HB2      LEU  54  -8.264   0.397  -5.183
  403    HB3  LEU  54           HB1      LEU  54  -7.062  -0.705  -5.798
  404    HG   LEU  54           HG       LEU  54  -6.732   1.626  -3.958
  405   HD11  LEU  54          HD11      LEU  54  -6.945  -0.679  -3.106
  406   HD12  LEU  54          HD12      LEU  54  -5.391   0.064  -2.709
  407   HD13  LEU  54          HD13      LEU  54  -5.498  -1.121  -4.014
  408   HD21  LEU  54          HD21      LEU  54  -5.164   2.218  -5.640
  409   HD22  LEU  54          HD22      LEU  54  -4.625   0.551  -5.816
  410   HD23  LEU  54          HD23      LEU  54  -4.258   1.447  -4.341
  411    H    ARG  55           HN       ARG  55  -4.937   1.371  -7.789
  412    HA   ARG  55           HA       ARG  55  -5.151  -0.890  -9.667
  413    HB2  ARG  55           HB2      ARG  55  -3.417   1.551 -10.038
  414    HB3  ARG  55           HB1      ARG  55  -3.804   0.315 -11.229
  415    HG2  ARG  55           HG2      ARG  55  -5.919   2.054 -10.017
  416    HG3  ARG  55           HG1      ARG  55  -4.984   2.559 -11.420
  417    HD2  ARG  55           HD2      ARG  55  -5.833   0.834 -12.751
  418    HD3  ARG  55           HD1      ARG  55  -6.376  -0.088 -11.351
  419    HE   ARG  55           HE       ARG  55  -7.657   2.484 -11.918
  420   HH11  ARG  55          HH11      ARG  55  -7.811  -1.015 -11.853
  421   HH12  ARG  55          HH12      ARG  55  -9.540  -1.068 -11.977
  422   HH21  ARG  55          HH21      ARG  55  -9.930   2.417 -12.113
  423   HH22  ARG  55          HH22      ARG  55 -10.749   0.889 -12.119
  424    H    GLN  56           HN       GLN  56  -2.867  -1.720 -10.235
  425    HA   GLN  56           HA       GLN  56  -1.407  -1.912  -7.701
  426    HB2  GLN  56           HB2      GLN  56  -0.320  -3.766  -9.556
  427    HB3  GLN  56           HB1      GLN  56  -1.224  -4.088  -8.095
  428    HG2  GLN  56           HG2      GLN  56  -3.110  -4.600  -9.178
  429    HG3  GLN  56           HG1      GLN  56  -2.824  -3.430 -10.442
  430   HE21  GLN  56          HE21      GLN  56  -1.442  -3.976 -12.183
  431   HE22  GLN  56          HE22      GLN  56  -1.133  -5.629 -12.573
  432    H    GLY  57           HN       GLY  57   0.693  -1.373  -7.508
  433    HA2  GLY  57           HA2      GLY  57   2.838  -0.817  -8.333
  434    HA3  GLY  57           HA1      GLY  57   2.135  -0.502  -9.905
  435    H    ASP  58           HN       ASP  58   0.229   0.887  -7.526
  436    HA   ASP  58           HA       ASP  58   1.198   3.546  -8.166
  437    HB2  ASP  58           HB2      ASP  58  -1.008   2.621  -6.307
  438    HB3  ASP  58           HB1      ASP  58  -0.658   4.300  -6.678
  439    H    LEU  59           HN       LEU  59   0.581   4.761  -5.667
  440    HA   LEU  59           HA       LEU  59   2.388   3.549  -3.767
  441    HB2  LEU  59           HB2      LEU  59   2.775   6.146  -5.137
  442    HB3  LEU  59           HB1      LEU  59   3.052   6.140  -3.405
  443    HG   LEU  59           HG       LEU  59   4.465   4.473  -5.469
  444   HD11  LEU  59          HD11      LEU  59   5.164   6.827  -5.342
  445   HD12  LEU  59          HD12      LEU  59   6.431   5.732  -4.791
  446   HD13  LEU  59          HD13      LEU  59   5.472   6.630  -3.617
  447   HD21  LEU  59          HD21      LEU  59   4.567   4.398  -2.467
  448   HD22  LEU  59          HD22      LEU  59   5.885   3.800  -3.473
  449   HD23  LEU  59          HD23      LEU  59   4.287   3.064  -3.587
  450    H    ILE  60           HN       ILE  60   1.193   3.340  -1.996
  451    HA   ILE  60           HA       ILE  60  -1.038   5.116  -1.549
  452    HB   ILE  60           HB       ILE  60   0.004   2.814   0.120
  453   HG12  ILE  60          HG12      ILE  60  -2.555   2.903  -1.478
  454   HG13  ILE  60          HG11      ILE  60  -1.035   2.386  -2.204
  455   HG21  ILE  60          HG21      ILE  60  -2.457   4.525   0.442
  456   HG22  ILE  60          HG22      ILE  60  -1.119   4.345   1.576
  457   HG23  ILE  60          HG23      ILE  60  -2.207   2.990   1.275
  458   HD11  ILE  60          HD11      ILE  60  -2.378   0.495  -1.477
  459   HD12  ILE  60          HD12      ILE  60  -2.372   1.114   0.175
  460   HD13  ILE  60          HD13      ILE  60  -0.864   0.588  -0.574
  461    H    THR  61           HN       THR  61  -0.534   7.069  -0.836
  462    HA   THR  61           HA       THR  61   1.744   7.445   0.918
  463    HB   THR  61           HB       THR  61   1.651   9.018  -0.843
  464    HG1  THR  61           HG1      THR  61   0.548  10.478   1.326
  465   HG21  THR  61          HG21      THR  61  -0.712   8.756  -1.450
  466   HG22  THR  61          HG22      THR  61  -0.267  10.458  -1.302
  467   HG23  THR  61          HG23      THR  61  -1.179   9.672  -0.013
  468    H    HIS  62           HN       HIS  62  -1.770   7.578   1.079
  469    HA   HIS  62           HA       HIS  62  -1.519   7.821   3.986
  470    HB2  HIS  62           HB2      HIS  62  -3.424   9.570   2.422
  471    HB3  HIS  62           HB1      HIS  62  -3.340   9.451   4.163
  472    HD2  HIS  62           HD2      HIS  62  -1.484  11.002   5.393
  473    HE1  HIS  62           HE1      HIS  62   0.104  12.692   1.856
  474    HE2  HIS  62           HE2      HIS  62  -0.099  12.939   4.367
  475    H    VAL  63           HN       VAL  63  -3.103   6.866   5.140
  476    HA   VAL  63           HA       VAL  63  -5.178   5.419   3.627
  477    HB   VAL  63           HB       VAL  63  -3.678   4.482   6.083
  478   HG11  VAL  63          HG11      VAL  63  -5.883   3.075   4.582
  479   HG12  VAL  63          HG12      VAL  63  -6.093   3.914   6.118
  480   HG13  VAL  63          HG13      VAL  63  -5.046   2.500   6.023
  481   HG21  VAL  63          HG21      VAL  63  -2.435   4.237   3.972
  482   HG22  VAL  63          HG22      VAL  63  -3.785   3.324   3.297
  483   HG23  VAL  63          HG23      VAL  63  -2.878   2.675   4.663
  484    H    ASN  64           HN       ASN  64  -7.112   6.229   4.104
  485    HA   ASN  64           HA       ASN  64  -8.871   7.115   5.237
  486    HB2  ASN  64           HB2      ASN  64  -7.344   6.175   7.678
  487    HB3  ASN  64           HB1      ASN  64  -8.983   6.813   7.720
  488   HD21  ASN  64          HD21      ASN  64  -7.862   4.193   8.433
  489   HD22  ASN  64          HD22      ASN  64  -8.759   3.036   7.519
  490    H    GLY  65           HN       GLY  65  -6.248   8.560   4.738
  491    HA2  GLY  65           HA2      GLY  65  -5.872  10.871   4.786
  492    HA3  GLY  65           HA1      GLY  65  -7.004  11.005   6.125
  493    H    GLU  66           HN       GLU  66  -4.759   8.491   6.529
  494    HA   GLU  66           HA       GLU  66  -3.260  10.142   8.441
  495    HB2  GLU  66           HB2      GLU  66  -3.368   7.137   8.356
  496    HB3  GLU  66           HB1      GLU  66  -2.856   8.160   9.690
  497    HG2  GLU  66           HG2      GLU  66  -5.661   8.123   8.633
  498    HG3  GLU  66           HG1      GLU  66  -5.103   7.057   9.911
  499    HA   PRO  67           HA       PRO  67   0.288   9.632   5.770
  500    HB2  PRO  67           HB2      PRO  67   1.901  10.345   8.115
  501    HB3  PRO  67           HB1      PRO  67   1.719  11.209   6.586
  502    HG2  PRO  67           HG2      PRO  67   0.671  12.135   8.892
  503    HG3  PRO  67           HG1      PRO  67  -0.108  12.396   7.325
  504    HD2  PRO  67           HD2      PRO  67  -0.774  10.423   9.452
  505    HD3  PRO  67           HD1      PRO  67  -1.859  11.385   8.435
  506    H    VAL  68           HN       VAL  68   1.032   7.663   5.335
  507    HA   VAL  68           HA       VAL  68   1.747   5.907   7.587
  508    HB   VAL  68           HB       VAL  68   1.409   4.020   6.096
  509   HG11  VAL  68          HG11      VAL  68  -1.008   4.159   5.885
  510   HG12  VAL  68          HG12      VAL  68  -0.938   5.914   6.048
  511   HG13  VAL  68          HG13      VAL  68  -0.478   4.882   7.403
  512   HG21  VAL  68          HG21      VAL  68   0.477   4.299   3.861
  513   HG22  VAL  68          HG22      VAL  68   2.046   5.095   3.988
  514   HG23  VAL  68          HG23      VAL  68   0.566   6.053   4.031
  515    H    HIS  69           HN       HIS  69   3.279   7.934   5.694
  516    HA   HIS  69           HA       HIS  69   5.328   6.341   4.516
  517    HB2  HIS  69           HB2      HIS  69   4.608   8.716   3.865
  518    HB3  HIS  69           HB1      HIS  69   5.563   9.261   5.236
  519    HD2  HIS  69           HD2      HIS  69   8.354   8.076   4.967
  520    HE1  HIS  69           HE1      HIS  69   8.144   8.812   0.806
  521    HE2  HIS  69           HE2      HIS  69   9.692   8.508   2.789
  522    H    GLY  70           HN       GLY  70   6.078   4.991   6.168
  523    HA2  GLY  70           HA2      GLY  70   8.351   5.264   7.390
  524    HA3  GLY  70           HA1      GLY  70   7.390   6.283   8.452
  525    H    LEU  71           HN       LEU  71   5.005   4.539   8.089
  526    HA   LEU  71           HA       LEU  71   5.380   2.872  10.318
  527    HB2  LEU  71           HB2      LEU  71   3.289   2.917   8.169
  528    HB3  LEU  71           HB1      LEU  71   3.223   1.845   9.542
  529    HG   LEU  71           HG       LEU  71   3.170   4.820   9.648
  530   HD11  LEU  71          HD11      LEU  71   1.164   4.102   8.756
  531   HD12  LEU  71          HD12      LEU  71   0.841   4.350  10.475
  532   HD13  LEU  71          HD13      LEU  71   1.086   2.714   9.844
  533   HD21  LEU  71          HD21      LEU  71   2.596   4.504  12.026
  534   HD22  LEU  71          HD22      LEU  71   4.226   3.951  11.641
  535   HD23  LEU  71          HD23      LEU  71   2.922   2.782  11.840
  536    H    VAL  72           HN       VAL  72   4.907   0.607  10.385
  537    HA   VAL  72           HA       VAL  72   6.523  -0.909   8.555
  538    HB   VAL  72           HB       VAL  72   5.793  -2.854   9.952
  539   HG11  VAL  72          HG11      VAL  72   6.933  -2.092  12.046
  540   HG12  VAL  72          HG12      VAL  72   6.967  -0.469  11.362
  541   HG13  VAL  72          HG13      VAL  72   7.829  -1.782  10.559
  542   HG21  VAL  72          HG21      VAL  72   3.850  -0.900  10.865
  543   HG22  VAL  72          HG22      VAL  72   4.735  -1.631  12.212
  544   HG23  VAL  72          HG23      VAL  72   3.875  -2.657  11.065
  545    H    HIS  73           HN       HIS  73   5.481  -3.048   7.755
  546    HA   HIS  73           HA       HIS  73   3.456  -2.401   5.932
  547    HB2  HIS  73           HB2      HIS  73   5.100  -4.234   5.639
  548    HB3  HIS  73           HB1      HIS  73   4.277  -5.145   6.897
  549    HD1  HIS  73           HD1      HIS  73   3.097  -3.427   3.685
  550    HD2  HIS  73           HD2      HIS  73   2.711  -6.993   5.784
  551    HE1  HIS  73           HE1      HIS  73   1.562  -4.895   2.319
  552    H    THR  74           HN       THR  74   3.326  -3.995   9.074
  553    HA   THR  74           HA       THR  74   0.563  -4.666   8.844
  554    HB   THR  74           HB       THR  74   0.798  -5.098  11.338
  555    HG1  THR  74           HG1      THR  74   2.609  -4.444  12.230
  556   HG21  THR  74          HG21      THR  74   2.609  -6.460   9.345
  557   HG22  THR  74          HG22      THR  74   0.936  -6.881   9.718
  558   HG23  THR  74          HG23      THR  74   2.193  -7.116  10.930
  559    H    GLU  75           HN       GLU  75   2.233  -1.811  10.132
  560    HA   GLU  75           HA       GLU  75   0.118  -0.879  11.705
  561    HB2  GLU  75           HB2      GLU  75   2.422   0.537  10.390
  562    HB3  GLU  75           HB1      GLU  75   1.144   1.409  11.151
  563    HG2  GLU  75           HG2      GLU  75   2.535  -0.753  12.618
  564    HG3  GLU  75           HG1      GLU  75   3.171   0.894  12.575
  565    H    VAL  76           HN       VAL  76   0.949  -0.332   8.341
  566    HA   VAL  76           HA       VAL  76  -1.291   1.368   7.851
  567    HB   VAL  76           HB       VAL  76  -0.688   1.307   5.534
  568   HG11  VAL  76          HG11      VAL  76   0.785   2.517   7.149
  569   HG12  VAL  76          HG12      VAL  76   1.575   2.064   5.636
  570   HG13  VAL  76          HG13      VAL  76   1.875   1.133   7.103
  571   HG21  VAL  76          HG21      VAL  76   0.947  -0.206   4.594
  572   HG22  VAL  76          HG22      VAL  76  -0.365  -1.132   5.324
  573   HG23  VAL  76          HG23      VAL  76   1.178  -0.976   6.163
  574    H    VAL  77           HN       VAL  77  -0.654  -2.089   7.543
  575    HA   VAL  77           HA       VAL  77  -2.952  -2.842   6.129
  576    HB   VAL  77           HB       VAL  77  -1.158  -4.282   8.068
  577   HG11  VAL  77          HG11      VAL  77  -3.462  -5.151   8.411
  578   HG12  VAL  77          HG12      VAL  77  -2.330  -6.342   7.770
  579   HG13  VAL  77          HG13      VAL  77  -3.508  -5.580   6.699
  580   HG21  VAL  77          HG21      VAL  77  -0.628  -5.619   6.088
  581   HG22  VAL  77          HG22      VAL  77  -0.353  -3.901   5.806
  582   HG23  VAL  77          HG23      VAL  77  -1.789  -4.684   5.146
  583    H    GLU  78           HN       GLU  78  -2.368  -2.663   9.624
  584    HA   GLU  78           HA       GLU  78  -4.953  -3.308  10.450
  585    HB2  GLU  78           HB2      GLU  78  -2.889  -1.604  11.737
  586    HB3  GLU  78           HB1      GLU  78  -4.366  -2.091  12.533
  587    HG2  GLU  78           HG2      GLU  78  -3.645  -4.425  11.883
  588    HG3  GLU  78           HG1      GLU  78  -2.048  -3.737  11.703
  589    H    LEU  79           HN       LEU  79  -3.418  -0.247   9.909
  590    HA   LEU  79           HA       LEU  79  -5.382   1.564  10.500
  591    HB2  LEU  79           HB2      LEU  79  -2.992   1.618   9.075
  592    HB3  LEU  79           HB1      LEU  79  -4.186   2.217   7.940
  593    HG   LEU  79           HG       LEU  79  -4.894   3.834   9.783
  594   HD11  LEU  79          HD11      LEU  79  -2.181   3.090  10.865
  595   HD12  LEU  79          HD12      LEU  79  -3.718   2.647  11.604
  596   HD13  LEU  79          HD13      LEU  79  -3.259   4.345  11.478
  597   HD21  LEU  79          HD21      LEU  79  -3.880   5.010   8.166
  598   HD22  LEU  79          HD22      LEU  79  -2.543   3.862   8.031
  599   HD23  LEU  79          HD23      LEU  79  -2.539   5.081   9.310
  600    H    ILE  80           HN       ILE  80  -4.921   0.109   7.255
  601    HA   ILE  80           HA       ILE  80  -7.219   0.974   6.031
  602    HB   ILE  80           HB       ILE  80  -5.803  -1.674   5.805
  603   HG12  ILE  80          HG12      ILE  80  -5.516   0.588   3.895
  604   HG13  ILE  80          HG11      ILE  80  -4.667   0.655   5.423
  605   HG21  ILE  80          HG21      ILE  80  -7.944  -1.930   4.842
  606   HG22  ILE  80          HG22      ILE  80  -6.788  -1.747   3.521
  607   HG23  ILE  80          HG23      ILE  80  -7.821  -0.394   3.986
  608   HD11  ILE  80          HD11      ILE  80  -3.479  -1.305   4.959
  609   HD12  ILE  80          HD12      ILE  80  -3.355  -0.274   3.532
  610   HD13  ILE  80          HD13      ILE  80  -4.457  -1.655   3.533
  611    H    LEU  81           HN       LEU  81  -6.732  -2.088   7.751
  612    HA   LEU  81           HA       LEU  81  -9.298  -3.101   7.627
  613    HB2  LEU  81           HB2      LEU  81  -7.196  -3.359   9.761
  614    HB3  LEU  81           HB1      LEU  81  -8.672  -4.300   9.769
  615    HG   LEU  81           HG       LEU  81  -6.627  -4.347   7.550
  616   HD11  LEU  81          HD11      LEU  81  -6.024  -6.552   8.412
  617   HD12  LEU  81          HD12      LEU  81  -7.131  -6.326   9.765
  618   HD13  LEU  81          HD13      LEU  81  -5.716  -5.286   9.601
  619   HD21  LEU  81          HD21      LEU  81  -7.867  -6.354   6.831
  620   HD22  LEU  81          HD22      LEU  81  -8.843  -4.888   6.756
  621   HD23  LEU  81          HD23      LEU  81  -9.071  -6.031   8.077
  622    H    LYS  82           HN       LYS  82  -7.987  -0.863  10.057
  623    HA   LYS  82           HA       LYS  82 -10.182  -0.844  11.768
  624    HB2  LYS  82           HB2      LYS  82  -8.116   1.271  11.266
  625    HB3  LYS  82           HB1      LYS  82  -9.241   1.269  12.621
  626    HG2  LYS  82           HG2      LYS  82  -8.334  -1.017  13.170
  627    HG3  LYS  82           HG1      LYS  82  -7.068  -0.678  12.017
  628    HD2  LYS  82           HD2      LYS  82  -7.503   1.463  13.971
  629    HD3  LYS  82           HD1      LYS  82  -6.961  -0.060  14.677
  630    HE2  LYS  82           HE2      LYS  82  -5.117  -0.067  12.958
  631    HE3  LYS  82           HE1      LYS  82  -5.603   1.576  12.543
  632    HZ1  LYS  82           HZ1      LYS  82  -5.023   2.337  14.683
  633    HZ2  LYS  82           HZ2      LYS  82  -3.732   1.366  14.184
  634    HZ3  LYS  82           HZ3      LYS  82  -4.856   0.771  15.296
  635    H    SER  83           HN       SER  83  -9.800   0.751   8.711
  636    HA   SER  83           HA       SER  83 -11.306   3.025   8.924
  637    HB2  SER  83           HB2      SER  83 -11.676   2.887   6.562
  638    HB3  SER  83           HB1      SER  83 -10.094   2.181   6.886
  639    HG   SER  83           HG       SER  83 -12.333   1.037   5.836
  640    H    GLY  84           HN       GLY  84 -12.623  -0.203   8.125
  641    HA2  GLY  84           HA2      GLY  84 -14.669  -1.110   8.728
  642    HA3  GLY  84           HA1      GLY  84 -15.042   0.376   9.584
  643    H    ASN  85           HN       ASN  85 -15.989  -1.535   7.149
  644    HA   ASN  85           HA       ASN  85 -17.607  -1.359   5.576
  645    HB2  ASN  85           HB2      ASN  85 -18.933   0.140   6.808
  646    HB3  ASN  85           HB1      ASN  85 -17.772   1.451   6.637
  647   HD21  ASN  85          HD21      ASN  85 -20.060  -0.544   4.867
  648   HD22  ASN  85          HD22      ASN  85 -20.403   0.628   3.648
  649    H    LYS  86           HN       LYS  86 -15.553   1.534   5.421
  650    HA   LYS  86           HA       LYS  86 -14.708   0.764   2.776
  651    HB2  LYS  86           HB2      LYS  86 -15.106   2.951   1.837
  652    HB3  LYS  86           HB1      LYS  86 -16.609   2.266   2.394
  653    HG2  LYS  86           HG2      LYS  86 -16.144   3.575   4.563
  654    HG3  LYS  86           HG1      LYS  86 -15.011   4.467   3.556
  655    HD2  LYS  86           HD2      LYS  86 -16.949   4.829   1.957
  656    HD3  LYS  86           HD1      LYS  86 -17.980   4.233   3.261
  657    HE2  LYS  86           HE2      LYS  86 -17.026   6.000   4.734
  658    HE3  LYS  86           HE1      LYS  86 -16.170   6.642   3.332
  659    HZ1  LYS  86           HZ1      LYS  86 -18.309   7.769   3.853
  660    HZ2  LYS  86           HZ2      LYS  86 -19.118   6.338   3.459
  661    HZ3  LYS  86           HZ3      LYS  86 -18.220   7.153   2.280
  662    H    VAL  87           HN       VAL  87 -12.916   2.067   2.094
  663    HA   VAL  87           HA       VAL  87 -11.513   3.435   4.272
  664    HB   VAL  87           HB       VAL  87 -10.718   1.182   4.445
  665   HG11  VAL  87          HG11      VAL  87 -11.355   0.379   2.256
  666   HG12  VAL  87          HG12      VAL  87  -9.653   0.019   2.564
  667   HG13  VAL  87          HG13      VAL  87 -10.092   1.359   1.503
  668   HG21  VAL  87          HG21      VAL  87  -9.009   2.805   4.825
  669   HG22  VAL  87          HG22      VAL  87  -8.738   3.013   3.096
  670   HG23  VAL  87          HG23      VAL  87  -8.288   1.502   3.880
  671    H    ALA  88           HN       ALA  88 -10.485   5.207   3.630
  672    HA   ALA  88           HA       ALA  88 -10.438   5.808   0.776
  673    HB1  ALA  88           HB1      ALA  88 -11.396   7.479   2.278
  674    HB2  ALA  88           HB2      ALA  88  -9.976   8.094   1.432
  675    HB3  ALA  88           HB3      ALA  88  -9.853   7.602   3.124
  676    H    ILE  89           HN       ILE  89  -8.721   5.176  -0.253
  677    HA   ILE  89           HA       ILE  89  -6.122   5.219   1.119
  678    HB   ILE  89           HB       ILE  89  -6.806   3.733  -1.414
  679   HG12  ILE  89          HG12      ILE  89  -7.344   3.072   1.410
  680   HG13  ILE  89          HG11      ILE  89  -8.086   2.471  -0.060
  681   HG21  ILE  89          HG21      ILE  89  -4.439   4.230  -1.036
  682   HG22  ILE  89          HG22      ILE  89  -4.793   2.500  -0.979
  683   HG23  ILE  89          HG23      ILE  89  -4.534   3.397   0.515
  684   HD11  ILE  89          HD11      ILE  89  -7.042   0.653   1.083
  685   HD12  ILE  89          HD12      ILE  89  -5.509   1.525   1.154
  686   HD13  ILE  89          HD13      ILE  89  -6.146   0.987  -0.399
  687    H    SER  90           HN       SER  90  -4.939   6.965   0.652
  688    HA   SER  90           HA       SER  90  -5.410   8.488  -1.746
  689    HB2  SER  90           HB2      SER  90  -3.328   8.803   0.428
  690    HB3  SER  90           HB1      SER  90  -3.640   9.965  -0.859
  691    HG   SER  90           HG       SER  90  -5.761   9.128   0.774
  692    H    THR  91           HN       THR  91  -4.694   7.643  -3.595
  693    HA   THR  91           HA       THR  91  -2.092   6.307  -3.594
  694    HB   THR  91           HB       THR  91  -2.852   5.529  -5.917
  695    HG1  THR  91           HG1      THR  91  -4.598   7.135  -6.003
  696   HG21  THR  91          HG21      THR  91  -2.867   3.946  -4.141
  697   HG22  THR  91          HG22      THR  91  -4.437   3.814  -4.946
  698   HG23  THR  91          HG23      THR  91  -4.295   4.678  -3.411
  699    H    THR  92           HN       THR  92  -0.491   6.874  -4.968
  700    HA   THR  92           HA       THR  92  -0.823   9.114  -6.802
  701    HB   THR  92           HB       THR  92  -0.160  10.281  -4.817
  702    HG1  THR  92           HG1      THR  92   2.312   9.843  -6.156
  703   HG21  THR  92          HG21      THR  92   0.566   8.333  -3.512
  704   HG22  THR  92          HG22      THR  92   1.741   9.650  -3.433
  705   HG23  THR  92          HG23      THR  92   2.048   8.254  -4.466
  706    HA   PRO  93           HA       PRO  93   1.762   6.753  -9.538
  707    HB2  PRO  93           HB2      PRO  93   3.541   9.141  -9.583
  708    HB3  PRO  93           HB1      PRO  93   2.941   8.180 -10.932
  709    HG2  PRO  93           HG2      PRO  93   1.830  10.530 -10.373
  710    HG3  PRO  93           HG1      PRO  93   0.819   9.152 -10.846
  711    HD2  PRO  93           HD2      PRO  93   1.203  10.383  -8.162
  712    HD3  PRO  93           HD1      PRO  93  -0.225   9.579  -8.843
  713    H    LEU  94           HN       LEU  94   3.582   5.558  -9.583
  714    HA   LEU  94           HA       LEU  94   5.376   5.768  -7.266
  715    HB2  LEU  94           HB2      LEU  94   4.302   3.656  -7.155
  716    HB3  LEU  94           HB1      LEU  94   4.455   3.400  -8.884
  717    HG   LEU  94           HG       LEU  94   6.950   3.211  -8.555
  718   HD11  LEU  94          HD11      LEU  94   6.172   3.094  -5.647
  719   HD12  LEU  94          HD12      LEU  94   7.125   4.358  -6.425
  720   HD13  LEU  94          HD13      LEU  94   7.763   2.718  -6.310
  721   HD21  LEU  94          HD21      LEU  94   6.856   0.922  -7.756
  722   HD22  LEU  94          HD22      LEU  94   5.491   1.255  -8.822
  723   HD23  LEU  94          HD23      LEU  94   5.253   1.202  -7.076
  724    H    GLU  95           HN       GLU  95   6.598   7.361  -8.358
  725    HA   GLU  95           HA       GLU  95   8.089   6.390 -10.684
  726    HB2  GLU  95           HB2      GLU  95   7.928   9.193  -9.620
  727    HB3  GLU  95           HB1      GLU  95   8.652   8.693 -11.135
  728    HG2  GLU  95           HG2      GLU  95   5.718   8.423 -10.470
  729    HG3  GLU  95           HG1      GLU  95   6.430   9.726 -11.425
  730    H    ASN  96           HN       ASN  96  10.085   5.837 -10.462
  731    HA   ASN  96           HA       ASN  96  11.814   6.976  -8.447
  732    HB2  ASN  96           HB2      ASN  96  10.547   4.922  -7.457
  733    HB3  ASN  96           HB1      ASN  96  11.607   3.973  -8.496
  734   HD21  ASN  96          HD21      ASN  96  13.963   4.401  -8.245
  735   HD22  ASN  96          HD22      ASN  96  14.556   4.761  -6.657
  736    H2   PRO  97           HT1      PRO  97  16.419  -6.326  -5.687
  737    H3   PRO  97           HT2      PRO  97  17.147  -5.193  -6.617
  738    HA   PRO  97           HA       PRO  97  15.397  -4.745  -7.814
  739    HB2  PRO  97           HB2      PRO  97  13.698  -7.053  -7.434
  740    HB3  PRO  97           HB1      PRO  97  14.347  -6.389  -8.940
  741    HG2  PRO  97           HG2      PRO  97  15.394  -8.556  -7.251
  742    HG3  PRO  97           HG1      PRO  97  15.696  -8.217  -8.963
  743    HD2  PRO  97           HD2      PRO  97  17.605  -7.830  -7.127
  744    HD3  PRO  97           HD1      PRO  97  17.416  -6.713  -8.491
  745    H    PHE  98           HN       PHE  98  13.705  -3.571  -7.013
  746    HA   PHE  98           HA       PHE  98  13.271  -3.629  -4.193
  747    HB2  PHE  98           HB2      PHE  98  11.944  -1.699  -4.478
  748    HB3  PHE  98           HB1      PHE  98  13.192  -1.573  -5.708
  749    HD1  PHE  98           HD1      PHE  98  12.523  -2.501  -8.074
  750    HD2  PHE  98           HD2      PHE  98   9.745  -1.356  -5.062
  751    HE1  PHE  98           HE1      PHE  98  10.788  -2.200  -9.791
  752    HE2  PHE  98           HE2      PHE  98   8.005  -1.049  -6.776
  753    HZ   PHE  98           HZ       PHE  98   8.528  -1.475  -9.144
  754    H    ASP  99           HN       ASP  99  11.863  -5.221  -6.831
  755    HA   ASP  99           HA       ASP  99   9.344  -5.776  -5.484
  756    HB2  ASP  99           HB2      ASP  99   8.856  -7.090  -7.577
  757    HB3  ASP  99           HB1      ASP  99   9.145  -5.372  -7.829
  758    H    GLU 100           HN       GLU 100  12.011  -6.775  -4.528
  759    HA   GLU 100           HA       GLU 100  12.060  -9.601  -4.908
  760    HB2  GLU 100           HB2      GLU 100  13.412  -7.682  -3.052
  761    HB3  GLU 100           HB1      GLU 100  13.471  -9.401  -2.693
  762    HG2  GLU 100           HG2      GLU 100  14.662  -9.874  -4.668
  763    HG3  GLU 100           HG1      GLU 100  14.330  -8.275  -5.339
  764    H    ASP 101           HN       ASP 101  12.032 -11.001  -2.798
  765    HA   ASP 101           HA       ASP 101   9.546 -10.363  -1.344
  766    HB2  ASP 101           HB2      ASP 101   9.374 -12.838  -0.971
  767    HB3  ASP 101           HB1      ASP 101   9.243 -12.357  -2.658
  768    H    GLN 102           HN       GLN 102  12.726 -10.229  -1.024
  769    HA   GLN 102           HA       GLN 102  13.271 -11.550   1.415
  770    HB2  GLN 102           HB2      GLN 102  14.692  -9.166   0.210
  771    HB3  GLN 102           HB1      GLN 102  15.339 -10.273   1.415
  772    HG2  GLN 102           HG2      GLN 102  14.518 -11.106  -1.357
  773    HG3  GLN 102           HG1      GLN 102  16.161 -10.653  -0.906
  774   HE21  GLN 102          HE21      GLN 102  13.682 -13.075  -0.669
  775   HE22  GLN 102          HE22      GLN 102  14.676 -14.294   0.055
  776    H    HIS 103           HN       HIS 103  13.532  -8.036   1.036
  777    HA   HIS 103           HA       HIS 103  12.493  -7.732   3.743
  778    HB2  HIS 103           HB2      HIS 103  13.558  -5.531   1.978
  779    HB3  HIS 103           HB1      HIS 103  13.413  -5.540   3.729
  780    HD2  HIS 103           HD2      HIS 103  15.208  -7.607   4.917
  781    HE1  HIS 103           HE1      HIS 103  18.006  -6.975   1.806
  782    HE2  HIS 103           HE2      HIS 103  17.686  -7.816   4.175
  783    H    THR 104           HN       THR 104  11.488  -7.391   0.504
  784    HA   THR 104           HA       THR 104   9.454  -5.432   0.961
  785    HB   THR 104           HB       THR 104   9.788  -7.399  -1.314
  786    HG1  THR 104           HG1      THR 104  10.481  -5.244  -2.313
  787   HG21  THR 104          HG21      THR 104   7.562  -6.693  -1.439
  788   HG22  THR 104          HG22      THR 104   8.417  -5.596  -2.523
  789   HG23  THR 104          HG23      THR 104   7.954  -5.057  -0.909
  790    H    GLN 105           HN       GLN 105   7.924  -5.953   2.403
  791    HA   GLN 105           HA       GLN 105   7.036  -8.650   2.808
  792    HB2  GLN 105           HB2      GLN 105   6.556  -6.033   4.056
  793    HB3  GLN 105           HB1      GLN 105   5.184  -7.127   4.109
  794    HG2  GLN 105           HG2      GLN 105   6.479  -7.361   6.115
  795    HG3  GLN 105           HG1      GLN 105   6.615  -8.834   5.153
  796   HE21  GLN 105          HE21      GLN 105   8.576  -9.380   4.247
  797   HE22  GLN 105          HE22      GLN 105  10.052  -8.595   4.687
  798    H    ILE 106           HN       ILE 106   4.755  -9.288   2.724
  799    HA   ILE 106           HA       ILE 106   3.067  -7.866   0.853
  800    HB   ILE 106           HB       ILE 106   4.219  -9.074  -0.787
  801   HG12  ILE 106          HG12      ILE 106   1.831 -10.784  -0.061
  802   HG13  ILE 106          HG11      ILE 106   1.762  -9.271  -0.959
  803   HG21  ILE 106          HG21      ILE 106   5.429 -10.562   0.777
  804   HG22  ILE 106          HG22      ILE 106   4.851 -11.387  -0.671
  805   HG23  ILE 106          HG23      ILE 106   3.996 -11.586   0.857
  806   HD11  ILE 106          HD11      ILE 106   1.602 -11.036  -2.520
  807   HD12  ILE 106          HD12      ILE 106   2.988 -11.873  -1.824
  808   HD13  ILE 106          HD13      ILE 106   3.219 -10.353  -2.686
  809    H    THR 107           HN       THR 107   1.081  -7.930   1.597
  810    HA   THR 107           HA       THR 107  -0.031 -10.352   2.744
  811    HB   THR 107           HB       THR 107   0.211  -7.792   4.340
  812    HG1  THR 107           HG1      THR 107   1.694 -10.012   4.226
  813   HG21  THR 107          HG21      THR 107  -2.020  -8.725   4.642
  814   HG22  THR 107          HG22      THR 107  -1.053  -8.981   6.097
  815   HG23  THR 107          HG23      THR 107  -1.331 -10.313   4.976
  816    H    LYS 108           HN       LYS 108  -2.082 -10.559   2.066
  817    HA   LYS 108           HA       LYS 108  -3.346  -8.401   0.638
  818    HB2  LYS 108           HB2      LYS 108  -4.399 -11.143   1.385
  819    HB3  LYS 108           HB1      LYS 108  -5.209 -10.009   0.313
  820    HG2  LYS 108           HG2      LYS 108  -2.970 -10.134  -1.033
  821    HG3  LYS 108           HG1      LYS 108  -2.765 -11.650  -0.155
  822    HD2  LYS 108           HD2      LYS 108  -4.938 -12.423  -0.998
  823    HD3  LYS 108           HD1      LYS 108  -5.126 -10.911  -1.888
  824    HE2  LYS 108           HE2      LYS 108  -2.984 -11.457  -3.076
  825    HE3  LYS 108           HE1      LYS 108  -3.040 -13.043  -2.312
  826    HZ1  LYS 108           HZ1      LYS 108  -3.956 -13.065  -4.553
  827    HZ2  LYS 108           HZ2      LYS 108  -5.133 -11.934  -4.112
  828    HZ3  LYS 108           HZ3      LYS 108  -5.132 -13.476  -3.411
  829    H    VAL 109           HN       VAL 109  -5.078  -7.159   1.349
  830    HA   VAL 109           HA       VAL 109  -5.632  -7.439   4.221
  831    HB   VAL 109           HB       VAL 109  -4.403  -5.439   3.828
  832   HG11  VAL 109          HG11      VAL 109  -4.748  -5.232   1.440
  833   HG12  VAL 109          HG12      VAL 109  -5.117  -3.710   2.255
  834   HG13  VAL 109          HG13      VAL 109  -6.428  -4.754   1.708
  835   HG21  VAL 109          HG21      VAL 109  -6.074  -5.112   5.465
  836   HG22  VAL 109          HG22      VAL 109  -7.329  -4.903   4.246
  837   HG23  VAL 109          HG23      VAL 109  -6.081  -3.673   4.445
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1   4.048  19.914  -2.317
    2    H2   GLY   1           HT2      GLY   1   3.781  20.759  -3.758
    3    H3   GLY   1           HT3      GLY   1   3.917  19.075  -3.780
    4    HA2  GLY   1           HA1      GLY   1   1.746  20.626  -2.490
    5    HA3  GLY   1           HA2      GLY   1   1.620  19.745  -4.005
    6    H    GLY   2           HN       GLY   2   0.657  19.575  -0.976
    7    HA2  GLY   2           HA2      GLY   2   1.317  16.801  -0.411
    8    HA3  GLY   2           HA1      GLY   2   0.326  17.866   0.578
    9    H    SER   3           HN       SER   3  -1.715  18.618  -0.808
   10    HA   SER   3           HA       SER   3  -3.153  16.162  -1.346
   11    HB2  SER   3           HB2      SER   3  -4.151  19.022  -1.408
   12    HB3  SER   3           HB1      SER   3  -5.142  17.565  -1.358
   13    HG   SER   3           HG       SER   3  -3.865  17.151   0.686
   14    H    MET   4           HN       MET   4  -3.355  15.341  -3.326
   15    HA   MET   4           HA       MET   4  -3.690  17.048  -5.622
   16    HB2  MET   4           HB2      MET   4  -1.300  17.109  -5.578
   17    HB3  MET   4           HB1      MET   4  -1.196  15.380  -5.283
   18    HG2  MET   4           HG2      MET   4  -0.607  16.020  -7.589
   19    HG3  MET   4           HG1      MET   4  -1.959  14.893  -7.500
   20    HE1  MET   4           HE1      MET   4  -3.017  15.290  -9.843
   21    HE2  MET   4           HE2      MET   4  -1.494  16.123 -10.147
   22    HE3  MET   4           HE3      MET   4  -3.019  16.874 -10.613
   23    H    ARG   5           HN       ARG   5  -2.744  13.701  -4.807
   24    HA   ARG   5           HA       ARG   5  -4.399  12.665  -6.932
   25    HB2  ARG   5           HB2      ARG   5  -2.556  11.455  -4.918
   26    HB3  ARG   5           HB1      ARG   5  -3.698  10.430  -5.770
   27    HG2  ARG   5           HG2      ARG   5  -1.963  10.231  -7.195
   28    HG3  ARG   5           HG1      ARG   5  -2.658  11.709  -7.861
   29    HD2  ARG   5           HD2      ARG   5  -1.103  13.046  -6.546
   30    HD3  ARG   5           HD1      ARG   5  -0.427  11.579  -5.836
   31    HE   ARG   5           HE       ARG   5  -0.292  11.500  -8.670
   32   HH11  ARG   5          HH11      ARG   5   1.240  12.948  -5.876
   33   HH12  ARG   5          HH12      ARG   5   2.781  13.119  -6.654
   34   HH21  ARG   5          HH21      ARG   5   1.744  11.720  -9.690
   35   HH22  ARG   5          HH22      ARG   5   3.069  12.411  -8.811
   36    HA   PRO   6           HA       PRO   6  -8.010  12.318  -4.360
   37    HB2  PRO   6           HB2      PRO   6  -9.563  11.001  -6.134
   38    HB3  PRO   6           HB1      PRO   6  -9.186  12.714  -6.299
   39    HG2  PRO   6           HG2      PRO   6  -7.937  10.360  -7.645
   40    HG3  PRO   6           HG1      PRO   6  -8.474  11.900  -8.324
   41    HD2  PRO   6           HD2      PRO   6  -5.885  11.405  -7.735
   42    HD3  PRO   6           HD1      PRO   6  -6.592  13.028  -7.610
   43    HA   PRO   7           HA       PRO   7  -6.982   8.298  -2.649
   44    HB2  PRO   7           HB2      PRO   7  -9.309   8.837  -0.924
   45    HB3  PRO   7           HB1      PRO   7  -7.637   8.486  -0.478
   46    HG2  PRO   7           HG2      PRO   7  -8.689  10.935  -0.222
   47    HG3  PRO   7           HG1      PRO   7  -6.990  10.692  -0.665
   48    HD2  PRO   7           HD2      PRO   7  -9.309  11.453  -2.388
   49    HD3  PRO   7           HD1      PRO   7  -7.618  11.993  -2.464
   50    H    ILE   8           HN       ILE   8  -7.839   6.276  -2.629
   51    HA   ILE   8           HA       ILE   8 -10.178   5.840  -4.294
   52    HB   ILE   8           HB       ILE   8  -8.229   3.845  -3.144
   53   HG12  ILE   8          HG12      ILE   8  -7.274   5.595  -4.741
   54   HG13  ILE   8          HG11      ILE   8  -7.011   3.910  -5.152
   55   HG21  ILE   8          HG21      ILE   8 -10.227   2.727  -3.699
   56   HG22  ILE   8          HG22      ILE   8  -9.102   2.421  -5.021
   57   HG23  ILE   8          HG23      ILE   8 -10.388   3.613  -5.217
   58   HD11  ILE   8          HD11      ILE   8  -8.963   5.811  -6.397
   59   HD12  ILE   8          HD12      ILE   8  -8.968   4.072  -6.701
   60   HD13  ILE   8          HD13      ILE   8  -7.562   5.044  -7.145
   61    H    ILE   9           HN       ILE   9 -11.902   6.312  -2.890
   62    HA   ILE   9           HA       ILE   9 -12.054   5.314  -0.240
   63    HB   ILE   9           HB       ILE   9 -14.171   6.437  -2.074
   64   HG12  ILE   9          HG12      ILE   9 -14.070   8.395  -0.804
   65   HG13  ILE   9          HG11      ILE   9 -13.160   7.637   0.482
   66   HG21  ILE   9          HG21      ILE   9 -15.364   6.644   0.276
   67   HG22  ILE   9          HG22      ILE   9 -14.417   5.187   0.595
   68   HG23  ILE   9          HG23      ILE   9 -15.555   5.223  -0.752
   69   HD11  ILE   9          HD11      ILE   9 -11.196   7.609  -0.926
   70   HD12  ILE   9          HD12      ILE   9 -11.852   9.242  -0.821
   71   HD13  ILE   9          HD13      ILE   9 -12.126   8.272  -2.269
   72    H    ILE  10           HN       ILE  10 -11.778   3.137  -0.177
   73    HA   ILE  10           HA       ILE  10 -13.476   1.381  -1.743
   74    HB   ILE  10           HB       ILE  10 -11.366   0.680   0.296
   75   HG12  ILE  10          HG12      ILE  10 -11.067   0.668  -2.695
   76   HG13  ILE  10          HG11      ILE  10 -10.633   2.062  -1.720
   77   HG21  ILE  10          HG21      ILE  10 -12.874  -1.151  -0.107
   78   HG22  ILE  10          HG22      ILE  10 -11.349  -1.481  -0.926
   79   HG23  ILE  10          HG23      ILE  10 -12.741  -0.926  -1.852
   80   HD11  ILE  10          HD11      ILE  10  -9.019   0.683  -0.502
   81   HD12  ILE  10          HD12      ILE  10  -8.687   0.731  -2.234
   82   HD13  ILE  10          HD13      ILE  10  -9.446  -0.692  -1.521
   83    H    HIS  11           HN       HIS  11 -15.271   0.579  -1.015
   84    HA   HIS  11           HA       HIS  11 -16.105   1.067   1.703
   85    HB2  HIS  11           HB2      HIS  11 -17.444  -0.203  -0.683
   86    HB3  HIS  11           HB1      HIS  11 -18.230  -0.002   0.882
   87    HD2  HIS  11           HD2      HIS  11 -16.351   3.109   0.472
   88    HE1  HIS  11           HE1      HIS  11 -19.980   3.776  -1.592
   89    HE2  HIS  11           HE2      HIS  11 -17.806   4.827  -0.831
   90    H    ARG  12           HN       ARG  12 -16.723  -0.571   3.169
   91    HA   ARG  12           HA       ARG  12 -15.005  -2.785   3.268
   92    HB2  ARG  12           HB2      ARG  12 -16.329  -3.382   5.262
   93    HB3  ARG  12           HB1      ARG  12 -15.859  -1.692   5.250
   94    HG2  ARG  12           HG2      ARG  12 -18.043  -0.997   4.669
   95    HG3  ARG  12           HG1      ARG  12 -18.549  -2.656   4.324
   96    HD2  ARG  12           HD2      ARG  12 -18.245  -3.244   6.636
   97    HD3  ARG  12           HD1      ARG  12 -17.679  -1.629   7.014
   98    HE   ARG  12           HE       ARG  12 -20.261  -1.538   5.856
   99   HH11  ARG  12          HH11      ARG  12 -18.589  -2.316   8.833
  100   HH12  ARG  12          HH12      ARG  12 -19.964  -2.004   9.839
  101   HH21  ARG  12          HH21      ARG  12 -22.073  -1.112   7.185
  102   HH22  ARG  12          HH22      ARG  12 -21.945  -1.315   8.904
  103    H    ALA  13           HN       ALA  13 -15.572  -5.018   3.358
  104    HA   ALA  13           HA       ALA  13 -17.973  -5.759   1.833
  105    HB1  ALA  13           HB1      ALA  13 -15.198  -6.874   1.429
  106    HB2  ALA  13           HB2      ALA  13 -16.067  -5.814   0.318
  107    HB3  ALA  13           HB3      ALA  13 -16.665  -7.441   0.629
  108    H    GLY  14           HN       GLY  14 -16.896  -8.593   1.949
  109    HA2  GLY  14           HA2      GLY  14 -18.243  -9.361   4.315
  110    HA3  GLY  14           HA1      GLY  14 -17.274 -10.413   3.297
  111    H    LYS  15           HN       LYS  15 -14.819  -9.956   3.528
  112    HA   LYS  15           HA       LYS  15 -14.157  -9.377   6.331
  113    HB2  LYS  15           HB2      LYS  15 -13.225 -11.781   4.759
  114    HB3  LYS  15           HB1      LYS  15 -12.626 -11.320   6.346
  115    HG2  LYS  15           HG2      LYS  15 -15.031 -11.506   7.137
  116    HG3  LYS  15           HG1      LYS  15 -15.350 -12.311   5.601
  117    HD2  LYS  15           HD2      LYS  15 -13.807 -14.052   6.110
  118    HD3  LYS  15           HD1      LYS  15 -13.229 -13.191   7.539
  119    HE2  LYS  15           HE2      LYS  15 -15.496 -13.379   8.509
  120    HE3  LYS  15           HE1      LYS  15 -15.982 -14.345   7.117
  121    HZ1  LYS  15           HZ1      LYS  15 -14.210 -15.933   7.740
  122    HZ2  LYS  15           HZ2      LYS  15 -15.428 -15.792   8.900
  123    HZ3  LYS  15           HZ3      LYS  15 -13.938 -15.037   9.148
  124    H    LYS  16           HN       LYS  16 -13.509  -8.858   3.081
  125    HA   LYS  16           HA       LYS  16 -10.932  -7.621   3.758
  126    HB2  LYS  16           HB2      LYS  16 -11.277  -8.933   1.078
  127    HB3  LYS  16           HB1      LYS  16  -9.794  -8.527   1.929
  128    HG2  LYS  16           HG2      LYS  16 -11.228 -10.434   3.482
  129    HG3  LYS  16           HG1      LYS  16 -11.138 -11.011   1.817
  130    HD2  LYS  16           HD2      LYS  16  -9.204 -11.845   2.864
  131    HD3  LYS  16           HD1      LYS  16  -8.652 -10.457   1.930
  132    HE2  LYS  16           HE2      LYS  16  -7.629 -10.443   4.126
  133    HE3  LYS  16           HE1      LYS  16  -8.728  -9.077   3.959
  134    HZ1  LYS  16           HZ1      LYS  16  -8.823 -10.367   6.113
  135    HZ2  LYS  16           HZ2      LYS  16  -9.563 -11.610   5.239
  136    HZ3  LYS  16           HZ3      LYS  16 -10.300 -10.091   5.341
  137    H    TYR  17           HN       TYR  17 -10.233  -6.187   1.796
  138    HA   TYR  17           HA       TYR  17 -12.583  -4.585   1.071
  139    HB2  TYR  17           HB2      TYR  17  -9.630  -3.938   1.005
  140    HB3  TYR  17           HB1      TYR  17 -10.885  -2.856   0.412
  141    HD1  TYR  17           HD1      TYR  17 -12.450  -1.783   1.986
  142    HD2  TYR  17           HD2      TYR  17  -9.268  -4.251   3.328
  143    HE1  TYR  17           HE1      TYR  17 -12.737  -0.895   4.264
  144    HE2  TYR  17           HE2      TYR  17  -9.524  -3.396   5.596
  145    HH   TYR  17           HH       TYR  17 -10.648  -0.904   6.521
  146    H    GLY  18           HN       GLY  18 -10.721  -6.985  -0.206
  147    HA2  GLY  18           HA2      GLY  18 -11.228  -7.879  -2.345
  148    HA3  GLY  18           HA1      GLY  18 -11.625  -6.262  -2.882
  149    H    PHE  19           HN       PHE  19  -8.746  -6.271  -1.128
  150    HA   PHE  19           HA       PHE  19  -7.192  -6.831  -3.523
  151    HB2  PHE  19           HB2      PHE  19  -6.002  -4.801  -3.568
  152    HB3  PHE  19           HB1      PHE  19  -7.697  -4.400  -3.524
  153    HD1  PHE  19           HD1      PHE  19  -8.691  -3.486  -1.408
  154    HD2  PHE  19           HD2      PHE  19  -4.508  -4.101  -1.897
  155    HE1  PHE  19           HE1      PHE  19  -8.245  -1.958   0.474
  156    HE2  PHE  19           HE2      PHE  19  -4.057  -2.587  -0.014
  157    HZ   PHE  19           HZ       PHE  19  -5.929  -1.512   1.171
  158    H    THR  20           HN       THR  20  -4.893  -6.615  -3.198
  159    HA   THR  20           HA       THR  20  -4.109  -7.791  -0.604
  160    HB   THR  20           HB       THR  20  -2.929  -8.253  -3.346
  161    HG1  THR  20           HG1      THR  20  -4.900  -9.361  -2.924
  162   HG21  THR  20          HG21      THR  20  -1.587 -10.033  -2.130
  163   HG22  THR  20          HG22      THR  20  -2.060  -9.240  -0.630
  164   HG23  THR  20          HG23      THR  20  -1.089  -8.365  -1.820
  165    H    LEU  21           HN       LEU  21  -2.799  -6.575   0.571
  166    HA   LEU  21           HA       LEU  21  -1.380  -4.379  -0.722
  167    HB2  LEU  21           HB2      LEU  21  -2.705  -3.815   1.244
  168    HB3  LEU  21           HB1      LEU  21  -1.863  -5.027   2.186
  169    HG   LEU  21           HG       LEU  21   0.233  -3.729   1.930
  170   HD11  LEU  21          HD11      LEU  21  -0.283  -2.590  -0.156
  171   HD12  LEU  21          HD12      LEU  21   0.111  -1.429   1.112
  172   HD13  LEU  21          HD13      LEU  21  -1.569  -1.686   0.644
  173   HD21  LEU  21          HD21      LEU  21  -0.507  -1.816   3.377
  174   HD22  LEU  21          HD22      LEU  21  -0.983  -3.417   3.938
  175   HD23  LEU  21          HD23      LEU  21  -2.162  -2.375   3.141
  176    H    ARG  22           HN       ARG  22   0.737  -4.542  -1.138
  177    HA   ARG  22           HA       ARG  22   2.186  -6.718   0.212
  178    HB2  ARG  22           HB2      ARG  22   2.199  -5.831  -2.640
  179    HB3  ARG  22           HB1      ARG  22   3.631  -6.577  -1.966
  180    HG2  ARG  22           HG2      ARG  22   1.701  -8.329  -1.189
  181    HG3  ARG  22           HG1      ARG  22   1.058  -7.732  -2.707
  182    HD2  ARG  22           HD2      ARG  22   2.670  -9.775  -2.685
  183    HD3  ARG  22           HD1      ARG  22   2.759  -8.575  -3.962
  184    HE   ARG  22           HE       ARG  22   4.520  -7.899  -1.848
  185   HH11  ARG  22          HH11      ARG  22   4.175 -10.220  -4.451
  186   HH12  ARG  22          HH12      ARG  22   5.886 -10.372  -4.704
  187   HH21  ARG  22          HH21      ARG  22   6.788  -8.089  -2.215
  188   HH22  ARG  22          HH22      ARG  22   7.358  -9.163  -3.448
  189    H    ALA  23           HN       ALA  23   4.020  -6.308   1.156
  190    HA   ALA  23           HA       ALA  23   5.007  -3.549   1.160
  191    HB1  ALA  23           HB1      ALA  23   4.899  -3.986   3.366
  192    HB2  ALA  23           HB2      ALA  23   6.400  -4.873   3.100
  193    HB3  ALA  23           HB3      ALA  23   4.855  -5.735   3.106
  194    H    ILE  24           HN       ILE  24   6.299  -3.431  -0.603
  195    HA   ILE  24           HA       ILE  24   8.240  -5.540  -1.123
  196    HB   ILE  24           HB       ILE  24   8.808  -4.107  -3.140
  197   HG12  ILE  24          HG12      ILE  24   6.179  -2.740  -2.576
  198   HG13  ILE  24          HG11      ILE  24   7.709  -2.032  -2.065
  199   HG21  ILE  24          HG21      ILE  24   5.981  -5.123  -2.875
  200   HG22  ILE  24          HG22      ILE  24   7.399  -6.099  -3.257
  201   HG23  ILE  24          HG23      ILE  24   6.848  -4.861  -4.388
  202   HD11  ILE  24          HD11      ILE  24   6.964  -2.730  -4.898
  203   HD12  ILE  24          HD12      ILE  24   8.456  -1.953  -4.369
  204   HD13  ILE  24          HD13      ILE  24   6.915  -1.117  -4.186
  205    H    ARG  25           HN       ARG  25  10.362  -5.397  -0.769
  206    HA   ARG  25           HA       ARG  25  11.350  -2.916   0.478
  207    HB2  ARG  25           HB2      ARG  25  11.836  -5.766   0.947
  208    HB3  ARG  25           HB1      ARG  25  13.286  -4.785   0.927
  209    HG2  ARG  25           HG2      ARG  25  12.475  -5.002   3.179
  210    HG3  ARG  25           HG1      ARG  25  12.318  -3.328   2.641
  211    HD2  ARG  25           HD2      ARG  25   9.963  -3.732   2.129
  212    HD3  ARG  25           HD1      ARG  25  10.120  -5.386   2.712
  213    HE   ARG  25           HE       ARG  25  10.718  -3.150   4.515
  214   HH11  ARG  25          HH11      ARG  25   8.757  -5.915   3.669
  215   HH12  ARG  25          HH12      ARG  25   7.942  -5.956   5.207
  216   HH21  ARG  25          HH21      ARG  25   9.630  -3.200   6.536
  217   HH22  ARG  25          HH22      ARG  25   8.442  -4.434   6.825
  218    H    VAL  26           HN       VAL  26  12.117  -1.706  -1.096
  219    HA   VAL  26           HA       VAL  26  13.919  -2.890  -3.103
  220    HB   VAL  26           HB       VAL  26  12.416  -0.256  -3.106
  221   HG11  VAL  26          HG11      VAL  26  14.410   0.159  -4.281
  222   HG12  VAL  26          HG12      VAL  26  13.199  -0.180  -5.518
  223   HG13  VAL  26          HG13      VAL  26  14.372  -1.419  -5.068
  224   HG21  VAL  26          HG21      VAL  26  11.179  -1.257  -4.995
  225   HG22  VAL  26          HG22      VAL  26  10.946  -2.130  -3.481
  226   HG23  VAL  26          HG23      VAL  26  12.030  -2.775  -4.714
  227    H    TYR  27           HN       TYR  27  16.063  -2.195  -3.169
  228    HA   TYR  27           HA       TYR  27  17.127  -1.014  -0.857
  229    HB2  TYR  27           HB2      TYR  27  18.202  -1.595  -3.569
  230    HB3  TYR  27           HB1      TYR  27  19.140  -0.610  -2.472
  231    HD1  TYR  27           HD1      TYR  27  19.670  -1.581  -0.154
  232    HD2  TYR  27           HD2      TYR  27  18.278  -3.937  -3.416
  233    HE1  TYR  27           HE1      TYR  27  20.538  -3.605   0.938
  234    HE2  TYR  27           HE2      TYR  27  19.145  -5.966  -2.329
  235    HH   TYR  27           HH       TYR  27  20.788  -6.616  -0.680
  236    H    MET  28           HN       MET  28  17.844   0.977  -0.392
  237    HA   MET  28           HA       MET  28  16.478   3.178  -1.572
  238    HB2  MET  28           HB2      MET  28  18.204   2.668   0.739
  239    HB3  MET  28           HB1      MET  28  18.401   4.268   0.052
  240    HG2  MET  28           HG2      MET  28  15.715   3.154   0.736
  241    HG3  MET  28           HG1      MET  28  16.722   3.985   1.913
  242    HE1  MET  28           HE1      MET  28  15.035   5.781   2.473
  243    HE2  MET  28           HE2      MET  28  13.822   5.085   1.400
  244    HE3  MET  28           HE3      MET  28  14.198   6.804   1.308
  245    H    GLY  29           HN       GLY  29  19.508   1.658  -2.100
  246    HA2  GLY  29           HA2      GLY  29  21.025   2.038  -3.809
  247    HA3  GLY  29           HA1      GLY  29  20.104   3.466  -4.266
  248    H    ASP  30           HN       ASP  30  21.030   3.089  -0.989
  249    HA   ASP  30           HA       ASP  30  23.070   5.189  -1.325
  250    HB2  ASP  30           HB2      ASP  30  21.305   6.144  -0.078
  251    HB3  ASP  30           HB1      ASP  30  21.062   4.676   0.863
  252    H    SER  31           HN       SER  31  22.138   2.441   0.736
  253    HA   SER  31           HA       SER  31  24.902   1.580   0.855
  254    HB2  SER  31           HB2      SER  31  24.712   1.473   3.430
  255    HB3  SER  31           HB1      SER  31  24.979   3.056   2.702
  256    HG   SER  31           HG       SER  31  22.960   3.652   3.137
  257    H    ASP  32           HN       ASP  32  23.079   0.543   3.485
  258    HA   ASP  32           HA       ASP  32  22.397  -1.976   2.117
  259    HB2  ASP  32           HB2      ASP  32  24.049  -2.023   4.039
  260    HB3  ASP  32           HB1      ASP  32  22.731  -1.527   5.087
  261    H    VAL  33           HN       VAL  33  21.239   0.785   3.630
  262    HA   VAL  33           HA       VAL  33  18.833  -0.013   4.780
  263    HB   VAL  33           HB       VAL  33  19.669   2.174   5.197
  264   HG11  VAL  33          HG11      VAL  33  19.653   3.910   3.356
  265   HG12  VAL  33          HG12      VAL  33  19.487   2.562   2.233
  266   HG13  VAL  33          HG13      VAL  33  20.918   2.679   3.260
  267   HG21  VAL  33          HG21      VAL  33  17.244   1.998   5.265
  268   HG22  VAL  33          HG22      VAL  33  17.155   2.431   3.559
  269   HG23  VAL  33          HG23      VAL  33  17.744   3.604   4.737
  270    H    TYR  34           HN       TYR  34  16.715   0.049   4.037
  271    HA   TYR  34           HA       TYR  34  16.417  -0.305   1.127
  272    HB2  TYR  34           HB2      TYR  34  14.613  -1.924   1.598
  273    HB3  TYR  34           HB1      TYR  34  16.165  -2.458   2.218
  274    HD1  TYR  34           HD2      TYR  34  12.871  -1.084   3.164
  275    HD2  TYR  34           HD1      TYR  34  16.488  -2.838   4.558
  276    HE1  TYR  34           HE2      TYR  34  11.846  -1.423   5.371
  277    HE2  TYR  34           HE1      TYR  34  15.468  -3.183   6.769
  278    HH   TYR  34           HH       TYR  34  13.698  -2.802   8.068
  279    H    THR  35           HN       THR  35  14.065  -0.191   0.514
  280    HA   THR  35           HA       THR  35  12.753   2.067   1.866
  281    HB   THR  35           HB       THR  35  12.390   1.661  -1.071
  282    HG1  THR  35           HG1      THR  35  14.614   1.623  -0.961
  283   HG21  THR  35          HG21      THR  35  12.336   3.936   0.879
  284   HG22  THR  35          HG22      THR  35  11.088   3.407  -0.248
  285   HG23  THR  35          HG23      THR  35  12.516   4.249  -0.848
  286    H    VAL  36           HN       VAL  36  11.090   1.048   2.887
  287    HA   VAL  36           HA       VAL  36   9.725  -1.151   1.580
  288    HB   VAL  36           HB       VAL  36  10.004  -1.460   3.923
  289   HG11  VAL  36          HG11      VAL  36   8.963   0.099   5.584
  290   HG12  VAL  36          HG12      VAL  36   8.726   1.244   4.263
  291   HG13  VAL  36          HG13      VAL  36  10.354   0.748   4.719
  292   HG21  VAL  36          HG21      VAL  36   7.679  -1.700   4.709
  293   HG22  VAL  36          HG22      VAL  36   7.901  -2.290   3.063
  294   HG23  VAL  36          HG23      VAL  36   7.136  -0.725   3.343
  295    H    HIS  37           HN       HIS  37   8.218  -0.808   0.141
  296    HA   HIS  37           HA       HIS  37   6.588   1.617   0.415
  297    HB2  HIS  37           HB2      HIS  37   7.401   0.060  -2.011
  298    HB3  HIS  37           HB1      HIS  37   6.009   1.121  -2.042
  299    HD2  HIS  37           HD2      HIS  37   9.753   1.279  -2.541
  300    HE1  HIS  37           HE1      HIS  37   8.422   5.255  -1.964
  301    HE2  HIS  37           HE2      HIS  37  10.309   3.800  -2.822
  302    H    HIS  38           HN       HIS  38   4.439   1.514   0.241
  303    HA   HIS  38           HA       HIS  38   3.265  -1.131   0.706
  304    HB2  HIS  38           HB2      HIS  38   2.116   1.602   1.343
  305    HB3  HIS  38           HB1      HIS  38   1.420   0.050   1.795
  306    HD2  HIS  38           HD2      HIS  38   3.682   2.686   3.232
  307    HE1  HIS  38           HE1      HIS  38   4.475  -0.862   5.391
  308    HE2  HIS  38           HE2      HIS  38   4.991   1.607   5.194
  309    H    MET  39           HN       MET  39   2.860  -1.869  -1.304
  310    HA   MET  39           HA       MET  39   1.210  -0.146  -3.031
  311    HB2  MET  39           HB2      MET  39   3.158  -0.308  -4.260
  312    HB3  MET  39           HB1      MET  39   3.541  -1.908  -3.643
  313    HG2  MET  39           HG2      MET  39   1.112  -1.881  -5.239
  314    HG3  MET  39           HG1      MET  39   2.519  -1.311  -6.133
  315    HE1  MET  39           HE1      MET  39   4.600  -4.311  -6.805
  316    HE2  MET  39           HE2      MET  39   4.885  -2.749  -6.032
  317    HE3  MET  39           HE3      MET  39   3.860  -2.851  -7.469
  318    H    VAL  40           HN       VAL  40  -0.613  -0.951  -3.837
  319    HA   VAL  40           HA       VAL  40  -1.625  -3.430  -2.842
  320    HB   VAL  40           HB       VAL  40  -3.358  -1.933  -3.141
  321   HG11  VAL  40          HG11      VAL  40  -3.609  -0.498  -5.183
  322   HG12  VAL  40          HG12      VAL  40  -2.006  -1.043  -5.676
  323   HG13  VAL  40          HG13      VAL  40  -2.210  -0.137  -4.176
  324   HG21  VAL  40          HG21      VAL  40  -3.999  -3.977  -4.255
  325   HG22  VAL  40          HG22      VAL  40  -3.292  -3.406  -5.766
  326   HG23  VAL  40          HG23      VAL  40  -4.705  -2.593  -5.092
  327    H    TRP  41           HN       TRP  41  -1.160  -5.335  -3.690
  328    HA   TRP  41           HA       TRP  41   0.331  -5.478  -6.170
  329    HB2  TRP  41           HB2      TRP  41   1.178  -6.691  -4.297
  330    HB3  TRP  41           HB1      TRP  41  -0.367  -7.505  -4.055
  331    HD1  TRP  41           HD1      TRP  41  -0.756  -9.730  -5.353
  332    HE1  TRP  41           HE1      TRP  41   0.664 -11.130  -6.978
  333    HE3  TRP  41           HE3      TRP  41   3.001  -6.375  -6.242
  334    HZ2  TRP  41           HZ2      TRP  41   3.059 -10.847  -8.442
  335    HZ3  TRP  41           HZ3      TRP  41   4.818  -7.024  -7.767
  336    HH2  TRP  41           HH2      TRP  41   4.845  -9.216  -8.844
  337    H    HIS  42           HN       HIS  42  -2.816  -6.466  -4.980
  338    HA   HIS  42           HA       HIS  42  -3.596  -7.003  -7.731
  339    HB2  HIS  42           HB2      HIS  42  -2.711  -9.171  -6.845
  340    HB3  HIS  42           HB1      HIS  42  -3.906  -9.107  -5.559
  341    HD2  HIS  42           HD2      HIS  42  -3.842  -9.485  -9.469
  342    HE1  HIS  42           HE1      HIS  42  -7.447 -11.065  -7.918
  343    HE2  HIS  42           HE2      HIS  42  -6.145 -10.543 -10.026
  344    H    VAL  43           HN       VAL  43  -5.795  -6.945  -8.075
  345    HA   VAL  43           HA       VAL  43  -7.484  -6.167  -5.795
  346    HB   VAL  43           HB       VAL  43  -7.635  -4.899  -8.542
  347   HG11  VAL  43          HG11      VAL  43  -9.162  -3.328  -7.432
  348   HG12  VAL  43          HG12      VAL  43  -9.025  -4.267  -5.946
  349   HG13  VAL  43          HG13      VAL  43  -9.759  -4.987  -7.378
  350   HG21  VAL  43          HG21      VAL  43  -5.587  -4.327  -7.092
  351   HG22  VAL  43          HG22      VAL  43  -6.737  -3.482  -6.058
  352   HG23  VAL  43          HG23      VAL  43  -6.544  -2.998  -7.743
  353    H    GLU  44           HN       GLU  44  -9.057  -7.619  -5.614
  354    HA   GLU  44           HA       GLU  44  -9.636  -9.633  -7.408
  355    HB2  GLU  44           HB2      GLU  44 -11.234  -8.392  -5.172
  356    HB3  GLU  44           HB1      GLU  44 -11.705  -9.846  -6.007
  357    HG2  GLU  44           HG2      GLU  44  -9.078  -9.576  -4.606
  358    HG3  GLU  44           HG1      GLU  44 -10.537 -10.159  -3.812
  359    H    ASP  45           HN       ASP  45 -10.933  -9.805  -9.130
  360    HA   ASP  45           HA       ASP  45 -11.929  -7.538 -10.461
  361    HB2  ASP  45           HB2      ASP  45 -11.955 -10.450 -10.886
  362    HB3  ASP  45           HB1      ASP  45 -13.314  -9.597 -11.609
  363    H    GLY  46           HN       GLY  46 -13.674  -6.373 -10.043
  364    HA2  GLY  46           HA2      GLY  46 -15.923  -5.934  -9.624
  365    HA3  GLY  46           HA1      GLY  46 -16.173  -7.650  -9.343
  366    H    GLY  47           HN       GLY  47 -13.548  -6.506  -7.597
  367    HA2  GLY  47           HA2      GLY  47 -14.971  -6.810  -5.109
  368    HA3  GLY  47           HA1      GLY  47 -13.255  -6.480  -5.300
  369    HA   PRO  48           HA       PRO  48 -15.865  -2.688  -3.843
  370    HB2  PRO  48           HB2      PRO  48 -13.841  -3.002  -1.683
  371    HB3  PRO  48           HB1      PRO  48 -15.532  -2.506  -1.551
  372    HG2  PRO  48           HG2      PRO  48 -14.850  -4.906  -0.802
  373    HG3  PRO  48           HG1      PRO  48 -16.261  -4.700  -1.847
  374    HD2  PRO  48           HD2      PRO  48 -13.498  -5.539  -2.607
  375    HD3  PRO  48           HD1      PRO  48 -15.047  -6.250  -3.053
  376    H    ALA  49           HN       ALA  49 -12.467  -3.401  -3.346
  377    HA   ALA  49           HA       ALA  49 -11.508  -0.793  -3.696
  378    HB1  ALA  49           HB1      ALA  49 -10.089  -3.407  -4.224
  379    HB2  ALA  49           HB2      ALA  49 -10.121  -2.520  -2.701
  380    HB3  ALA  49           HB3      ALA  49  -9.299  -1.834  -4.102
  381    H    SER  50           HN       SER  50 -12.128  -3.329  -6.023
  382    HA   SER  50           HA       SER  50 -10.971  -2.087  -8.277
  383    HB2  SER  50           HB2      SER  50 -12.099  -4.516  -7.773
  384    HB3  SER  50           HB1      SER  50 -13.392  -3.733  -8.683
  385    HG   SER  50           HG       SER  50 -12.170  -3.715 -10.444
  386    H    GLU  51           HN       GLU  51 -14.100  -1.958  -6.736
  387    HA   GLU  51           HA       GLU  51 -15.409  -0.417  -8.741
  388    HB2  GLU  51           HB2      GLU  51 -16.113  -0.690  -5.813
  389    HB3  GLU  51           HB1      GLU  51 -17.193  -0.169  -7.102
  390    HG2  GLU  51           HG2      GLU  51 -16.962  -2.393  -8.136
  391    HG3  GLU  51           HG1      GLU  51 -15.963  -2.893  -6.779
  392    H    ALA  52           HN       ALA  52 -13.681   0.279  -5.817
  393    HA   ALA  52           HA       ALA  52 -14.223   3.059  -5.713
  394    HB1  ALA  52           HB1      ALA  52 -11.947   1.499  -4.520
  395    HB2  ALA  52           HB2      ALA  52 -13.527   1.743  -3.777
  396    HB3  ALA  52           HB3      ALA  52 -12.462   3.121  -4.053
  397    H    GLY  53           HN       GLY  53 -11.978   1.115  -7.486
  398    HA2  GLY  53           HA2      GLY  53 -11.043   2.067  -9.494
  399    HA3  GLY  53           HA1      GLY  53 -10.869   3.572  -8.621
  400    H    LEU  54           HN       LEU  54  -9.937   1.009  -6.655
  401    HA   LEU  54           HA       LEU  54  -7.226   1.834  -6.613
  402    HB2  LEU  54           HB2      LEU  54  -8.857   0.234  -5.051
  403    HB3  LEU  54           HB1      LEU  54  -7.676  -0.886  -5.670
  404    HG   LEU  54           HG       LEU  54  -7.327   1.397  -3.789
  405   HD11  LEU  54          HD11      LEU  54  -7.475  -0.859  -2.913
  406   HD12  LEU  54          HD12      LEU  54  -5.853  -0.197  -2.663
  407   HD13  LEU  54          HD13      LEU  54  -6.144  -1.364  -3.955
  408   HD21  LEU  54          HD21      LEU  54  -5.771   2.116  -5.369
  409   HD22  LEU  54          HD22      LEU  54  -5.275   0.471  -5.763
  410   HD23  LEU  54          HD23      LEU  54  -4.830   1.179  -4.210
  411    H    ARG  55           HN       ARG  55  -5.492   1.109  -7.654
  412    HA   ARG  55           HA       ARG  55  -5.856  -1.089  -9.568
  413    HB2  ARG  55           HB2      ARG  55  -4.113   1.355  -9.892
  414    HB3  ARG  55           HB1      ARG  55  -4.356   0.077 -11.079
  415    HG2  ARG  55           HG2      ARG  55  -6.710   1.582 -10.051
  416    HG3  ARG  55           HG1      ARG  55  -5.666   2.324 -11.259
  417    HD2  ARG  55           HD2      ARG  55  -6.234   0.793 -12.883
  418    HD3  ARG  55           HD1      ARG  55  -6.613  -0.460 -11.706
  419    HE   ARG  55           HE       ARG  55  -8.352   1.834 -12.334
  420   HH11  ARG  55          HH11      ARG  55  -7.916  -1.467 -11.219
  421   HH12  ARG  55          HH12      ARG  55  -9.619  -1.792 -11.135
  422   HH21  ARG  55          HH21      ARG  55 -10.589   1.406 -12.195
  423   HH22  ARG  55          HH22      ARG  55 -11.136  -0.159 -11.677
  424    H    GLN  56           HN       GLN  56  -4.305  -2.630  -9.647
  425    HA   GLN  56           HA       GLN  56  -2.473  -2.729  -7.451
  426    HB2  GLN  56           HB2      GLN  56  -1.834  -4.826  -9.197
  427    HB3  GLN  56           HB1      GLN  56  -2.774  -4.905  -7.726
  428    HG2  GLN  56           HG2      GLN  56  -4.808  -4.627  -8.889
  429    HG3  GLN  56           HG1      GLN  56  -3.948  -4.256 -10.355
  430   HE21  GLN  56          HE21      GLN  56  -1.989  -6.365 -10.046
  431   HE22  GLN  56          HE22      GLN  56  -2.815  -7.844 -10.381
  432    H    GLY  57           HN       GLY  57  -0.294  -2.578  -7.445
  433    HA2  GLY  57           HA2      GLY  57   1.849  -2.439  -8.413
  434    HA3  GLY  57           HA1      GLY  57   1.112  -2.117  -9.968
  435    H    ASP  58           HN       ASP  58  -0.451  -0.206  -7.749
  436    HA   ASP  58           HA       ASP  58   1.001   2.151  -8.597
  437    HB2  ASP  58           HB2      ASP  58  -1.337   1.860  -6.697
  438    HB3  ASP  58           HB1      ASP  58  -0.683   3.389  -7.252
  439    H    LEU  59           HN       LEU  59   0.558   3.666  -6.197
  440    HA   LEU  59           HA       LEU  59   2.219   2.359  -4.227
  441    HB2  LEU  59           HB2      LEU  59   2.884   4.799  -5.766
  442    HB3  LEU  59           HB1      LEU  59   3.202   4.859  -4.044
  443    HG   LEU  59           HG       LEU  59   4.347   2.891  -6.008
  444   HD11  LEU  59          HD11      LEU  59   5.309   5.142  -6.120
  445   HD12  LEU  59          HD12      LEU  59   6.464   3.968  -5.491
  446   HD13  LEU  59          HD13      LEU  59   5.648   5.077  -4.390
  447   HD21  LEU  59          HD21      LEU  59   4.090   1.667  -4.016
  448   HD22  LEU  59          HD22      LEU  59   4.527   3.048  -3.012
  449   HD23  LEU  59          HD23      LEU  59   5.759   2.239  -3.982
  450    H    ILE  60           HN       ILE  60   1.031   2.424  -2.424
  451    HA   ILE  60           HA       ILE  60  -0.981   4.450  -2.082
  452    HB   ILE  60           HB       ILE  60  -0.066   2.237  -0.226
  453   HG12  ILE  60          HG12      ILE  60  -2.679   2.439  -1.732
  454   HG13  ILE  60          HG11      ILE  60  -1.255   1.671  -2.427
  455   HG21  ILE  60          HG21      ILE  60  -2.035   2.721   1.111
  456   HG22  ILE  60          HG22      ILE  60  -2.457   4.060   0.044
  457   HG23  ILE  60          HG23      ILE  60  -0.990   4.138   1.019
  458   HD11  ILE  60          HD11      ILE  60  -1.229   0.069  -0.587
  459   HD12  ILE  60          HD12      ILE  60  -2.760   0.034  -1.462
  460   HD13  ILE  60          HD13      ILE  60  -2.656   0.841   0.102
  461    H    THR  61           HN       THR  61  -0.443   6.415  -1.432
  462    HA   THR  61           HA       THR  61   1.998   6.814   0.110
  463    HB   THR  61           HB       THR  61   1.871   8.250  -1.770
  464    HG1  THR  61           HG1      THR  61   1.019   9.947   0.341
  465   HG21  THR  61          HG21      THR  61   0.029   9.749  -2.248
  466   HG22  THR  61          HG22      THR  61  -0.826   9.197  -0.808
  467   HG23  THR  61          HG23      THR  61  -0.557   8.089  -2.153
  468    H    HIS  62           HN       HIS  62  -1.495   7.181   0.452
  469    HA   HIS  62           HA       HIS  62  -1.078   7.585   3.320
  470    HB2  HIS  62           HB2      HIS  62  -3.081   9.290   1.839
  471    HB3  HIS  62           HB1      HIS  62  -2.630   9.391   3.526
  472    HD2  HIS  62           HD2      HIS  62  -0.026  10.511   3.983
  473    HE1  HIS  62           HE1      HIS  62  -0.009  12.428   0.210
  474    HE2  HIS  62           HE2      HIS  62   1.208  12.179   2.414
  475    H    VAL  63           HN       VAL  63  -2.705   6.828   4.600
  476    HA   VAL  63           HA       VAL  63  -4.927   5.444   3.239
  477    HB   VAL  63           HB       VAL  63  -3.342   4.507   5.641
  478   HG11  VAL  63          HG11      VAL  63  -5.801   3.255   4.428
  479   HG12  VAL  63          HG12      VAL  63  -5.768   4.165   5.938
  480   HG13  VAL  63          HG13      VAL  63  -4.879   2.649   5.803
  481   HG21  VAL  63          HG21      VAL  63  -2.388   4.052   3.376
  482   HG22  VAL  63          HG22      VAL  63  -3.837   3.114   3.016
  483   HG23  VAL  63          HG23      VAL  63  -2.757   2.604   4.313
  484    H    ASN  64           HN       ASN  64  -6.712   6.551   3.714
  485    HA   ASN  64           HA       ASN  64  -8.339   7.647   4.860
  486    HB2  ASN  64           HB2      ASN  64  -6.886   6.544   7.280
  487    HB3  ASN  64           HB1      ASN  64  -8.420   7.399   7.358
  488   HD21  ASN  64          HD21      ASN  64  -7.437   4.563   7.870
  489   HD22  ASN  64          HD22      ASN  64  -8.596   3.577   7.062
  490    H    GLY  65           HN       GLY  65  -5.709   8.800   4.153
  491    HA2  GLY  65           HA2      GLY  65  -4.998  11.017   4.137
  492    HA3  GLY  65           HA1      GLY  65  -6.057  11.340   5.501
  493    H    GLU  66           HN       GLU  66  -4.165   8.594   6.034
  494    HA   GLU  66           HA       GLU  66  -2.475  10.134   7.868
  495    HB2  GLU  66           HB2      GLU  66  -2.855   7.148   7.764
  496    HB3  GLU  66           HB1      GLU  66  -2.128   8.079   9.063
  497    HG2  GLU  66           HG2      GLU  66  -4.975   8.499   8.259
  498    HG3  GLU  66           HG1      GLU  66  -4.517   7.200   9.348
  499    HA   PRO  67           HA       PRO  67   1.022   9.432   5.188
  500    HB2  PRO  67           HB2      PRO  67   2.649  10.025   7.559
  501    HB3  PRO  67           HB1      PRO  67   2.554  10.892   6.026
  502    HG2  PRO  67           HG2      PRO  67   1.531  11.905   8.300
  503    HG3  PRO  67           HG1      PRO  67   0.782  12.188   6.722
  504    HD2  PRO  67           HD2      PRO  67  -0.006  10.285   8.868
  505    HD3  PRO  67           HD1      PRO  67  -1.027  11.296   7.832
  506    H    VAL  68           HN       VAL  68   1.334   7.336   4.763
  507    HA   VAL  68           HA       VAL  68   1.939   5.448   6.897
  508    HB   VAL  68           HB       VAL  68   1.728   3.720   5.231
  509   HG11  VAL  68          HG11      VAL  68  -0.333   4.586   6.183
  510   HG12  VAL  68          HG12      VAL  68  -0.587   4.104   4.507
  511   HG13  VAL  68          HG13      VAL  68  -0.423   5.811   4.918
  512   HG21  VAL  68          HG21      VAL  68   1.388   5.899   3.168
  513   HG22  VAL  68          HG22      VAL  68   1.340   4.158   2.887
  514   HG23  VAL  68          HG23      VAL  68   2.848   4.930   3.376
  515    H    HIS  69           HN       HIS  69   3.665   7.525   5.000
  516    HA   HIS  69           HA       HIS  69   5.891   5.927   4.271
  517    HB2  HIS  69           HB2      HIS  69   5.355   8.098   3.202
  518    HB3  HIS  69           HB1      HIS  69   5.756   8.921   4.704
  519    HD2  HIS  69           HD2      HIS  69   8.252   9.833   4.747
  520    HE1  HIS  69           HE1      HIS  69   9.890   7.148   1.918
  521    HE2  HIS  69           HE2      HIS  69  10.287   9.276   3.238
  522    H    GLY  70           HN       GLY  70   6.591   4.746   6.035
  523    HA2  GLY  70           HA2      GLY  70   8.649   5.235   7.512
  524    HA3  GLY  70           HA1      GLY  70   7.523   6.278   8.364
  525    H    LEU  71           HN       LEU  71   5.329   4.205   7.779
  526    HA   LEU  71           HA       LEU  71   5.830   2.704  10.202
  527    HB2  LEU  71           HB2      LEU  71   3.478   2.152   8.473
  528    HB3  LEU  71           HB1      LEU  71   3.609   2.139  10.219
  529    HG   LEU  71           HG       LEU  71   3.623   4.628   8.584
  530   HD11  LEU  71          HD11      LEU  71   1.544   3.917   8.092
  531   HD12  LEU  71          HD12      LEU  71   1.216   4.674   9.654
  532   HD13  LEU  71          HD13      LEU  71   1.430   2.920   9.544
  533   HD21  LEU  71          HD21      LEU  71   2.590   5.077  11.132
  534   HD22  LEU  71          HD22      LEU  71   4.173   5.572  10.528
  535   HD23  LEU  71          HD23      LEU  71   3.992   4.036  11.371
  536    H    VAL  72           HN       VAL  72   4.872   0.417  10.094
  537    HA   VAL  72           HA       VAL  72   6.493  -1.111   8.228
  538    HB   VAL  72           HB       VAL  72   5.829  -3.037   9.647
  539   HG11  VAL  72          HG11      VAL  72   7.103  -2.387  11.623
  540   HG12  VAL  72          HG12      VAL  72   6.925  -0.688  11.188
  541   HG13  VAL  72          HG13      VAL  72   7.860  -1.770  10.156
  542   HG21  VAL  72          HG21      VAL  72   3.893  -1.089  10.594
  543   HG22  VAL  72          HG22      VAL  72   4.804  -1.813  11.930
  544   HG23  VAL  72          HG23      VAL  72   3.930  -2.850  10.804
  545    H    HIS  73           HN       HIS  73   5.237  -3.360   7.786
  546    HA   HIS  73           HA       HIS  73   3.248  -2.727   5.888
  547    HB2  HIS  73           HB2      HIS  73   4.747  -4.665   5.676
  548    HB3  HIS  73           HB1      HIS  73   3.987  -5.409   7.076
  549    HD1  HIS  73           HD1      HIS  73   2.540  -3.947   3.834
  550    HD2  HIS  73           HD2      HIS  73   2.385  -7.346   6.219
  551    HE1  HIS  73           HE1      HIS  73   0.912  -5.524   2.718
  552    H    THR  74           HN       THR  74   3.086  -4.143   9.133
  553    HA   THR  74           HA       THR  74   0.283  -4.609   9.029
  554    HB   THR  74           HB       THR  74   0.549  -4.795  11.566
  555    HG1  THR  74           HG1      THR  74   2.451  -4.318  12.363
  556   HG21  THR  74          HG21      THR  74   0.449  -6.739  10.147
  557   HG22  THR  74          HG22      THR  74   1.726  -6.973  11.341
  558   HG23  THR  74          HG23      THR  74   2.139  -6.535   9.682
  559    H    GLU  75           HN       GLU  75   2.203  -1.811  10.056
  560    HA   GLU  75           HA       GLU  75   0.244  -0.559  11.578
  561    HB2  GLU  75           HB2      GLU  75   2.522   0.609   9.975
  562    HB3  GLU  75           HB1      GLU  75   1.407   1.562  10.889
  563    HG2  GLU  75           HG2      GLU  75   2.892  -0.669  12.141
  564    HG3  GLU  75           HG1      GLU  75   3.515   0.981  12.093
  565    H    VAL  76           HN       VAL  76   0.943  -0.427   8.141
  566    HA   VAL  76           HA       VAL  76  -1.198   1.387   7.589
  567    HB   VAL  76           HB       VAL  76  -0.715   1.025   5.238
  568   HG11  VAL  76          HG11      VAL  76   0.711   2.559   6.393
  569   HG12  VAL  76          HG12      VAL  76   1.715   1.617   5.287
  570   HG13  VAL  76          HG13      VAL  76   1.710   1.245   7.013
  571   HG21  VAL  76          HG21      VAL  76   0.943  -0.554   4.472
  572   HG22  VAL  76          HG22      VAL  76  -0.319  -1.417   5.354
  573   HG23  VAL  76          HG23      VAL  76   1.234  -1.097   6.124
  574    H    VAL  77           HN       VAL  77  -0.794  -2.117   7.519
  575    HA   VAL  77           HA       VAL  77  -3.180  -2.844   6.244
  576    HB   VAL  77           HB       VAL  77  -1.436  -4.195   8.288
  577   HG11  VAL  77          HG11      VAL  77  -3.807  -4.834   8.750
  578   HG12  VAL  77          HG12      VAL  77  -2.758  -6.172   8.284
  579   HG13  VAL  77          HG13      VAL  77  -3.889  -5.489   7.114
  580   HG21  VAL  77          HG21      VAL  77  -1.067  -5.779   6.448
  581   HG22  VAL  77          HG22      VAL  77  -0.651  -4.127   5.996
  582   HG23  VAL  77          HG23      VAL  77  -2.163  -4.842   5.434
  583    H    GLU  78           HN       GLU  78  -2.484  -2.366   9.681
  584    HA   GLU  78           HA       GLU  78  -5.090  -2.759  10.600
  585    HB2  GLU  78           HB2      GLU  78  -2.938  -1.065  11.740
  586    HB3  GLU  78           HB1      GLU  78  -4.383  -1.552  12.593
  587    HG2  GLU  78           HG2      GLU  78  -3.670  -3.894  12.036
  588    HG3  GLU  78           HG1      GLU  78  -2.099  -3.215  11.686
  589    H    LEU  79           HN       LEU  79  -3.303   0.113   9.858
  590    HA   LEU  79           HA       LEU  79  -5.063   2.139  10.304
  591    HB2  LEU  79           HB2      LEU  79  -2.731   1.827   8.821
  592    HB3  LEU  79           HB1      LEU  79  -3.895   2.451   7.668
  593    HG   LEU  79           HG       LEU  79  -4.368   4.257   9.457
  594   HD11  LEU  79          HD11      LEU  79  -3.127   3.170  11.263
  595   HD12  LEU  79          HD12      LEU  79  -2.483   4.771  10.898
  596   HD13  LEU  79          HD13      LEU  79  -1.637   3.330  10.334
  597   HD21  LEU  79          HD21      LEU  79  -2.213   3.970   7.487
  598   HD22  LEU  79          HD22      LEU  79  -1.996   5.275   8.657
  599   HD23  LEU  79          HD23      LEU  79  -3.449   5.222   7.657
  600    H    ILE  80           HN       ILE  80  -4.883   0.346   7.198
  601    HA   ILE  80           HA       ILE  80  -7.125   1.378   5.980
  602    HB   ILE  80           HB       ILE  80  -6.023  -1.424   5.905
  603   HG12  ILE  80          HG12      ILE  80  -5.545   0.658   3.832
  604   HG13  ILE  80          HG11      ILE  80  -4.643   0.729   5.329
  605   HG21  ILE  80          HG21      ILE  80  -8.225  -1.477   5.025
  606   HG22  ILE  80          HG22      ILE  80  -7.096  -1.551   3.670
  607   HG23  ILE  80          HG23      ILE  80  -7.935  -0.042   4.039
  608   HD11  ILE  80          HD11      ILE  80  -3.682  -1.366   4.971
  609   HD12  ILE  80          HD12      ILE  80  -3.514  -0.471   3.459
  610   HD13  ILE  80          HD13      ILE  80  -4.751  -1.723   3.614
  611    H    LEU  81           HN       LEU  81  -6.910  -1.621   7.882
  612    HA   LEU  81           HA       LEU  81  -9.597  -2.298   7.899
  613    HB2  LEU  81           HB2      LEU  81  -7.308  -2.830   9.725
  614    HB3  LEU  81           HB1      LEU  81  -8.912  -3.276  10.266
  615    HG   LEU  81           HG       LEU  81  -7.779  -4.207   7.638
  616   HD11  LEU  81          HD11      LEU  81  -6.296  -4.959   9.415
  617   HD12  LEU  81          HD12      LEU  81  -7.231  -6.308   8.771
  618   HD13  LEU  81          HD13      LEU  81  -7.677  -5.587  10.317
  619   HD21  LEU  81          HD21      LEU  81 -10.111  -5.013   9.357
  620   HD22  LEU  81          HD22      LEU  81  -9.490  -6.018   8.051
  621   HD23  LEU  81          HD23      LEU  81 -10.134  -4.417   7.697
  622    H    LYS  82           HN       LYS  82  -7.899  -0.148  10.168
  623    HA   LYS  82           HA       LYS  82 -10.004   0.235  11.955
  624    HB2  LYS  82           HB2      LYS  82  -7.713   2.065  11.316
  625    HB3  LYS  82           HB1      LYS  82  -8.754   2.183  12.735
  626    HG2  LYS  82           HG2      LYS  82  -8.089  -0.153  13.284
  627    HG3  LYS  82           HG1      LYS  82  -6.908  -0.046  12.002
  628    HD2  LYS  82           HD2      LYS  82  -7.031   1.889  14.309
  629    HD3  LYS  82           HD1      LYS  82  -6.016   0.445  14.305
  630    HE2  LYS  82           HE2      LYS  82  -4.903   1.282  12.262
  631    HE3  LYS  82           HE1      LYS  82  -5.868   2.754  12.367
  632    HZ1  LYS  82           HZ1      LYS  82  -4.870   3.136  14.575
  633    HZ2  LYS  82           HZ2      LYS  82  -3.733   3.148  13.326
  634    HZ3  LYS  82           HZ3      LYS  82  -3.863   1.798  14.335
  635    H    SER  83           HN       SER  83  -9.743   1.449   8.781
  636    HA   SER  83           HA       SER  83 -10.833   3.972   8.890
  637    HB2  SER  83           HB2      SER  83 -11.611   3.597   6.617
  638    HB3  SER  83           HB1      SER  83 -10.026   2.858   6.829
  639    HG   SER  83           HG       SER  83 -12.185   1.704   5.949
  640    H    GLY  84           HN       GLY  84 -12.669   0.937   8.513
  641    HA2  GLY  84           HA2      GLY  84 -14.730   0.382   9.438
  642    HA3  GLY  84           HA1      GLY  84 -14.818   1.990  10.139
  643    H    ASN  85           HN       ASN  85 -16.118  -0.031   7.891
  644    HA   ASN  85           HA       ASN  85 -17.774   0.197   6.367
  645    HB2  ASN  85           HB2      ASN  85 -18.896   1.863   7.619
  646    HB3  ASN  85           HB1      ASN  85 -17.669   3.075   7.269
  647   HD21  ASN  85          HD21      ASN  85 -19.473   0.866   5.139
  648   HD22  ASN  85          HD22      ASN  85 -20.133   2.114   4.145
  649    H    LYS  86           HN       LYS  86 -15.349   2.799   5.986
  650    HA   LYS  86           HA       LYS  86 -14.726   1.799   3.380
  651    HB2  LYS  86           HB2      LYS  86 -14.969   4.054   2.335
  652    HB3  LYS  86           HB1      LYS  86 -16.458   3.211   2.679
  653    HG2  LYS  86           HG2      LYS  86 -16.304   4.557   4.924
  654    HG3  LYS  86           HG1      LYS  86 -15.315   5.610   3.923
  655    HD2  LYS  86           HD2      LYS  86 -17.285   5.426   2.244
  656    HD3  LYS  86           HD1      LYS  86 -18.194   4.903   3.662
  657    HE2  LYS  86           HE2      LYS  86 -17.483   6.986   4.817
  658    HE3  LYS  86           HE1      LYS  86 -16.739   7.519   3.309
  659    HZ1  LYS  86           HZ1      LYS  86 -18.916   7.428   2.254
  660    HZ2  LYS  86           HZ2      LYS  86 -18.940   8.464   3.587
  661    HZ3  LYS  86           HZ3      LYS  86 -19.619   6.922   3.705
  662    H    VAL  87           HN       VAL  87 -12.863   2.714   2.516
  663    HA   VAL  87           HA       VAL  87 -11.239   4.248   4.430
  664    HB   VAL  87           HB       VAL  87 -10.614   1.969   4.799
  665   HG11  VAL  87          HG11      VAL  87 -11.490   1.027   2.726
  666   HG12  VAL  87          HG12      VAL  87  -9.835   0.489   3.029
  667   HG13  VAL  87          HG13      VAL  87 -10.148   1.745   1.831
  668   HG21  VAL  87          HG21      VAL  87  -8.761   3.516   4.822
  669   HG22  VAL  87          HG22      VAL  87  -8.568   3.366   3.076
  670   HG23  VAL  87          HG23      VAL  87  -8.226   1.987   4.120
  671    H    ALA  88           HN       ALA  88 -10.090   5.839   3.545
  672    HA   ALA  88           HA       ALA  88 -10.191   6.127   0.639
  673    HB1  ALA  88           HB1      ALA  88 -10.938   8.048   1.898
  674    HB2  ALA  88           HB2      ALA  88  -9.444   8.432   1.042
  675    HB3  ALA  88           HB3      ALA  88  -9.410   8.100   2.775
  676    H    ILE  89           HN       ILE  89  -8.595   5.213  -0.375
  677    HA   ILE  89           HA       ILE  89  -5.934   5.171   0.865
  678    HB   ILE  89           HB       ILE  89  -6.842   3.549  -1.504
  679   HG12  ILE  89          HG12      ILE  89  -7.346   3.198   1.375
  680   HG13  ILE  89          HG11      ILE  89  -8.174   2.519  -0.012
  681   HG21  ILE  89          HG21      ILE  89  -4.391   3.976  -1.040
  682   HG22  ILE  89          HG22      ILE  89  -4.903   2.293  -1.202
  683   HG23  ILE  89          HG23      ILE  89  -4.609   2.974   0.396
  684   HD11  ILE  89          HD11      ILE  89  -7.263   0.738   1.283
  685   HD12  ILE  89          HD12      ILE  89  -5.662   1.483   1.263
  686   HD13  ILE  89          HD13      ILE  89  -6.358   0.852  -0.230
  687    H    SER  90           HN       SER  90  -4.750   6.858   0.257
  688    HA   SER  90           HA       SER  90  -5.112   8.166  -2.272
  689    HB2  SER  90           HB2      SER  90  -2.791   8.624  -0.418
  690    HB3  SER  90           HB1      SER  90  -3.631   9.782  -1.449
  691    HG   SER  90           HG       SER  90  -4.518  10.220   0.455
  692    H    THR  91           HN       THR  91  -4.387   7.298  -4.075
  693    HA   THR  91           HA       THR  91  -2.000   5.615  -4.012
  694    HB   THR  91           HB       THR  91  -2.844   5.091  -6.424
  695    HG1  THR  91           HG1      THR  91  -5.212   5.268  -6.438
  696   HG21  THR  91          HG21      THR  91  -2.852   3.415  -4.713
  697   HG22  THR  91          HG22      THR  91  -4.436   3.394  -5.496
  698   HG23  THR  91          HG23      THR  91  -4.239   4.160  -3.917
  699    H    THR  92           HN       THR  92  -0.654   5.686  -5.999
  700    HA   THR  92           HA       THR  92  -0.525   7.978  -7.649
  701    HB   THR  92           HB       THR  92   0.299   9.122  -5.680
  702    HG1  THR  92           HG1      THR  92   2.513   8.404  -7.330
  703   HG21  THR  92          HG21      THR  92   0.948   7.148  -4.376
  704   HG22  THR  92          HG22      THR  92   2.219   8.372  -4.398
  705   HG23  THR  92          HG23      THR  92   2.363   6.936  -5.413
  706    HA   PRO  93           HA       PRO  93   1.651   5.073 -10.204
  707    HB2  PRO  93           HB2      PRO  93   3.667   7.221 -10.604
  708    HB3  PRO  93           HB1      PRO  93   2.855   6.221 -11.803
  709    HG2  PRO  93           HG2      PRO  93   2.077   8.731 -11.424
  710    HG3  PRO  93           HG1      PRO  93   0.878   7.450 -11.684
  711    HD2  PRO  93           HD2      PRO  93   1.636   8.860  -9.167
  712    HD3  PRO  93           HD1      PRO  93   0.057   8.233  -9.682
  713    H    LEU  94           HN       LEU  94   3.336   3.669 -10.174
  714    HA   LEU  94           HA       LEU  94   5.248   3.958  -7.967
  715    HB2  LEU  94           HB2      LEU  94   4.049   1.941  -7.647
  716    HB3  LEU  94           HB1      LEU  94   4.115   1.540  -9.355
  717    HG   LEU  94           HG       LEU  94   6.606   1.197  -9.095
  718   HD11  LEU  94          HD11      LEU  94   5.936   1.342  -6.161
  719   HD12  LEU  94          HD12      LEU  94   6.921   2.495  -7.062
  720   HD13  LEU  94          HD13      LEU  94   7.476   0.834  -6.855
  721   HD21  LEU  94          HD21      LEU  94   4.902  -0.581  -7.352
  722   HD22  LEU  94          HD22      LEU  94   6.384  -1.015  -8.205
  723   HD23  LEU  94          HD23      LEU  94   4.922  -0.638  -9.114
  724    H    GLU  95           HN       GLU  95   6.456   5.407  -9.275
  725    HA   GLU  95           HA       GLU  95   7.864   4.175 -11.525
  726    HB2  GLU  95           HB2      GLU  95   7.952   7.041 -10.621
  727    HB3  GLU  95           HB1      GLU  95   8.559   6.398 -12.131
  728    HG2  GLU  95           HG2      GLU  95   5.644   6.328 -11.371
  729    HG3  GLU  95           HG1      GLU  95   6.390   7.629 -12.305
  730    H    ASN  96           HN       ASN  96   9.832   3.484 -11.272
  731    HA   ASN  96           HA       ASN  96  11.620   4.618  -9.296
  732    HB2  ASN  96           HB2      ASN  96  10.307   2.873  -8.065
  733    HB3  ASN  96           HB1      ASN  96  10.925   1.672  -9.195
  734   HD21  ASN  96          HD21      ASN  96  12.970   0.893  -8.939
  735   HD22  ASN  96          HD22      ASN  96  13.993   1.316  -7.609
  736    H2   PRO  97           HT1      PRO  97  16.011  -2.034 -13.444
  737    H3   PRO  97           HT2      PRO  97  14.668  -2.038 -14.377
  738    HA   PRO  97           HA       PRO  97  13.809  -3.734 -13.447
  739    HB2  PRO  97           HB2      PRO  97  15.894  -5.443 -12.588
  740    HB3  PRO  97           HB1      PRO  97  14.811  -5.683 -13.965
  741    HG2  PRO  97           HG2      PRO  97  17.548  -4.540 -13.893
  742    HG3  PRO  97           HG1      PRO  97  16.741  -5.454 -15.181
  743    HD2  PRO  97           HD2      PRO  97  17.110  -2.819 -15.406
  744    HD3  PRO  97           HD1      PRO  97  15.608  -3.574 -15.972
  745    H    PHE  98           HN       PHE  98  13.528  -4.506 -11.244
  746    HA   PHE  98           HA       PHE  98  14.485  -2.599  -9.313
  747    HB2  PHE  98           HB2      PHE  98  12.646  -4.991  -9.174
  748    HB3  PHE  98           HB1      PHE  98  13.141  -4.124  -7.724
  749    HD1  PHE  98           HD1      PHE  98  11.679  -3.447 -11.089
  750    HD2  PHE  98           HD2      PHE  98  11.777  -2.429  -6.959
  751    HE1  PHE  98           HE1      PHE  98   9.861  -1.825 -11.447
  752    HE2  PHE  98           HE2      PHE  98   9.956  -0.816  -7.310
  753    HZ   PHE  98           HZ       PHE  98   8.980  -0.525  -9.530
  754    H    ASP  99           HN       ASP  99  15.755  -3.139  -7.444
  755    HA   ASP  99           HA       ASP  99  17.891  -4.899  -8.014
  756    HB2  ASP  99           HB2      ASP  99  18.372  -4.461  -5.456
  757    HB3  ASP  99           HB1      ASP  99  18.627  -3.210  -6.665
  758    H    GLU 100           HN       GLU 100  16.343  -5.163  -4.849
  759    HA   GLU 100           HA       GLU 100  15.480  -7.873  -5.408
  760    HB2  GLU 100           HB2      GLU 100  17.952  -7.257  -3.879
  761    HB3  GLU 100           HB1      GLU 100  16.915  -8.526  -3.249
  762    HG2  GLU 100           HG2      GLU 100  17.167  -9.834  -5.196
  763    HG3  GLU 100           HG1      GLU 100  17.898  -8.499  -6.082
  764    H    ASP 101           HN       ASP 101  13.670  -8.223  -4.337
  765    HA   ASP 101           HA       ASP 101  12.751  -6.420  -2.311
  766    HB2  ASP 101           HB2      ASP 101  11.331  -7.725  -4.026
  767    HB3  ASP 101           HB1      ASP 101  11.523  -9.102  -2.947
  768    H    GLN 102           HN       GLN 102  13.735  -6.477  -0.405
  769    HA   GLN 102           HA       GLN 102  14.990  -8.797   0.661
  770    HB2  GLN 102           HB2      GLN 102  14.315  -6.182   2.018
  771    HB3  GLN 102           HB1      GLN 102  15.377  -7.420   2.670
  772    HG2  GLN 102           HG2      GLN 102  15.818  -5.703   0.246
  773    HG3  GLN 102           HG1      GLN 102  16.747  -5.730   1.745
  774   HE21  GLN 102          HE21      GLN 102  16.238  -7.165  -1.323
  775   HE22  GLN 102          HE22      GLN 102  17.544  -8.301  -1.250
  776    H    HIS 103           HN       HIS 103  12.837  -6.946   2.710
  777    HA   HIS 103           HA       HIS 103  11.777  -9.390   3.804
  778    HB2  HIS 103           HB2      HIS 103  10.940  -6.578   4.518
  779    HB3  HIS 103           HB1      HIS 103  10.810  -8.030   5.506
  780    HD2  HIS 103           HD2      HIS 103  13.137  -8.823   6.804
  781    HE1  HIS 103           HE1      HIS 103  15.370  -5.412   5.669
  782    HE2  HIS 103           HE2      HIS 103  15.399  -7.563   7.002
  783    H    THR 104           HN       THR 104  10.635 -10.225   2.066
  784    HA   THR 104           HA       THR 104   8.559  -8.843   0.722
  785    HB   THR 104           HB       THR 104   8.017 -11.590   0.569
  786    HG1  THR 104           HG1      THR 104   9.988 -12.031   1.619
  787   HG21  THR 104          HG21      THR 104   7.996  -9.971  -1.289
  788   HG22  THR 104          HG22      THR 104   8.944 -11.406  -1.677
  789   HG23  THR 104          HG23      THR 104   9.758  -9.905  -1.236
  790    H    GLN 105           HN       GLN 105   7.064  -7.980   2.182
  791    HA   GLN 105           HA       GLN 105   5.667  -9.930   3.891
  792    HB2  GLN 105           HB2      GLN 105   5.965  -6.945   4.083
  793    HB3  GLN 105           HB1      GLN 105   4.709  -7.801   4.964
  794    HG2  GLN 105           HG2      GLN 105   6.505  -9.189   6.004
  795    HG3  GLN 105           HG1      GLN 105   7.683  -8.114   5.243
  796   HE21  GLN 105          HE21      GLN 105   5.275  -8.436   7.709
  797   HE22  GLN 105          HE22      GLN 105   5.623  -6.953   8.529
  798    H    ILE 106           HN       ILE 106   3.615 -10.459   3.465
  799    HA   ILE 106           HA       ILE 106   2.088  -8.774   1.600
  800    HB   ILE 106           HB       ILE 106   2.404 -11.759   1.413
  801   HG12  ILE 106          HG12      ILE 106   3.203  -9.766  -0.683
  802   HG13  ILE 106          HG11      ILE 106   4.308 -10.241   0.601
  803   HG21  ILE 106          HG21      ILE 106   0.799  -9.881  -0.310
  804   HG22  ILE 106          HG22      ILE 106   0.151 -11.073   0.815
  805   HG23  ILE 106          HG23      ILE 106   1.034 -11.602  -0.615
  806   HD11  ILE 106          HD11      ILE 106   3.039 -12.089  -1.402
  807   HD12  ILE 106          HD12      ILE 106   4.158 -12.561  -0.124
  808   HD13  ILE 106          HD13      ILE 106   4.703 -11.508  -1.430
  809    H    THR 107           HN       THR 107   0.030  -8.467   2.247
  810    HA   THR 107           HA       THR 107  -1.347 -10.493   3.804
  811    HB   THR 107           HB       THR 107  -0.958  -7.694   4.900
  812    HG1  THR 107           HG1      THR 107   0.692  -9.567   5.139
  813   HG21  THR 107          HG21      THR 107  -2.582 -10.019   5.942
  814   HG22  THR 107          HG22      THR 107  -3.200  -8.468   5.375
  815   HG23  THR 107          HG23      THR 107  -2.237  -8.547   6.850
  816    H    LYS 108           HN       LYS 108  -3.381 -10.635   3.100
  817    HA   LYS 108           HA       LYS 108  -4.452  -8.620   1.327
  818    HB2  LYS 108           HB2      LYS 108  -5.647 -11.184   2.416
  819    HB3  LYS 108           HB1      LYS 108  -6.447 -10.140   1.250
  820    HG2  LYS 108           HG2      LYS 108  -4.556 -10.511  -0.309
  821    HG3  LYS 108           HG1      LYS 108  -3.877 -11.657   0.849
  822    HD2  LYS 108           HD2      LYS 108  -5.965 -12.983   0.695
  823    HD3  LYS 108           HD1      LYS 108  -6.544 -11.871  -0.547
  824    HE2  LYS 108           HE2      LYS 108  -3.962 -13.396  -0.773
  825    HE3  LYS 108           HE1      LYS 108  -5.496 -14.018  -1.375
  826    HZ1  LYS 108           HZ1      LYS 108  -5.624 -12.341  -2.971
  827    HZ2  LYS 108           HZ2      LYS 108  -3.998 -12.802  -3.006
  828    HZ3  LYS 108           HZ3      LYS 108  -4.454 -11.376  -2.217
  829    H    VAL 109           HN       VAL 109  -6.197  -7.224   1.825
  830    HA   VAL 109           HA       VAL 109  -6.985  -7.232   4.643
  831    HB   VAL 109           HB       VAL 109  -5.215  -5.583   4.364
  832   HG11  VAL 109          HG11      VAL 109  -6.988  -4.300   2.294
  833   HG12  VAL 109          HG12      VAL 109  -5.488  -5.174   1.972
  834   HG13  VAL 109          HG13      VAL 109  -5.454  -3.665   2.889
  835   HG21  VAL 109          HG21      VAL 109  -7.097  -5.129   5.913
  836   HG22  VAL 109          HG22      VAL 109  -7.866  -4.180   4.645
  837   HG23  VAL 109          HG23      VAL 109  -6.317  -3.670   5.309
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1   2.944  20.957  -2.515
    2    H2   GLY   1           HT2      GLY   1   3.229  21.306  -4.143
    3    H3   GLY   1           HT3      GLY   1   3.890  19.913  -3.448
    4    HA2  GLY   1           HA1      GLY   1   1.006  20.450  -3.862
    5    HA3  GLY   1           HA2      GLY   1   1.993  19.353  -4.816
    6    H    GLY   2           HN       GLY   2  -0.266  19.408  -2.502
    7    HA2  GLY   2           HA2      GLY   2   0.810  17.015  -1.141
    8    HA3  GLY   2           HA1      GLY   2  -0.295  18.156  -0.385
    9    H    SER   3           HN       SER   3  -2.239  18.520  -2.194
   10    HA   SER   3           HA       SER   3  -3.367  15.822  -2.478
   11    HB2  SER   3           HB2      SER   3  -4.888  18.435  -2.361
   12    HB3  SER   3           HB1      SER   3  -5.551  16.805  -2.242
   13    HG   SER   3           HG       SER   3  -3.661  17.851  -0.405
   14    H    MET   4           HN       MET   4  -2.630  15.291  -4.470
   15    HA   MET   4           HA       MET   4  -3.707  16.858  -6.715
   16    HB2  MET   4           HB2      MET   4  -1.343  17.287  -6.687
   17    HB3  MET   4           HB1      MET   4  -0.979  15.581  -6.478
   18    HG2  MET   4           HG2      MET   4  -0.508  16.202  -8.731
   19    HG3  MET   4           HG1      MET   4  -1.917  15.145  -8.716
   20    HE1  MET   4           HE1      MET   4  -2.597  17.577 -11.723
   21    HE2  MET   4           HE2      MET   4  -2.599  15.889 -11.217
   22    HE3  MET   4           HE3      MET   4  -1.096  16.810 -11.204
   23    H    ARG   5           HN       ARG   5  -2.596  13.728  -5.536
   24    HA   ARG   5           HA       ARG   5  -3.874  12.360  -7.760
   25    HB2  ARG   5           HB2      ARG   5  -2.035  11.544  -5.561
   26    HB3  ARG   5           HB1      ARG   5  -3.006  10.316  -6.354
   27    HG2  ARG   5           HG2      ARG   5  -1.002  10.264  -7.517
   28    HG3  ARG   5           HG1      ARG   5  -2.040  11.262  -8.537
   29    HD2  ARG   5           HD2      ARG   5  -1.035  13.277  -7.614
   30    HD3  ARG   5           HD1      ARG   5  -0.026  12.301  -6.546
   31    HE   ARG   5           HE       ARG   5   0.206  11.852  -9.423
   32   HH11  ARG   5          HH11      ARG   5   1.560  13.235  -6.510
   33   HH12  ARG   5          HH12      ARG   5   3.146  13.424  -7.188
   34   HH21  ARG   5          HH21      ARG   5   2.300  12.061 -10.303
   35   HH22  ARG   5          HH22      ARG   5   3.573  12.733  -9.332
   36    HA   PRO   6           HA       PRO   6  -7.602  11.897  -5.353
   37    HB2  PRO   6           HB2      PRO   6  -8.933  10.350  -7.137
   38    HB3  PRO   6           HB1      PRO   6  -8.716  12.084  -7.353
   39    HG2  PRO   6           HG2      PRO   6  -7.165   9.819  -8.524
   40    HG3  PRO   6           HG1      PRO   6  -7.820  11.262  -9.308
   41    HD2  PRO   6           HD2      PRO   6  -5.232  11.083  -8.588
   42    HD3  PRO   6           HD1      PRO   6  -6.117  12.620  -8.521
   43    HA   PRO   7           HA       PRO   7  -6.581   7.999  -3.402
   44    HB2  PRO   7           HB2      PRO   7  -9.065   8.358  -1.898
   45    HB3  PRO   7           HB1      PRO   7  -7.405   8.277  -1.307
   46    HG2  PRO   7           HG2      PRO   7  -8.834  10.556  -1.303
   47    HG3  PRO   7           HG1      PRO   7  -7.077  10.540  -1.545
   48    HD2  PRO   7           HD2      PRO   7  -9.265  10.854  -3.562
   49    HD3  PRO   7           HD1      PRO   7  -7.684  11.661  -3.474
   50    H    ILE   8           HN       ILE   8  -7.383   5.920  -3.257
   51    HA   ILE   8           HA       ILE   8  -9.511   5.284  -5.147
   52    HB   ILE   8           HB       ILE   8  -7.562   3.451  -3.764
   53   HG12  ILE   8          HG12      ILE   8  -6.562   5.234  -5.303
   54   HG13  ILE   8          HG11      ILE   8  -6.149   3.561  -5.640
   55   HG21  ILE   8          HG21      ILE   8  -9.444   2.214  -4.489
   56   HG22  ILE   8          HG22      ILE   8  -8.163   1.927  -5.666
   57   HG23  ILE   8          HG23      ILE   8  -9.475   3.044  -6.045
   58   HD11  ILE   8          HD11      ILE   8  -8.327   5.038  -7.081
   59   HD12  ILE   8          HD12      ILE   8  -7.600   3.484  -7.505
   60   HD13  ILE   8          HD13      ILE   8  -6.654   4.967  -7.636
   61    H    ILE   9           HN       ILE   9 -11.357   5.734  -3.865
   62    HA   ILE   9           HA       ILE   9 -11.666   4.737  -1.230
   63    HB   ILE   9           HB       ILE   9 -13.638   5.810  -3.240
   64   HG12  ILE   9          HG12      ILE   9 -13.710   7.753  -1.935
   65   HG13  ILE   9          HG11      ILE   9 -12.901   6.998  -0.585
   66   HG21  ILE   9          HG21      ILE   9 -15.008   4.398  -2.013
   67   HG22  ILE   9          HG22      ILE   9 -15.164   5.944  -1.176
   68   HG23  ILE   9          HG23      ILE   9 -14.120   4.680  -0.516
   69   HD11  ILE   9          HD11      ILE   9 -11.440   8.576  -1.607
   70   HD12  ILE   9          HD12      ILE   9 -11.701   7.860  -3.198
   71   HD13  ILE   9          HD13      ILE   9 -10.836   6.956  -1.954
   72    H    ILE  10           HN       ILE  10 -11.364   2.576  -1.090
   73    HA   ILE  10           HA       ILE  10 -12.869   0.754  -2.788
   74    HB   ILE  10           HB       ILE  10 -10.893   0.107  -0.607
   75   HG12  ILE  10          HG12      ILE  10 -10.306   0.126  -3.550
   76   HG13  ILE  10          HG11      ILE  10 -10.081   1.565  -2.570
   77   HG21  ILE  10          HG21      ILE  10 -12.198  -1.799  -1.114
   78   HG22  ILE  10          HG22      ILE  10 -10.677  -2.003  -1.986
   79   HG23  ILE  10          HG23      ILE  10 -12.122  -1.481  -2.848
   80   HD11  ILE  10          HD11      ILE  10  -8.486   0.383  -1.177
   81   HD12  ILE  10          HD12      ILE  10  -8.005   0.318  -2.874
   82   HD13  ILE  10          HD13      ILE  10  -8.744  -1.089  -2.111
   83    H    HIS  11           HN       HIS  11 -14.507  -0.490  -2.095
   84    HA   HIS  11           HA       HIS  11 -15.667   0.098   0.509
   85    HB2  HIS  11           HB2      HIS  11 -16.571  -1.322  -1.979
   86    HB3  HIS  11           HB1      HIS  11 -17.406  -1.622  -0.460
   87    HD2  HIS  11           HD2      HIS  11 -16.629   1.914  -0.176
   88    HE1  HIS  11           HE1      HIS  11 -20.192   1.805  -2.441
   89    HE2  HIS  11           HE2      HIS  11 -18.747   3.214  -0.913
   90    H    ARG  12           HN       ARG  12 -16.076  -1.458   2.099
   91    HA   ARG  12           HA       ARG  12 -14.115  -3.472   2.400
   92    HB2  ARG  12           HB2      ARG  12 -15.342  -3.980   4.473
   93    HB3  ARG  12           HB1      ARG  12 -15.079  -2.259   4.283
   94    HG2  ARG  12           HG2      ARG  12 -17.336  -1.887   3.689
   95    HG3  ARG  12           HG1      ARG  12 -17.638  -3.617   3.510
   96    HD2  ARG  12           HD2      ARG  12 -17.153  -3.912   5.888
   97    HD3  ARG  12           HD1      ARG  12 -16.965  -2.178   6.062
   98    HE   ARG  12           HE       ARG  12 -19.511  -3.065   4.991
   99   HH11  ARG  12          HH11      ARG  12 -17.680  -2.148   7.831
  100   HH12  ARG  12          HH12      ARG  12 -19.091  -1.799   8.778
  101   HH21  ARG  12          HH21      ARG  12 -21.367  -2.607   6.237
  102   HH22  ARG  12          HH22      ARG  12 -21.187  -2.063   7.876
  103    H    ALA  13           HN       ALA  13 -14.225  -5.656   2.151
  104    HA   ALA  13           HA       ALA  13 -16.737  -6.786   1.093
  105    HB1  ALA  13           HB1      ALA  13 -15.365  -6.707  -0.796
  106    HB2  ALA  13           HB2      ALA  13 -15.143  -8.351  -0.197
  107    HB3  ALA  13           HB3      ALA  13 -13.917  -7.123   0.119
  108    H    GLY  14           HN       GLY  14 -16.468  -6.893   3.697
  109    HA2  GLY  14           HA2      GLY  14 -16.789  -8.602   5.270
  110    HA3  GLY  14           HA1      GLY  14 -15.928  -9.711   4.209
  111    H    LYS  15           HN       LYS  15 -13.705  -9.859   4.317
  112    HA   LYS  15           HA       LYS  15 -12.503  -8.565   6.664
  113    HB2  LYS  15           HB2      LYS  15 -12.623 -11.067   6.597
  114    HB3  LYS  15           HB1      LYS  15 -11.512 -10.991   5.247
  115    HG2  LYS  15           HG2      LYS  15  -9.824  -9.960   6.618
  116    HG3  LYS  15           HG1      LYS  15 -10.941  -9.902   7.981
  117    HD2  LYS  15           HD2      LYS  15  -9.595 -11.772   8.392
  118    HD3  LYS  15           HD1      LYS  15 -11.096 -12.433   7.740
  119    HE2  LYS  15           HE2      LYS  15 -10.049 -12.585   5.523
  120    HE3  LYS  15           HE1      LYS  15  -8.548 -11.951   6.195
  121    HZ1  LYS  15           HZ1      LYS  15  -8.316 -13.879   7.551
  122    HZ2  LYS  15           HZ2      LYS  15  -8.605 -14.400   5.968
  123    HZ3  LYS  15           HZ3      LYS  15  -9.846 -14.456   7.114
  124    H    LYS  16           HN       LYS  16 -12.309  -8.956   3.259
  125    HA   LYS  16           HA       LYS  16  -9.781  -7.452   3.185
  126    HB2  LYS  16           HB2      LYS  16 -10.949  -9.485   1.295
  127    HB3  LYS  16           HB1      LYS  16  -9.660  -8.398   0.807
  128    HG2  LYS  16           HG2      LYS  16  -8.321  -9.300   2.736
  129    HG3  LYS  16           HG1      LYS  16  -9.580 -10.524   2.926
  130    HD2  LYS  16           HD2      LYS  16  -7.875 -11.500   1.587
  131    HD3  LYS  16           HD1      LYS  16  -9.217 -11.116   0.507
  132    HE2  LYS  16           HE2      LYS  16  -7.930  -8.885   0.132
  133    HE3  LYS  16           HE1      LYS  16  -6.550  -9.772   0.783
  134    HZ1  LYS  16           HZ1      LYS  16  -8.179 -10.606  -1.555
  135    HZ2  LYS  16           HZ2      LYS  16  -6.817 -11.409  -0.958
  136    HZ3  LYS  16           HZ3      LYS  16  -6.659  -9.870  -1.640
  137    H    TYR  17           HN       TYR  17  -9.573  -6.332   0.953
  138    HA   TYR  17           HA       TYR  17 -12.081  -4.881   0.379
  139    HB2  TYR  17           HB2      TYR  17  -9.236  -3.853   0.244
  140    HB3  TYR  17           HB1      TYR  17 -10.672  -2.941  -0.205
  141    HD1  TYR  17           HD2      TYR  17  -8.843  -4.452   2.570
  142    HD2  TYR  17           HD1      TYR  17 -12.061  -1.922   1.462
  143    HE1  TYR  17           HE2      TYR  17  -9.048  -3.760   4.887
  144    HE2  TYR  17           HE1      TYR  17 -12.298  -1.180   3.792
  145    HH   TYR  17           HH       TYR  17  -9.979  -1.644   6.101
  146    H    GLY  18           HN       GLY  18  -9.822  -7.015  -0.772
  147    HA2  GLY  18           HA2      GLY  18 -10.326  -8.025  -2.921
  148    HA3  GLY  18           HA1      GLY  18 -10.665  -6.416  -3.514
  149    H    PHE  19           HN       PHE  19  -7.898  -6.454  -1.574
  150    HA   PHE  19           HA       PHE  19  -6.226  -7.050  -3.887
  151    HB2  PHE  19           HB2      PHE  19  -4.972  -5.030  -3.815
  152    HB3  PHE  19           HB1      PHE  19  -6.664  -4.625  -3.940
  153    HD1  PHE  19           HD1      PHE  19  -7.867  -3.728  -1.922
  154    HD2  PHE  19           HD2      PHE  19  -3.648  -4.290  -2.017
  155    HE1  PHE  19           HE1      PHE  19  -7.619  -2.199  -0.007
  156    HE2  PHE  19           HE2      PHE  19  -3.398  -2.771  -0.102
  157    HZ   PHE  19           HZ       PHE  19  -5.383  -1.726   0.909
  158    H    THR  20           HN       THR  20  -3.923  -6.805  -3.399
  159    HA   THR  20           HA       THR  20  -3.308  -8.045  -0.787
  160    HB   THR  20           HB       THR  20  -1.804  -8.372  -3.386
  161    HG1  THR  20           HG1      THR  20  -4.058  -9.392  -2.962
  162   HG21  THR  20          HG21      THR  20  -0.692 -10.238  -2.205
  163   HG22  THR  20          HG22      THR  20  -1.538  -9.774  -0.729
  164   HG23  THR  20          HG23      THR  20  -0.362  -8.673  -1.455
  165    H    LEU  21           HN       LEU  21  -2.234  -6.691   0.490
  166    HA   LEU  21           HA       LEU  21  -0.651  -4.546  -0.699
  167    HB2  LEU  21           HB2      LEU  21  -2.242  -3.973   1.094
  168    HB3  LEU  21           HB1      LEU  21  -1.405  -5.061   2.184
  169    HG   LEU  21           HG       LEU  21   0.613  -3.654   2.020
  170   HD11  LEU  21          HD11      LEU  21   0.322  -2.724  -0.181
  171   HD12  LEU  21          HD12      LEU  21   0.422  -1.419   1.000
  172   HD13  LEU  21          HD13      LEU  21  -1.141  -1.887   0.331
  173   HD21  LEU  21          HD21      LEU  21  -1.891  -2.177   2.799
  174   HD22  LEU  21          HD22      LEU  21  -0.251  -1.762   3.300
  175   HD23  LEU  21          HD23      LEU  21  -0.974  -3.285   3.819
  176    H    ARG  22           HN       ARG  22   1.503  -4.743  -0.870
  177    HA   ARG  22           HA       ARG  22   2.793  -6.712   0.887
  178    HB2  ARG  22           HB2      ARG  22   3.221  -6.332  -2.072
  179    HB3  ARG  22           HB1      ARG  22   4.332  -7.225  -1.052
  180    HG2  ARG  22           HG2      ARG  22   2.099  -8.511  -0.395
  181    HG3  ARG  22           HG1      ARG  22   1.615  -7.934  -1.985
  182    HD2  ARG  22           HD2      ARG  22   2.657 -10.189  -1.994
  183    HD3  ARG  22           HD1      ARG  22   3.453  -9.016  -3.034
  184    HE   ARG  22           HE       ARG  22   4.488  -9.673  -0.354
  185   HH11  ARG  22          HH11      ARG  22   4.958  -9.294  -3.804
  186   HH12  ARG  22          HH12      ARG  22   6.672  -9.529  -3.721
  187   HH21  ARG  22          HH21      ARG  22   6.748 -10.014  -0.260
  188   HH22  ARG  22          HH22      ARG  22   7.691  -9.929  -1.724
  189    H    ALA  23           HN       ALA  23   4.493  -6.030   1.938
  190    HA   ALA  23           HA       ALA  23   5.389  -3.309   1.619
  191    HB1  ALA  23           HB1      ALA  23   6.691  -3.720   3.610
  192    HB2  ALA  23           HB2      ALA  23   6.421  -5.459   3.469
  193    HB3  ALA  23           HB3      ALA  23   5.072  -4.384   3.840
  194    H    ILE  24           HN       ILE  24   6.602  -3.036  -0.186
  195    HA   ILE  24           HA       ILE  24   8.528  -5.062  -0.941
  196    HB   ILE  24           HB       ILE  24   8.984  -3.608  -2.905
  197   HG12  ILE  24          HG12      ILE  24   6.560  -1.998  -2.195
  198   HG13  ILE  24          HG11      ILE  24   8.129  -1.513  -1.557
  199   HG21  ILE  24          HG21      ILE  24   6.758  -3.979  -3.960
  200   HG22  ILE  24          HG22      ILE  24   6.124  -4.398  -2.369
  201   HG23  ILE  24          HG23      ILE  24   7.387  -5.388  -3.104
  202   HD11  ILE  24          HD11      ILE  24   9.001  -1.250  -3.779
  203   HD12  ILE  24          HD12      ILE  24   7.490  -0.351  -3.639
  204   HD13  ILE  24          HD13      ILE  24   7.518  -1.902  -4.477
  205    H    ARG  25           HN       ARG  25  10.718  -4.795  -1.066
  206    HA   ARG  25           HA       ARG  25  11.786  -2.683   0.672
  207    HB2  ARG  25           HB2      ARG  25  12.015  -5.205   1.191
  208    HB3  ARG  25           HB1      ARG  25  13.223  -5.212  -0.084
  209    HG2  ARG  25           HG2      ARG  25  14.614  -3.708   1.116
  210    HG3  ARG  25           HG1      ARG  25  13.346  -3.393   2.306
  211    HD2  ARG  25           HD2      ARG  25  13.464  -5.642   3.118
  212    HD3  ARG  25           HD1      ARG  25  14.570  -6.102   1.827
  213    HE   ARG  25           HE       ARG  25  15.207  -4.570   4.227
  214   HH11  ARG  25          HH11      ARG  25  16.256  -5.911   1.171
  215   HH12  ARG  25          HH12      ARG  25  17.952  -5.758   1.537
  216   HH21  ARG  25          HH21      ARG  25  17.437  -4.408   4.729
  217   HH22  ARG  25          HH22      ARG  25  18.617  -4.915   3.560
  218    H    VAL  26           HN       VAL  26  12.598  -1.060  -0.450
  219    HA   VAL  26           HA       VAL  26  14.092  -1.651  -2.922
  220    HB   VAL  26           HB       VAL  26  12.603   0.868  -2.156
  221   HG11  VAL  26          HG11      VAL  26  13.187   1.691  -4.389
  222   HG12  VAL  26          HG12      VAL  26  14.166   0.250  -4.664
  223   HG13  VAL  26          HG13      VAL  26  14.626   1.401  -3.410
  224   HG21  VAL  26          HG21      VAL  26  11.128  -0.944  -2.837
  225   HG22  VAL  26          HG22      VAL  26  12.068  -1.172  -4.311
  226   HG23  VAL  26          HG23      VAL  26  11.165   0.323  -4.065
  227    H    TYR  27           HN       TYR  27  16.227  -1.275  -2.833
  228    HA   TYR  27           HA       TYR  27  17.363  -0.058  -0.503
  229    HB2  TYR  27           HB2      TYR  27  18.459  -1.235  -3.008
  230    HB3  TYR  27           HB1      TYR  27  19.494  -0.253  -2.000
  231    HD1  TYR  27           HD1      TYR  27  19.209  -0.912   0.635
  232    HD2  TYR  27           HD2      TYR  27  18.654  -3.509  -2.688
  233    HE1  TYR  27           HE1      TYR  27  19.662  -2.846   2.081
  234    HE2  TYR  27           HE2      TYR  27  19.107  -5.452  -1.248
  235    HH   TYR  27           HH       TYR  27  20.403  -5.857   0.954
  236    H    MET  28           HN       MET  28  18.370   1.859  -0.314
  237    HA   MET  28           HA       MET  28  17.480   3.995  -1.954
  238    HB2  MET  28           HB2      MET  28  19.270   3.692   0.419
  239    HB3  MET  28           HB1      MET  28  19.324   5.184  -0.489
  240    HG2  MET  28           HG2      MET  28  16.880   3.991   0.777
  241    HG3  MET  28           HG1      MET  28  17.832   5.321   1.422
  242    HE1  MET  28           HE1      MET  28  14.896   7.524   0.415
  243    HE2  MET  28           HE2      MET  28  16.269   7.348   1.508
  244    HE3  MET  28           HE3      MET  28  15.043   6.084   1.424
  245    H    GLY  29           HN       GLY  29  18.566   5.131  -3.517
  246    HA2  GLY  29           HA2      GLY  29  20.790   3.776  -4.770
  247    HA3  GLY  29           HA1      GLY  29  19.940   5.183  -5.387
  248    H    ASP  30           HN       ASP  30  21.884   4.433  -2.501
  249    HA   ASP  30           HA       ASP  30  23.959   6.237  -3.226
  250    HB2  ASP  30           HB2      ASP  30  23.638   7.763  -1.206
  251    HB3  ASP  30           HB1      ASP  30  22.569   8.032  -2.573
  252    H    SER  31           HN       SER  31  22.404   4.958  -0.284
  253    HA   SER  31           HA       SER  31  25.039   3.942   0.534
  254    HB2  SER  31           HB2      SER  31  22.686   4.267   2.382
  255    HB3  SER  31           HB1      SER  31  24.401   4.220   2.777
  256    HG   SER  31           HG       SER  31  23.113   6.292   1.307
  257    H    ASP  32           HN       ASP  32  23.924   2.204   2.561
  258    HA   ASP  32           HA       ASP  32  23.065   0.014   0.796
  259    HB2  ASP  32           HB2      ASP  32  23.746  -1.454   2.710
  260    HB3  ASP  32           HB1      ASP  32  25.071  -0.558   1.975
  261    H    VAL  33           HN       VAL  33  21.913   2.168   2.999
  262    HA   VAL  33           HA       VAL  33  20.070   0.710   4.503
  263    HB   VAL  33           HB       VAL  33  20.628   2.981   5.075
  264   HG11  VAL  33          HG11      VAL  33  20.877   3.781   2.726
  265   HG12  VAL  33          HG12      VAL  33  19.999   4.887   3.781
  266   HG13  VAL  33          HG13      VAL  33  19.121   3.875   2.635
  267   HG21  VAL  33          HG21      VAL  33  17.726   2.891   4.314
  268   HG22  VAL  33          HG22      VAL  33  18.463   3.860   5.591
  269   HG23  VAL  33          HG23      VAL  33  18.414   2.103   5.735
  270    H    TYR  34           HN       TYR  34  17.874   0.393   4.275
  271    HA   TYR  34           HA       TYR  34  17.006   0.170   1.483
  272    HB2  TYR  34           HB2      TYR  34  15.445  -1.531   2.204
  273    HB3  TYR  34           HB1      TYR  34  17.053  -1.940   2.775
  274    HD1  TYR  34           HD1      TYR  34  17.597  -1.728   5.192
  275    HD2  TYR  34           HD2      TYR  34  13.656  -1.063   3.726
  276    HE1  TYR  34           HE1      TYR  34  16.713  -1.937   7.478
  277    HE2  TYR  34           HE2      TYR  34  12.768  -1.273   6.003
  278    HH   TYR  34           HH       TYR  34  14.840  -1.402   8.786
  279    H    THR  35           HN       THR  35  14.604   0.213   1.280
  280    HA   THR  35           HA       THR  35  13.328   2.261   2.929
  281    HB   THR  35           HB       THR  35  12.825   2.512   0.032
  282    HG1  THR  35           HG1      THR  35  15.067   2.218  -0.029
  283   HG21  THR  35          HG21      THR  35  12.771   4.857   0.540
  284   HG22  THR  35          HG22      THR  35  13.549   4.586   2.099
  285   HG23  THR  35          HG23      THR  35  11.904   4.008   1.821
  286    H    VAL  36           HN       VAL  36  11.635   1.146   3.683
  287    HA   VAL  36           HA       VAL  36  10.416  -0.931   2.072
  288    HB   VAL  36           HB       VAL  36  10.719  -1.561   4.334
  289   HG11  VAL  36          HG11      VAL  36   9.703  -0.301   6.224
  290   HG12  VAL  36          HG12      VAL  36   9.336   1.002   5.093
  291   HG13  VAL  36          HG13      VAL  36  11.012   0.550   5.405
  292   HG21  VAL  36          HG21      VAL  36   8.421  -1.979   5.128
  293   HG22  VAL  36          HG22      VAL  36   8.638  -2.347   3.416
  294   HG23  VAL  36          HG23      VAL  36   7.822  -0.860   3.902
  295    H    HIS  37           HN       HIS  37   8.958  -0.427   0.640
  296    HA   HIS  37           HA       HIS  37   7.181   1.867   1.124
  297    HB2  HIS  37           HB2      HIS  37   7.921   0.482  -1.464
  298    HB3  HIS  37           HB1      HIS  37   6.770   1.796  -1.331
  299    HD2  HIS  37           HD2      HIS  37  10.583   1.169  -1.362
  300    HE1  HIS  37           HE1      HIS  37   9.884   5.339  -1.339
  301    HE2  HIS  37           HE2      HIS  37  11.583   3.521  -1.801
  302    H    HIS  38           HN       HIS  38   4.944   1.632   0.676
  303    HA   HIS  38           HA       HIS  38   4.012  -1.136   0.942
  304    HB2  HIS  38           HB2      HIS  38   2.476   1.409   1.520
  305    HB3  HIS  38           HB1      HIS  38   1.975  -0.234   1.913
  306    HD2  HIS  38           HD2      HIS  38   3.881   2.671   3.425
  307    HE1  HIS  38           HE1      HIS  38   4.754  -0.720   5.795
  308    HE2  HIS  38           HE2      HIS  38   5.088   1.778   5.534
  309    H    MET  39           HN       MET  39   3.698  -1.928  -1.029
  310    HA   MET  39           HA       MET  39   2.139  -0.295  -2.919
  311    HB2  MET  39           HB2      MET  39   4.249  -0.473  -3.920
  312    HB3  MET  39           HB1      MET  39   4.476  -2.128  -3.370
  313    HG2  MET  39           HG2      MET  39   2.187  -1.870  -5.132
  314    HG3  MET  39           HG1      MET  39   3.676  -1.316  -5.894
  315    HE1  MET  39           HE1      MET  39   5.726  -4.371  -6.495
  316    HE2  MET  39           HE2      MET  39   5.945  -2.823  -5.679
  317    HE3  MET  39           HE3      MET  39   5.088  -2.894  -7.223
  318    H    VAL  40           HN       VAL  40   0.394  -1.170  -3.841
  319    HA   VAL  40           HA       VAL  40  -0.644  -3.624  -2.826
  320    HB   VAL  40           HB       VAL  40  -2.359  -2.148  -3.338
  321   HG11  VAL  40          HG11      VAL  40  -2.517  -0.865  -5.450
  322   HG12  VAL  40          HG12      VAL  40  -0.928  -1.484  -5.900
  323   HG13  VAL  40          HG13      VAL  40  -1.104  -0.460  -4.477
  324   HG21  VAL  40          HG21      VAL  40  -3.340  -2.952  -5.624
  325   HG22  VAL  40          HG22      VAL  40  -3.218  -4.062  -4.256
  326   HG23  VAL  40          HG23      VAL  40  -2.015  -4.117  -5.544
  327    H    TRP  41           HN       TRP  41  -0.031  -5.540  -3.499
  328    HA   TRP  41           HA       TRP  41   1.657  -5.805  -5.823
  329    HB2  TRP  41           HB2      TRP  41   2.219  -6.911  -3.713
  330    HB3  TRP  41           HB1      TRP  41   0.729  -7.848  -3.802
  331    HD1  TRP  41           HD1      TRP  41   0.812 -10.062  -5.156
  332    HE1  TRP  41           HE1      TRP  41   2.629 -11.281  -6.512
  333    HE3  TRP  41           HE3      TRP  41   4.330  -6.361  -5.289
  334    HZ2  TRP  41           HZ2      TRP  41   5.216 -10.737  -7.512
  335    HZ3  TRP  41           HZ3      TRP  41   6.450  -6.789  -6.466
  336    HH2  TRP  41           HH2      TRP  41   6.880  -8.934  -7.552
  337    H    HIS  42           HN       HIS  42  -1.602  -6.813  -4.917
  338    HA   HIS  42           HA       HIS  42  -2.105  -7.443  -7.704
  339    HB2  HIS  42           HB2      HIS  42  -1.198  -9.554  -6.591
  340    HB3  HIS  42           HB1      HIS  42  -2.645  -9.551  -5.590
  341    HD2  HIS  42           HD2      HIS  42  -1.532 -10.329  -9.220
  342    HE1  HIS  42           HE1      HIS  42  -5.578 -11.463  -8.760
  343    HE2  HIS  42           HE2      HIS  42  -3.496 -11.721 -10.178
  344    H    VAL  43           HN       VAL  43  -4.259  -7.382  -8.242
  345    HA   VAL  43           HA       VAL  43  -6.133  -6.673  -6.086
  346    HB   VAL  43           HB       VAL  43  -6.058  -5.412  -8.840
  347   HG11  VAL  43          HG11      VAL  43  -8.312  -5.598  -7.984
  348   HG12  VAL  43          HG12      VAL  43  -7.789  -3.914  -7.939
  349   HG13  VAL  43          HG13      VAL  43  -7.819  -4.868  -6.457
  350   HG21  VAL  43          HG21      VAL  43  -4.217  -4.600  -7.457
  351   HG22  VAL  43          HG22      VAL  43  -5.351  -4.211  -6.165
  352   HG23  VAL  43          HG23      VAL  43  -5.429  -3.341  -7.696
  353    H    GLU  44           HN       GLU  44  -7.926  -7.871  -6.079
  354    HA   GLU  44           HA       GLU  44  -8.284 -10.101  -7.652
  355    HB2  GLU  44           HB2      GLU  44 -10.255  -8.463  -6.062
  356    HB3  GLU  44           HB1      GLU  44 -10.578 -10.051  -6.701
  357    HG2  GLU  44           HG2      GLU  44  -8.474  -9.368  -4.687
  358    HG3  GLU  44           HG1      GLU  44 -10.000 -10.186  -4.366
  359    H    ASP  45           HN       ASP  45  -9.223 -10.499  -9.554
  360    HA   ASP  45           HA       ASP  45  -9.715  -8.447 -11.400
  361    HB2  ASP  45           HB2      ASP  45 -10.457 -11.374 -11.438
  362    HB3  ASP  45           HB1      ASP  45 -10.717 -10.298 -12.806
  363    H    GLY  46           HN       GLY  46 -11.286  -7.011 -11.131
  364    HA2  GLY  46           HA2      GLY  46 -13.468  -6.234 -11.216
  365    HA3  GLY  46           HA1      GLY  46 -14.029  -7.899 -11.168
  366    H    GLY  47           HN       GLY  47 -11.784  -7.045  -8.744
  367    HA2  GLY  47           HA2      GLY  47 -13.742  -7.460  -6.679
  368    HA3  GLY  47           HA1      GLY  47 -12.032  -7.128  -6.443
  369    HA   PRO  48           HA       PRO  48 -14.867  -3.447  -5.250
  370    HB2  PRO  48           HB2      PRO  48 -13.122  -3.807  -2.862
  371    HB3  PRO  48           HB1      PRO  48 -14.831  -3.351  -2.925
  372    HG2  PRO  48           HG2      PRO  48 -14.202  -5.778  -2.207
  373    HG3  PRO  48           HG1      PRO  48 -15.450  -5.550  -3.438
  374    HD2  PRO  48           HD2      PRO  48 -12.576  -6.262  -3.832
  375    HD3  PRO  48           HD1      PRO  48 -14.015  -7.015  -4.511
  376    H    ALA  49           HN       ALA  49 -11.526  -4.050  -4.345
  377    HA   ALA  49           HA       ALA  49 -10.651  -1.392  -4.534
  378    HB1  ALA  49           HB1      ALA  49  -9.064  -3.933  -4.909
  379    HB2  ALA  49           HB2      ALA  49  -9.319  -3.067  -3.393
  380    HB3  ALA  49           HB3      ALA  49  -8.364  -2.330  -4.681
  381    H    SER  50           HN       SER  50 -10.875  -3.915  -6.952
  382    HA   SER  50           HA       SER  50  -9.498  -2.581  -9.025
  383    HB2  SER  50           HB2      SER  50 -10.457  -5.069  -8.756
  384    HB3  SER  50           HB1      SER  50 -11.796  -4.367  -9.664
  385    HG   SER  50           HG       SER  50  -9.063  -4.542 -10.419
  386    H    GLU  51           HN       GLU  51 -12.804  -2.619  -7.895
  387    HA   GLU  51           HA       GLU  51 -13.913  -1.089 -10.026
  388    HB2  GLU  51           HB2      GLU  51 -14.967  -1.433  -7.214
  389    HB3  GLU  51           HB1      GLU  51 -15.892  -0.917  -8.619
  390    HG2  GLU  51           HG2      GLU  51 -15.453  -3.134  -9.639
  391    HG3  GLU  51           HG1      GLU  51 -14.673  -3.621  -8.140
  392    H    ALA  52           HN       ALA  52 -12.566  -0.401  -6.909
  393    HA   ALA  52           HA       ALA  52 -13.257   2.344  -6.790
  394    HB1  ALA  52           HB1      ALA  52 -11.009   0.904  -5.405
  395    HB2  ALA  52           HB2      ALA  52 -12.679   0.953  -4.837
  396    HB3  ALA  52           HB3      ALA  52 -11.732   2.440  -4.930
  397    H    GLY  53           HN       GLY  53 -10.724   0.573  -8.364
  398    HA2  GLY  53           HA2      GLY  53  -9.662   1.699 -10.243
  399    HA3  GLY  53           HA1      GLY  53  -9.590   3.129  -9.237
  400    H    LEU  54           HN       LEU  54  -8.806   0.470  -7.361
  401    HA   LEU  54           HA       LEU  54  -6.082   1.298  -7.149
  402    HB2  LEU  54           HB2      LEU  54  -7.850  -0.219  -5.632
  403    HB3  LEU  54           HB1      LEU  54  -6.614  -1.351  -6.106
  404    HG   LEU  54           HG       LEU  54  -6.434   1.019  -4.312
  405   HD11  LEU  54          HD11      LEU  54  -6.656  -1.333  -3.509
  406   HD12  LEU  54          HD12      LEU  54  -5.216  -0.487  -2.922
  407   HD13  LEU  54          HD13      LEU  54  -5.077  -1.664  -4.229
  408   HD21  LEU  54          HD21      LEU  54  -4.744   1.701  -5.748
  409   HD22  LEU  54          HD22      LEU  54  -4.259   0.049  -6.124
  410   HD23  LEU  54          HD23      LEU  54  -3.888   0.740  -4.544
  411    H    ARG  55           HN       ARG  55  -4.366   0.580  -8.140
  412    HA   ARG  55           HA       ARG  55  -4.596  -1.808  -9.847
  413    HB2  ARG  55           HB2      ARG  55  -2.818   0.547 -10.444
  414    HB3  ARG  55           HB1      ARG  55  -3.318  -0.744 -11.528
  415    HG2  ARG  55           HG2      ARG  55  -5.248   1.227 -10.349
  416    HG3  ARG  55           HG1      ARG  55  -4.414   1.491 -11.875
  417    HD2  ARG  55           HD2      ARG  55  -5.402  -0.508 -12.803
  418    HD3  ARG  55           HD1      ARG  55  -6.139  -0.897 -11.253
  419    HE   ARG  55           HE       ARG  55  -6.865   1.551 -12.723
  420   HH11  ARG  55          HH11      ARG  55  -7.767  -1.429 -11.108
  421   HH12  ARG  55          HH12      ARG  55  -9.472  -1.142 -11.269
  422   HH21  ARG  55          HH21      ARG  55  -9.106   1.929 -12.912
  423   HH22  ARG  55          HH22      ARG  55 -10.233   0.763 -12.297
  424    H    GLN  56           HN       GLN  56  -2.981  -3.285  -9.705
  425    HA   GLN  56           HA       GLN  56  -1.241  -3.111  -7.464
  426    HB2  GLN  56           HB2      GLN  56  -0.293  -5.229  -8.994
  427    HB3  GLN  56           HB1      GLN  56  -1.408  -5.311  -7.650
  428    HG2  GLN  56           HG2      GLN  56  -3.270  -5.407  -9.014
  429    HG3  GLN  56           HG1      GLN  56  -2.370  -4.825 -10.390
  430   HE21  GLN  56          HE21      GLN  56  -0.124  -6.533 -10.128
  431   HE22  GLN  56          HE22      GLN  56  -0.640  -8.137 -10.511
  432    H    GLY  57           HN       GLY  57   0.909  -2.781  -7.336
  433    HA2  GLY  57           HA2      GLY  57   3.090  -2.543  -8.203
  434    HA3  GLY  57           HA1      GLY  57   2.419  -2.310  -9.799
  435    H    ASP  58           HN       ASP  58   0.677  -0.428  -7.642
  436    HA   ASP  58           HA       ASP  58   2.093   1.966  -8.513
  437    HB2  ASP  58           HB2      ASP  58  -0.411   1.651  -6.846
  438    HB3  ASP  58           HB1      ASP  58   0.268   3.193  -7.335
  439    H    LEU  59           HN       LEU  59   1.458   3.577  -6.261
  440    HA   LEU  59           HA       LEU  59   2.995   2.361  -4.133
  441    HB2  LEU  59           HB2      LEU  59   3.683   4.768  -5.704
  442    HB3  LEU  59           HB1      LEU  59   3.836   4.935  -3.967
  443    HG   LEU  59           HG       LEU  59   5.225   2.873  -5.663
  444   HD11  LEU  59          HD11      LEU  59   6.097   5.124  -6.009
  445   HD12  LEU  59          HD12      LEU  59   7.253   4.131  -5.120
  446   HD13  LEU  59          HD13      LEU  59   6.281   5.328  -4.267
  447   HD21  LEU  59          HD21      LEU  59   4.846   1.930  -3.506
  448   HD22  LEU  59          HD22      LEU  59   5.304   3.432  -2.704
  449   HD23  LEU  59          HD23      LEU  59   6.522   2.474  -3.548
  450    H    ILE  60           HN       ILE  60   1.666   2.371  -2.452
  451    HA   ILE  60           HA       ILE  60  -0.432   4.322  -2.271
  452    HB   ILE  60           HB       ILE  60   0.432   2.168  -0.322
  453   HG12  ILE  60          HG12      ILE  60  -2.085   2.239  -1.989
  454   HG13  ILE  60          HG11      ILE  60  -0.588   1.529  -2.586
  455   HG21  ILE  60          HG21      ILE  60  -1.794   2.591   0.746
  456   HG22  ILE  60          HG22      ILE  60  -1.904   4.064  -0.222
  457   HG23  ILE  60          HG23      ILE  60  -0.608   3.879   0.958
  458   HD11  ILE  60          HD11      ILE  60  -2.222   0.653  -0.225
  459   HD12  ILE  60          HD12      ILE  60  -0.609   0.037  -0.583
  460   HD13  ILE  60          HD13      ILE  60  -1.927  -0.224  -1.727
  461    H    THR  61           HN       THR  61   0.090   6.331  -1.687
  462    HA   THR  61           HA       THR  61   2.364   6.786   0.053
  463    HB   THR  61           HB       THR  61   2.333   8.209  -1.838
  464    HG1  THR  61           HG1      THR  61   1.291   9.926   0.161
  465   HG21  THR  61          HG21      THR  61  -0.452   9.079  -1.065
  466   HG22  THR  61          HG22      THR  61  -0.051   8.003  -2.404
  467   HG23  THR  61          HG23      THR  61   0.490   9.682  -2.429
  468    H    HIS  62           HN       HIS  62  -1.151   7.077   0.164
  469    HA   HIS  62           HA       HIS  62  -0.925   7.493   3.049
  470    HB2  HIS  62           HB2      HIS  62  -2.697   9.234   1.323
  471    HB3  HIS  62           HB1      HIS  62  -2.673   9.222   3.073
  472    HD2  HIS  62           HD2      HIS  62  -0.571  10.565   4.273
  473    HE1  HIS  62           HE1      HIS  62   0.871  12.249   0.671
  474    HE2  HIS  62           HE2      HIS  62   0.894  12.413   3.196
  475    H    VAL  63           HN       VAL  63  -2.733   6.863   4.231
  476    HA   VAL  63           HA       VAL  63  -4.823   5.399   2.754
  477    HB   VAL  63           HB       VAL  63  -3.377   4.492   5.252
  478   HG11  VAL  63          HG11      VAL  63  -5.708   3.133   3.912
  479   HG12  VAL  63          HG12      VAL  63  -5.851   4.151   5.344
  480   HG13  VAL  63          HG13      VAL  63  -4.906   2.665   5.412
  481   HG21  VAL  63          HG21      VAL  63  -2.207   3.977   3.164
  482   HG22  VAL  63          HG22      VAL  63  -3.656   3.183   2.547
  483   HG23  VAL  63          HG23      VAL  63  -2.809   2.512   3.941
  484    H    ASN  64           HN       ASN  64  -6.707   6.343   3.173
  485    HA   ASN  64           HA       ASN  64  -8.410   7.427   4.217
  486    HB2  ASN  64           HB2      ASN  64  -7.019   6.443   6.722
  487    HB3  ASN  64           HB1      ASN  64  -8.595   7.227   6.712
  488   HD21  ASN  64          HD21      ASN  64  -7.642   4.511   7.460
  489   HD22  ASN  64          HD22      ASN  64  -8.660   3.430   6.582
  490    H    GLY  65           HN       GLY  65  -5.750   8.663   3.655
  491    HA2  GLY  65           HA2      GLY  65  -5.119  10.895   3.629
  492    HA3  GLY  65           HA1      GLY  65  -6.319  11.225   4.869
  493    H    GLU  66           HN       GLU  66  -4.154   8.609   5.431
  494    HA   GLU  66           HA       GLU  66  -2.706  10.258   7.397
  495    HB2  GLU  66           HB2      GLU  66  -2.988   7.270   7.475
  496    HB3  GLU  66           HB1      GLU  66  -2.531   8.347   8.786
  497    HG2  GLU  66           HG2      GLU  66  -5.229   8.605   7.569
  498    HG3  GLU  66           HG1      GLU  66  -4.909   7.262   8.659
  499    HA   PRO  67           HA       PRO  67   0.936   9.349   4.960
  500    HB2  PRO  67           HB2      PRO  67   2.475  10.058   7.356
  501    HB3  PRO  67           HB1      PRO  67   2.440  10.845   5.777
  502    HG2  PRO  67           HG2      PRO  67   1.348  11.976   7.967
  503    HG3  PRO  67           HG1      PRO  67   0.674  12.206   6.349
  504    HD2  PRO  67           HD2      PRO  67  -0.251  10.417   8.540
  505    HD3  PRO  67           HD1      PRO  67  -1.205  11.396   7.412
  506    H    VAL  68           HN       VAL  68   1.360   7.262   4.670
  507    HA   VAL  68           HA       VAL  68   1.848   5.553   6.994
  508    HB   VAL  68           HB       VAL  68   1.579   3.671   5.480
  509   HG11  VAL  68          HG11      VAL  68  -0.792   3.958   4.979
  510   HG12  VAL  68          HG12      VAL  68  -0.631   5.699   5.204
  511   HG13  VAL  68          HG13      VAL  68  -0.390   4.610   6.568
  512   HG21  VAL  68          HG21      VAL  68   0.896   3.992   3.154
  513   HG22  VAL  68          HG22      VAL  68   2.501   4.665   3.445
  514   HG23  VAL  68          HG23      VAL  68   1.103   5.734   3.330
  515    H    HIS  69           HN       HIS  69   3.645   7.325   4.842
  516    HA   HIS  69           HA       HIS  69   5.750   5.447   4.347
  517    HB2  HIS  69           HB2      HIS  69   5.248   7.490   2.930
  518    HB3  HIS  69           HB1      HIS  69   5.940   8.461   4.220
  519    HD2  HIS  69           HD2      HIS  69   8.732   7.420   4.811
  520    HE1  HIS  69           HE1      HIS  69   9.275   6.816   0.659
  521    HE2  HIS  69           HE2      HIS  69  10.440   7.191   2.880
  522    H    GLY  70           HN       GLY  70   6.588   4.600   6.157
  523    HA2  GLY  70           HA2      GLY  70   8.621   5.323   7.551
  524    HA3  GLY  70           HA1      GLY  70   7.469   6.434   8.278
  525    H    LEU  71           HN       LEU  71   5.267   4.446   8.060
  526    HA   LEU  71           HA       LEU  71   5.751   3.147  10.578
  527    HB2  LEU  71           HB2      LEU  71   3.444   2.420   8.838
  528    HB3  LEU  71           HB1      LEU  71   3.522   2.548  10.584
  529    HG   LEU  71           HG       LEU  71   3.559   4.889   8.731
  530   HD11  LEU  71          HD11      LEU  71   1.478   4.216   8.286
  531   HD12  LEU  71          HD12      LEU  71   1.133   4.974   9.843
  532   HD13  LEU  71          HD13      LEU  71   1.378   3.226   9.740
  533   HD21  LEU  71          HD21      LEU  71   2.926   6.147  10.747
  534   HD22  LEU  71          HD22      LEU  71   4.487   5.352  10.942
  535   HD23  LEU  71          HD23      LEU  71   3.048   4.664  11.693
  536    H    VAL  72           HN       VAL  72   4.885   0.833  10.734
  537    HA   VAL  72           HA       VAL  72   6.542  -0.854   9.081
  538    HB   VAL  72           HB       VAL  72   5.574  -2.703  10.467
  539   HG11  VAL  72          HG11      VAL  72   6.805  -2.192  12.435
  540   HG12  VAL  72          HG12      VAL  72   6.631  -0.459  12.170
  541   HG13  VAL  72          HG13      VAL  72   7.638  -1.420  11.088
  542   HG21  VAL  72          HG21      VAL  72   3.706  -0.603  11.149
  543   HG22  VAL  72          HG22      VAL  72   4.453  -1.291  12.601
  544   HG23  VAL  72          HG23      VAL  72   3.617  -2.344  11.460
  545    H    HIS  73           HN       HIS  73   5.456  -2.941   8.262
  546    HA   HIS  73           HA       HIS  73   3.585  -2.282   6.288
  547    HB2  HIS  73           HB2      HIS  73   5.120  -4.203   6.153
  548    HB3  HIS  73           HB1      HIS  73   4.229  -5.000   7.441
  549    HD1  HIS  73           HD1      HIS  73   3.205  -3.486   4.058
  550    HD2  HIS  73           HD2      HIS  73   2.623  -6.845   6.439
  551    HE1  HIS  73           HE1      HIS  73   1.678  -5.029   2.760
  552    H    THR  74           HN       THR  74   3.168  -3.727   9.475
  553    HA   THR  74           HA       THR  74   0.400  -4.283   9.135
  554    HB   THR  74           HB       THR  74   0.491  -4.476  11.697
  555    HG1  THR  74           HG1      THR  74   2.318  -3.923  12.604
  556   HG21  THR  74          HG21      THR  74   2.298  -6.172   9.970
  557   HG22  THR  74          HG22      THR  74   0.558  -6.383  10.162
  558   HG23  THR  74          HG23      THR  74   1.634  -6.644  11.533
  559    H    GLU  75           HN       GLU  75   2.126  -1.427  10.371
  560    HA   GLU  75           HA       GLU  75  -0.019  -0.251  11.704
  561    HB2  GLU  75           HB2      GLU  75   2.391   0.956  10.335
  562    HB3  GLU  75           HB1      GLU  75   1.129   1.925  11.005
  563    HG2  GLU  75           HG2      GLU  75   2.343  -0.154  12.709
  564    HG3  GLU  75           HG1      GLU  75   3.163   1.392  12.467
  565    H    VAL  76           HN       VAL  76   0.994  -0.067   8.352
  566    HA   VAL  76           HA       VAL  76  -1.128   1.677   7.579
  567    HB   VAL  76           HB       VAL  76  -0.332   1.537   5.395
  568   HG11  VAL  76          HG11      VAL  76   1.305   2.459   6.991
  569   HG12  VAL  76          HG12      VAL  76   2.071   1.748   5.570
  570   HG13  VAL  76          HG13      VAL  76   2.064   0.873   7.100
  571   HG21  VAL  76          HG21      VAL  76   0.981  -0.264   4.465
  572   HG22  VAL  76          HG22      VAL  76  -0.504  -0.918   5.158
  573   HG23  VAL  76          HG23      VAL  76   1.023  -1.085   6.025
  574    H    VAL  77           HN       VAL  77  -0.682  -1.804   7.680
  575    HA   VAL  77           HA       VAL  77  -2.941  -2.583   6.196
  576    HB   VAL  77           HB       VAL  77  -1.312  -3.908   8.344
  577   HG11  VAL  77          HG11      VAL  77  -3.637  -5.235   6.966
  578   HG12  VAL  77          HG12      VAL  77  -3.672  -4.638   8.626
  579   HG13  VAL  77          HG13      VAL  77  -2.563  -5.934   8.178
  580   HG21  VAL  77          HG21      VAL  77  -0.704  -5.424   6.531
  581   HG22  VAL  77          HG22      VAL  77  -0.376  -3.745   6.097
  582   HG23  VAL  77          HG23      VAL  77  -1.793  -4.565   5.441
  583    H    GLU  78           HN       GLU  78  -2.471  -2.094   9.668
  584    HA   GLU  78           HA       GLU  78  -5.077  -2.557  10.530
  585    HB2  GLU  78           HB2      GLU  78  -3.130  -0.579  11.601
  586    HB3  GLU  78           HB1      GLU  78  -4.507  -1.207  12.469
  587    HG2  GLU  78           HG2      GLU  78  -3.539  -3.425  12.304
  588    HG3  GLU  78           HG1      GLU  78  -2.120  -2.754  11.538
  589    H    LEU  79           HN       LEU  79  -3.456   0.396   9.728
  590    HA   LEU  79           HA       LEU  79  -5.378   2.305   9.964
  591    HB2  LEU  79           HB2      LEU  79  -2.942   2.095   8.624
  592    HB3  LEU  79           HB1      LEU  79  -4.078   2.586   7.386
  593    HG   LEU  79           HG       LEU  79  -4.767   4.459   8.967
  594   HD11  LEU  79          HD11      LEU  79  -2.140   3.735  10.258
  595   HD12  LEU  79          HD12      LEU  79  -3.727   3.483  10.985
  596   HD13  LEU  79          HD13      LEU  79  -3.161   5.119  10.647
  597   HD21  LEU  79          HD21      LEU  79  -2.318   4.153   7.372
  598   HD22  LEU  79          HD22      LEU  79  -2.368   5.551   8.448
  599   HD23  LEU  79          HD23      LEU  79  -3.630   5.328   7.234
  600    H    ILE  80           HN       ILE  80  -4.854   0.426   6.951
  601    HA   ILE  80           HA       ILE  80  -7.098   1.184   5.551
  602    HB   ILE  80           HB       ILE  80  -5.729  -1.499   5.679
  603   HG12  ILE  80          HG12      ILE  80  -5.345   0.533   3.542
  604   HG13  ILE  80          HG11      ILE  80  -4.545   0.761   5.079
  605   HG21  ILE  80          HG21      ILE  80  -7.875  -1.787   4.682
  606   HG22  ILE  80          HG22      ILE  80  -6.655  -1.837   3.406
  607   HG23  ILE  80          HG23      ILE  80  -7.634  -0.386   3.636
  608   HD11  ILE  80          HD11      ILE  80  -4.308  -1.786   3.540
  609   HD12  ILE  80          HD12      ILE  80  -3.323  -1.186   4.878
  610   HD13  ILE  80          HD13      ILE  80  -3.224  -0.413   3.296
  611    H    LEU  81           HN       LEU  81  -6.732  -1.677   7.623
  612    HA   LEU  81           HA       LEU  81  -9.306  -2.657   7.534
  613    HB2  LEU  81           HB2      LEU  81  -7.295  -2.660   9.774
  614    HB3  LEU  81           HB1      LEU  81  -8.790  -3.565   9.848
  615    HG   LEU  81           HG       LEU  81  -6.686  -3.959   7.723
  616   HD11  LEU  81          HD11      LEU  81  -7.211  -5.540  10.233
  617   HD12  LEU  81          HD12      LEU  81  -5.788  -4.554   9.898
  618   HD13  LEU  81          HD13      LEU  81  -6.104  -6.002   8.942
  619   HD21  LEU  81          HD21      LEU  81  -9.115  -5.576   8.490
  620   HD22  LEU  81          HD22      LEU  81  -7.904  -6.056   7.301
  621   HD23  LEU  81          HD23      LEU  81  -8.909  -4.637   7.012
  622    H    LYS  82           HN       LYS  82  -8.048  -0.149   9.725
  623    HA   LYS  82           HA       LYS  82 -10.437   0.099  11.207
  624    HB2  LYS  82           HB2      LYS  82  -8.120   1.992  10.991
  625    HB3  LYS  82           HB1      LYS  82  -9.367   2.020  12.239
  626    HG2  LYS  82           HG2      LYS  82  -8.714  -0.317  12.794
  627    HG3  LYS  82           HG1      LYS  82  -7.360  -0.126  11.709
  628    HD2  LYS  82           HD2      LYS  82  -7.797   1.882  13.873
  629    HD3  LYS  82           HD1      LYS  82  -7.066   0.327  14.269
  630    HE2  LYS  82           HE2      LYS  82  -5.449   0.819  12.334
  631    HE3  LYS  82           HE1      LYS  82  -6.031   2.477  12.445
  632    HZ1  LYS  82           HZ1      LYS  82  -5.297   2.584  14.712
  633    HZ2  LYS  82           HZ2      LYS  82  -4.004   2.075  13.747
  634    HZ3  LYS  82           HZ3      LYS  82  -4.843   0.956  14.694
  635    H    SER  83           HN       SER  83  -9.821   1.201   8.092
  636    HA   SER  83           HA       SER  83 -10.803   3.731   7.884
  637    HB2  SER  83           HB2      SER  83 -11.686   3.043   5.637
  638    HB3  SER  83           HB1      SER  83 -10.018   2.567   5.938
  639    HG   SER  83           HG       SER  83 -10.586   0.508   6.008
  640    H    GLY  84           HN       GLY  84 -12.927   0.904   7.372
  641    HA2  GLY  84           HA2      GLY  84 -14.991   0.616   8.583
  642    HA3  GLY  84           HA1      GLY  84 -15.051   2.358   8.805
  643    H    ASN  85           HN       ASN  85 -15.872  -0.288   6.809
  644    HA   ASN  85           HA       ASN  85 -17.354  -0.538   5.133
  645    HB2  ASN  85           HB2      ASN  85 -19.072   0.803   5.685
  646    HB3  ASN  85           HB1      ASN  85 -18.016   2.132   6.137
  647   HD21  ASN  85          HD21      ASN  85 -19.790   0.633   3.546
  648   HD22  ASN  85          HD22      ASN  85 -19.766   1.992   2.478
  649    H    LYS  86           HN       LYS  86 -15.249   2.289   4.721
  650    HA   LYS  86           HA       LYS  86 -14.335   1.192   2.247
  651    HB2  LYS  86           HB2      LYS  86 -14.650   3.209   0.962
  652    HB3  LYS  86           HB1      LYS  86 -16.175   2.561   1.491
  653    HG2  LYS  86           HG2      LYS  86 -15.930   4.219   3.453
  654    HG3  LYS  86           HG1      LYS  86 -14.762   4.990   2.385
  655    HD2  LYS  86           HD2      LYS  86 -16.601   4.892   0.613
  656    HD3  LYS  86           HD1      LYS  86 -17.682   4.542   1.961
  657    HE2  LYS  86           HE2      LYS  86 -17.113   6.628   3.021
  658    HE3  LYS  86           HE1      LYS  86 -15.900   6.966   1.788
  659    HZ1  LYS  86           HZ1      LYS  86 -18.323   7.962   1.680
  660    HZ2  LYS  86           HZ2      LYS  86 -18.635   6.503   0.882
  661    HZ3  LYS  86           HZ3      LYS  86 -17.458   7.560   0.280
  662    H    VAL  87           HN       VAL  87 -12.486   2.188   1.506
  663    HA   VAL  87           HA       VAL  87 -11.087   3.826   3.508
  664    HB   VAL  87           HB       VAL  87 -10.398   1.567   3.909
  665   HG11  VAL  87          HG11      VAL  87  -9.615   1.396   1.004
  666   HG12  VAL  87          HG12      VAL  87 -11.051   0.656   1.721
  667   HG13  VAL  87          HG13      VAL  87  -9.440   0.130   2.221
  668   HG21  VAL  87          HG21      VAL  87  -7.951   1.718   3.377
  669   HG22  VAL  87          HG22      VAL  87  -8.622   3.152   4.153
  670   HG23  VAL  87          HG23      VAL  87  -8.310   3.153   2.418
  671    H    ALA  88           HN       ALA  88  -9.941   5.463   2.712
  672    HA   ALA  88           HA       ALA  88  -9.847   5.777  -0.193
  673    HB1  ALA  88           HB1      ALA  88 -10.756   7.641   1.090
  674    HB2  ALA  88           HB2      ALA  88  -9.277   8.103   0.244
  675    HB3  ALA  88           HB3      ALA  88  -9.241   7.775   1.982
  676    H    ILE  89           HN       ILE  89  -8.138   4.987  -1.121
  677    HA   ILE  89           HA       ILE  89  -5.577   5.047   0.321
  678    HB   ILE  89           HB       ILE  89  -6.265   3.323  -2.054
  679   HG12  ILE  89          HG12      ILE  89  -6.801   2.965   0.844
  680   HG13  ILE  89          HG11      ILE  89  -7.651   2.339  -0.552
  681   HG21  ILE  89          HG21      ILE  89  -3.941   3.568  -1.876
  682   HG22  ILE  89          HG22      ILE  89  -4.326   2.010  -1.143
  683   HG23  ILE  89          HG23      ILE  89  -3.983   3.405  -0.122
  684   HD11  ILE  89          HD11      ILE  89  -6.709   0.530   0.707
  685   HD12  ILE  89          HD12      ILE  89  -5.105   1.255   0.604
  686   HD13  ILE  89          HD13      ILE  89  -5.894   0.652  -0.853
  687    H    SER  90           HN       SER  90  -4.349   6.695  -0.262
  688    HA   SER  90           HA       SER  90  -4.612   7.993  -2.812
  689    HB2  SER  90           HB2      SER  90  -2.394   8.435  -0.818
  690    HB3  SER  90           HB1      SER  90  -3.097   9.588  -1.951
  691    HG   SER  90           HG       SER  90  -4.648   9.997  -0.583
  692    H    THR  91           HN       THR  91  -3.731   7.199  -4.605
  693    HA   THR  91           HA       THR  91  -1.363   5.488  -4.367
  694    HB   THR  91           HB       THR  91  -2.123   5.029  -6.885
  695    HG1  THR  91           HG1      THR  91  -4.677   4.992  -6.162
  696   HG21  THR  91          HG21      THR  91  -1.923   3.295  -5.214
  697   HG22  THR  91          HG22      THR  91  -3.477   3.120  -6.040
  698   HG23  THR  91          HG23      THR  91  -3.405   3.834  -4.425
  699    H    THR  92           HN       THR  92   0.051   5.527  -6.320
  700    HA   THR  92           HA       THR  92   0.294   7.779  -7.985
  701    HB   THR  92           HB       THR  92   0.910   8.957  -5.935
  702    HG1  THR  92           HG1      THR  92   2.333   9.931  -7.122
  703   HG21  THR  92          HG21      THR  92   1.618   7.013  -4.610
  704   HG22  THR  92          HG22      THR  92   2.816   8.311  -4.574
  705   HG23  THR  92          HG23      THR  92   3.084   6.893  -5.589
  706    HA   PRO  93           HA       PRO  93   2.718   4.832 -10.262
  707    HB2  PRO  93           HB2      PRO  93   4.706   7.019 -10.598
  708    HB3  PRO  93           HB1      PRO  93   4.001   5.957 -11.815
  709    HG2  PRO  93           HG2      PRO  93   3.157   8.467 -11.570
  710    HG3  PRO  93           HG1      PRO  93   2.008   7.156 -11.890
  711    HD2  PRO  93           HD2      PRO  93   2.511   8.655  -9.368
  712    HD3  PRO  93           HD1      PRO  93   1.004   7.952  -9.985
  713    H    LEU  94           HN       LEU  94   4.444   3.494 -10.085
  714    HA   LEU  94           HA       LEU  94   6.219   3.932  -7.778
  715    HB2  LEU  94           HB2      LEU  94   4.992   1.935  -7.400
  716    HB3  LEU  94           HB1      LEU  94   5.178   1.414  -9.066
  717    HG   LEU  94           HG       LEU  94   7.691   1.231  -8.537
  718   HD11  LEU  94          HD11      LEU  94   6.627   1.185  -5.722
  719   HD12  LEU  94          HD12      LEU  94   7.625   2.460  -6.421
  720   HD13  LEU  94          HD13      LEU  94   8.278   0.833  -6.231
  721   HD21  LEU  94          HD21      LEU  94   7.421  -1.020  -7.645
  722   HD22  LEU  94          HD22      LEU  94   6.245  -0.688  -8.918
  723   HD23  LEU  94          HD23      LEU  94   5.746  -0.657  -7.227
  724    H    GLU  95           HN       GLU  95   7.422   5.330  -9.236
  725    HA   GLU  95           HA       GLU  95   8.885   3.967 -11.357
  726    HB2  GLU  95           HB2      GLU  95   9.193   6.834 -10.536
  727    HB3  GLU  95           HB1      GLU  95   9.584   6.109 -12.081
  728    HG2  GLU  95           HG2      GLU  95   6.743   6.022 -11.209
  729    HG3  GLU  95           HG1      GLU  95   7.406   7.572 -11.731
  730    H    ASN  96           HN       ASN  96  10.791   3.131 -11.000
  731    HA   ASN  96           HA       ASN  96  12.792   4.318  -9.382
  732    HB2  ASN  96           HB2      ASN  96  11.100   3.083  -7.760
  733    HB3  ASN  96           HB1      ASN  96  11.992   1.653  -8.280
  734   HD21  ASN  96          HD21      ASN  96  14.049   1.332  -7.562
  735   HD22  ASN  96          HD22      ASN  96  14.818   2.344  -6.388
  736    H2   PRO  97           HT1      PRO  97  13.517  -1.351 -11.933
  737    H3   PRO  97           HT2      PRO  97  12.778   0.106 -11.885
  738    HA   PRO  97           HA       PRO  97  10.812  -0.691 -11.668
  739    HB2  PRO  97           HB2      PRO  97  10.793  -3.264 -12.886
  740    HB3  PRO  97           HB1      PRO  97   9.977  -1.796 -13.439
  741    HG2  PRO  97           HG2      PRO  97  12.592  -2.920 -14.256
  742    HG3  PRO  97           HG1      PRO  97  11.457  -1.919 -15.180
  743    HD2  PRO  97           HD2      PRO  97  13.743  -0.893 -14.262
  744    HD3  PRO  97           HD1      PRO  97  12.250   0.063 -14.242
  745    H    PHE  98           HN       PHE  98  10.356  -1.467  -9.717
  746    HA   PHE  98           HA       PHE  98  10.411  -2.680  -7.798
  747    HB2  PHE  98           HB2      PHE  98  10.117  -4.529  -9.665
  748    HB3  PHE  98           HB1      PHE  98  11.749  -4.973  -9.187
  749    HD1  PHE  98           HD2      PHE  98   9.013  -3.728  -7.032
  750    HD2  PHE  98           HD1      PHE  98  11.426  -7.053  -8.147
  751    HE1  PHE  98           HE2      PHE  98   8.103  -5.017  -5.150
  752    HE2  PHE  98           HE1      PHE  98  10.520  -8.342  -6.262
  753    HZ   PHE  98           HZ       PHE  98   8.849  -7.400  -4.815
  754    H    ASP  99           HN       ASP  99  12.293  -4.487  -6.751
  755    HA   ASP  99           HA       ASP  99  14.947  -3.504  -7.159
  756    HB2  ASP  99           HB2      ASP  99  13.743  -1.712  -5.736
  757    HB3  ASP  99           HB1      ASP  99  13.830  -2.893  -4.434
  758    H    GLU 100           HN       GLU 100  13.437  -4.583  -4.125
  759    HA   GLU 100           HA       GLU 100  14.788  -7.165  -4.466
  760    HB2  GLU 100           HB2      GLU 100  15.034  -5.230  -2.202
  761    HB3  GLU 100           HB1      GLU 100  15.112  -6.952  -1.860
  762    HG2  GLU 100           HG2      GLU 100  16.863  -5.584  -3.878
  763    HG3  GLU 100           HG1      GLU 100  17.309  -5.814  -2.191
  764    H    ASP 101           HN       ASP 101  13.847  -8.923  -3.430
  765    HA   ASP 101           HA       ASP 101  11.252  -8.484  -2.129
  766    HB2  ASP 101           HB2      ASP 101  11.027  -9.022  -4.626
  767    HB3  ASP 101           HB1      ASP 101  11.618 -10.626  -4.222
  768    H    GLN 102           HN       GLN 102  13.998  -9.253  -1.286
  769    HA   GLN 102           HA       GLN 102  13.747 -12.034  -0.532
  770    HB2  GLN 102           HB2      GLN 102  15.865 -11.149   0.936
  771    HB3  GLN 102           HB1      GLN 102  15.976 -11.794  -0.691
  772    HG2  GLN 102           HG2      GLN 102  17.223  -9.867  -0.816
  773    HG3  GLN 102           HG1      GLN 102  15.662  -9.345  -1.441
  774   HE21  GLN 102          HE21      GLN 102  17.840  -9.246   1.278
  775   HE22  GLN 102          HE22      GLN 102  17.127  -7.875   2.056
  776    H    HIS 103           HN       HIS 103  13.865  -8.915   1.169
  777    HA   HIS 103           HA       HIS 103  12.511 -10.223   3.430
  778    HB2  HIS 103           HB2      HIS 103  14.724  -9.260   4.012
  779    HB3  HIS 103           HB1      HIS 103  14.163  -7.679   3.477
  780    HD2  HIS 103           HD2      HIS 103  12.283 -10.173   5.883
  781    HE1  HIS 103           HE1      HIS 103  12.846  -6.455   7.810
  782    HE2  HIS 103           HE2      HIS 103  12.027  -8.831   8.086
  783    H    THR 104           HN       THR 104  10.560  -9.995   2.236
  784    HA   THR 104           HA       THR 104   9.445  -7.282   2.397
  785    HB   THR 104           HB       THR 104   7.970  -8.118   0.415
  786    HG1  THR 104           HG1      THR 104   9.402  -9.523  -0.953
  787   HG21  THR 104          HG21      THR 104  10.880  -7.495  -0.088
  788   HG22  THR 104          HG22      THR 104   9.651  -6.293   0.301
  789   HG23  THR 104          HG23      THR 104   9.535  -7.223  -1.194
  790    H    GLN 105           HN       GLN 105   6.921  -7.469   2.312
  791    HA   GLN 105           HA       GLN 105   6.067  -9.851   3.807
  792    HB2  GLN 105           HB2      GLN 105   6.458  -7.436   5.029
  793    HB3  GLN 105           HB1      GLN 105   4.754  -7.343   4.599
  794    HG2  GLN 105           HG2      GLN 105   4.249  -9.300   5.842
  795    HG3  GLN 105           HG1      GLN 105   5.957  -9.661   6.084
  796   HE21  GLN 105          HE21      GLN 105   3.830  -9.299   8.031
  797   HE22  GLN 105          HE22      GLN 105   4.352  -8.025   9.077
  798    H    ILE 106           HN       ILE 106   3.649 -10.076   3.840
  799    HA   ILE 106           HA       ILE 106   2.284  -8.713   1.657
  800    HB   ILE 106           HB       ILE 106   3.099 -10.492   0.385
  801   HG12  ILE 106          HG12      ILE 106   0.396 -11.393   1.410
  802   HG13  ILE 106          HG11      ILE 106   0.678 -10.236   0.112
  803   HG21  ILE 106          HG21      ILE 106   2.392 -12.404   2.596
  804   HG22  ILE 106          HG22      ILE 106   4.008 -11.786   2.257
  805   HG23  ILE 106          HG23      ILE 106   3.184 -12.800   1.072
  806   HD11  ILE 106          HD11      ILE 106   1.684 -11.982  -1.242
  807   HD12  ILE 106          HD12      ILE 106   0.059 -12.436  -0.735
  808   HD13  ILE 106          HD13      ILE 106   1.462 -13.144   0.066
  809    H    THR 107           HN       THR 107   0.257  -8.274   2.181
  810    HA   THR 107           HA       THR 107  -1.110  -9.961   4.153
  811    HB   THR 107           HB       THR 107  -1.020  -6.936   4.224
  812    HG1  THR 107           HG1      THR 107   0.768  -7.545   5.260
  813   HG21  THR 107          HG21      THR 107  -2.510  -8.905   5.972
  814   HG22  THR 107          HG22      THR 107  -3.228  -7.731   4.870
  815   HG23  THR 107          HG23      THR 107  -2.353  -7.180   6.299
  816    H    LYS 108           HN       LYS 108  -3.040 -10.532   3.582
  817    HA   LYS 108           HA       LYS 108  -4.210  -9.497   1.148
  818    HB2  LYS 108           HB2      LYS 108  -5.362 -11.591   3.000
  819    HB3  LYS 108           HB1      LYS 108  -5.680 -11.377   1.285
  820    HG2  LYS 108           HG2      LYS 108  -3.628 -12.278   0.662
  821    HG3  LYS 108           HG1      LYS 108  -2.933 -12.040   2.265
  822    HD2  LYS 108           HD2      LYS 108  -4.664 -13.717   3.087
  823    HD3  LYS 108           HD1      LYS 108  -4.939 -14.099   1.387
  824    HE2  LYS 108           HE2      LYS 108  -2.668 -14.782   1.101
  825    HE3  LYS 108           HE1      LYS 108  -2.235 -14.203   2.707
  826    HZ1  LYS 108           HZ1      LYS 108  -3.972 -16.510   2.037
  827    HZ2  LYS 108           HZ2      LYS 108  -3.821 -15.886   3.597
  828    HZ3  LYS 108           HZ3      LYS 108  -2.473 -16.544   2.816
  829    H    VAL 109           HN       VAL 109  -5.223  -7.568   1.399
  830    HA   VAL 109           HA       VAL 109  -7.293  -7.354   3.406
  831    HB   VAL 109           HB       VAL 109  -5.284  -6.424   4.447
  832   HG11  VAL 109          HG11      VAL 109  -4.054  -5.846   2.424
  833   HG12  VAL 109          HG12      VAL 109  -4.119  -4.495   3.558
  834   HG13  VAL 109          HG13      VAL 109  -5.160  -4.503   2.134
  835   HG21  VAL 109          HG21      VAL 109  -6.121  -4.281   5.111
  836   HG22  VAL 109          HG22      VAL 109  -7.474  -5.395   4.916
  837   HG23  VAL 109          HG23      VAL 109  -7.140  -4.187   3.676
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1   3.794  20.161  -2.051
    2    H2   GLY   1           HT2      GLY   1   3.295  21.502  -2.950
    3    H3   GLY   1           HT3      GLY   1   3.289  19.965  -3.651
    4    HA2  GLY   1           HA1      GLY   1   1.588  20.820  -1.379
    5    HA3  GLY   1           HA2      GLY   1   1.052  20.682  -3.046
    6    H    GLY   2           HN       GLY   2   0.847  19.193  -0.207
    7    HA2  GLY   2           HA2      GLY   2   1.392  16.478  -1.002
    8    HA3  GLY   2           HA1      GLY   2   0.644  16.999   0.500
    9    H    SER   3           HN       SER   3  -1.528  18.415  -0.445
   10    HA   SER   3           HA       SER   3  -3.283  16.271  -1.143
   11    HB2  SER   3           HB2      SER   3  -3.929  19.222  -1.019
   12    HB3  SER   3           HB1      SER   3  -5.055  17.872  -0.868
   13    HG   SER   3           HG       SER   3  -3.309  17.392   0.953
   14    H    MET   4           HN       MET   4  -3.587  15.539  -3.111
   15    HA   MET   4           HA       MET   4  -4.181  17.253  -5.310
   16    HB2  MET   4           HB2      MET   4  -1.738  17.480  -5.335
   17    HB3  MET   4           HB1      MET   4  -1.568  15.731  -5.385
   18    HG2  MET   4           HG2      MET   4  -1.216  16.730  -7.570
   19    HG3  MET   4           HG1      MET   4  -2.617  15.664  -7.567
   20    HE1  MET   4           HE1      MET   4  -2.137  17.768  -9.945
   21    HE2  MET   4           HE2      MET   4  -3.812  18.287 -10.125
   22    HE3  MET   4           HE3      MET   4  -3.446  16.595  -9.793
   23    H    ARG   5           HN       ARG   5  -2.808  14.029  -4.689
   24    HA   ARG   5           HA       ARG   5  -4.456  12.792  -6.675
   25    HB2  ARG   5           HB2      ARG   5  -2.489  11.807  -4.653
   26    HB3  ARG   5           HB1      ARG   5  -3.561  10.660  -5.437
   27    HG2  ARG   5           HG2      ARG   5  -1.514  10.668  -6.640
   28    HG3  ARG   5           HG1      ARG   5  -2.713  11.495  -7.635
   29    HD2  ARG   5           HD2      ARG   5  -1.794  13.602  -7.190
   30    HD3  ARG   5           HD1      ARG   5  -0.881  13.007  -5.806
   31    HE   ARG   5           HE       ARG   5  -0.241  12.153  -8.547
   32   HH11  ARG   5          HH11      ARG   5   0.712  13.557  -5.487
   33   HH12  ARG   5          HH12      ARG   5   2.397  13.614  -5.892
   34   HH21  ARG   5          HH21      ARG   5   1.971  12.210  -9.080
   35   HH22  ARG   5          HH22      ARG   5   3.118  12.822  -7.929
   36    HA   PRO   6           HA       PRO   6  -7.994  12.453  -3.975
   37    HB2  PRO   6           HB2      PRO   6  -9.565  11.088  -5.710
   38    HB3  PRO   6           HB1      PRO   6  -9.259  12.816  -5.861
   39    HG2  PRO   6           HG2      PRO   6  -7.963  10.524  -7.269
   40    HG3  PRO   6           HG1      PRO   6  -8.582  12.046  -7.917
   41    HD2  PRO   6           HD2      PRO   6  -5.964  11.674  -7.437
   42    HD3  PRO   6           HD1      PRO   6  -6.736  13.256  -7.220
   43    HA   PRO   7           HA       PRO   7  -7.094   8.407  -2.336
   44    HB2  PRO   7           HB2      PRO   7  -9.422   8.775  -0.611
   45    HB3  PRO   7           HB1      PRO   7  -7.717   8.633  -0.176
   46    HG2  PRO   7           HG2      PRO   7  -9.094  10.946   0.043
   47    HG3  PRO   7           HG1      PRO   7  -7.360  10.895  -0.319
   48    HD2  PRO   7           HD2      PRO   7  -9.667  11.355  -2.165
   49    HD3  PRO   7           HD1      PRO   7  -8.065  12.121  -2.146
   50    H    ILE   8           HN       ILE   8  -7.856   6.378  -2.484
   51    HA   ILE   8           HA       ILE   8 -10.174   5.926  -4.162
   52    HB   ILE   8           HB       ILE   8  -8.137   3.995  -3.057
   53   HG12  ILE   8          HG12      ILE   8  -7.309   5.838  -4.634
   54   HG13  ILE   8          HG11      ILE   8  -6.926   4.177  -5.059
   55   HG21  ILE   8          HG21      ILE   8 -10.284   3.673  -5.128
   56   HG22  ILE   8          HG22      ILE   8 -10.075   2.778  -3.622
   57   HG23  ILE   8          HG23      ILE   8  -8.933   2.553  -4.947
   58   HD11  ILE   8          HD11      ILE   8  -9.063   5.911  -6.268
   59   HD12  ILE   8          HD12      ILE   8  -8.848   4.194  -6.626
   60   HD13  ILE   8          HD13      ILE   8  -7.575   5.347  -7.032
   61    H    ILE   9           HN       ILE   9 -11.916   6.329  -2.729
   62    HA   ILE   9           HA       ILE   9 -12.077   5.212  -0.134
   63    HB   ILE   9           HB       ILE   9 -14.141   6.415  -1.964
   64   HG12  ILE   9          HG12      ILE   9 -14.131   8.251  -0.550
   65   HG13  ILE   9          HG11      ILE   9 -13.350   7.388   0.752
   66   HG21  ILE   9          HG21      ILE   9 -15.512   4.957  -0.819
   67   HG22  ILE   9          HG22      ILE   9 -15.560   6.399   0.200
   68   HG23  ILE   9          HG23      ILE   9 -14.534   5.034   0.647
   69   HD11  ILE   9          HD11      ILE   9 -12.122   8.430  -1.775
   70   HD12  ILE   9          HD12      ILE   9 -11.282   7.366  -0.650
   71   HD13  ILE   9          HD13      ILE   9 -11.813   8.964  -0.123
   72    H    ILE  10           HN       ILE  10 -11.784   3.062  -0.084
   73    HA   ILE  10           HA       ILE  10 -13.417   1.290  -1.730
   74    HB   ILE  10           HB       ILE  10 -11.272   0.599   0.275
   75   HG12  ILE  10          HG12      ILE  10 -10.982   0.700  -2.712
   76   HG13  ILE  10          HG11      ILE  10 -10.609   2.079  -1.694
   77   HG21  ILE  10          HG21      ILE  10 -12.677  -1.288  -0.167
   78   HG22  ILE  10          HG22      ILE  10 -11.174  -1.512  -1.066
   79   HG23  ILE  10          HG23      ILE  10 -12.628  -0.975  -1.904
   80   HD11  ILE  10          HD11      ILE  10  -8.903   0.786  -0.549
   81   HD12  ILE  10          HD12      ILE  10  -8.617   0.812  -2.291
   82   HD13  ILE  10          HD13      ILE  10  -9.302  -0.624  -1.531
   83    H    HIS  11           HN       HIS  11 -15.082   0.198  -0.995
   84    HA   HIS  11           HA       HIS  11 -16.001   0.650   1.718
   85    HB2  HIS  11           HB2      HIS  11 -17.179  -0.698  -0.711
   86    HB3  HIS  11           HB1      HIS  11 -17.986  -0.701   0.853
   87    HD2  HIS  11           HD2      HIS  11 -16.645   2.644   0.845
   88    HE1  HIS  11           HE1      HIS  11 -20.158   2.976  -1.473
   89    HE2  HIS  11           HE2      HIS  11 -18.493   4.231  -0.040
   90    H    ARG  12           HN       ARG  12 -16.516  -1.044   3.182
   91    HA   ARG  12           HA       ARG  12 -14.626  -3.169   3.206
   92    HB2  ARG  12           HB2      ARG  12 -15.716  -3.742   5.341
   93    HB3  ARG  12           HB1      ARG  12 -15.319  -2.040   5.244
   94    HG2  ARG  12           HG2      ARG  12 -17.584  -1.446   4.896
   95    HG3  ARG  12           HG1      ARG  12 -18.050  -3.128   4.636
   96    HD2  ARG  12           HD2      ARG  12 -17.485  -3.665   6.903
   97    HD3  ARG  12           HD1      ARG  12 -16.930  -2.027   7.200
   98    HE   ARG  12           HE       ARG  12 -19.644  -2.072   6.338
   99   HH11  ARG  12          HH11      ARG  12 -17.588  -2.626   9.114
  100   HH12  ARG  12          HH12      ARG  12 -18.831  -2.289  10.272
  101   HH21  ARG  12          HH21      ARG  12 -21.290  -1.617   7.856
  102   HH22  ARG  12          HH22      ARG  12 -20.945  -1.710   9.555
  103    H    ALA  13           HN       ALA  13 -14.886  -5.294   2.747
  104    HA   ALA  13           HA       ALA  13 -17.572  -6.206   1.949
  105    HB1  ALA  13           HB1      ALA  13 -16.343  -5.920  -0.073
  106    HB2  ALA  13           HB2      ALA  13 -16.411  -7.651   0.258
  107    HB3  ALA  13           HB3      ALA  13 -14.934  -6.744   0.593
  108    H    GLY  14           HN       GLY  14 -17.818  -7.070   4.055
  109    HA2  GLY  14           HA2      GLY  14 -17.884  -8.901   5.452
  110    HA3  GLY  14           HA1      GLY  14 -16.886  -9.765   4.292
  111    H    LYS  15           HN       LYS  15 -14.629  -9.648   4.452
  112    HA   LYS  15           HA       LYS  15 -13.586  -8.412   6.908
  113    HB2  LYS  15           HB2      LYS  15 -13.580 -11.248   6.140
  114    HB3  LYS  15           HB1      LYS  15 -12.024 -10.629   6.669
  115    HG2  LYS  15           HG2      LYS  15 -13.210  -9.746   8.715
  116    HG3  LYS  15           HG1      LYS  15 -14.598 -10.703   8.199
  117    HD2  LYS  15           HD2      LYS  15 -13.463 -12.721   8.471
  118    HD3  LYS  15           HD1      LYS  15 -11.885 -11.935   8.485
  119    HE2  LYS  15           HE2      LYS  15 -12.327 -12.566  10.719
  120    HE3  LYS  15           HE1      LYS  15 -12.593 -10.827  10.638
  121    HZ1  LYS  15           HZ1      LYS  15 -14.997 -11.315  10.386
  122    HZ2  LYS  15           HZ2      LYS  15 -14.357 -11.799  11.871
  123    HZ3  LYS  15           HZ3      LYS  15 -14.664 -12.948  10.674
  124    H    LYS  16           HN       LYS  16 -13.492  -8.259   3.720
  125    HA   LYS  16           HA       LYS  16 -10.670  -7.469   3.685
  126    HB2  LYS  16           HB2      LYS  16 -11.898  -8.996   1.391
  127    HB3  LYS  16           HB1      LYS  16 -10.213  -8.557   1.613
  128    HG2  LYS  16           HG2      LYS  16 -11.062 -10.146   3.826
  129    HG3  LYS  16           HG1      LYS  16 -11.501 -10.955   2.320
  130    HD2  LYS  16           HD2      LYS  16  -9.311 -11.690   2.874
  131    HD3  LYS  16           HD1      LYS  16  -9.139 -10.544   1.544
  132    HE2  LYS  16           HE2      LYS  16  -7.449 -10.178   3.272
  133    HE3  LYS  16           HE1      LYS  16  -8.523  -8.791   3.108
  134    HZ1  LYS  16           HZ1      LYS  16  -9.660  -9.374   5.083
  135    HZ2  LYS  16           HZ2      LYS  16  -8.009  -9.477   5.439
  136    HZ3  LYS  16           HZ3      LYS  16  -8.900 -10.887   5.168
  137    H    TYR  17           HN       TYR  17 -10.174  -6.147   1.702
  138    HA   TYR  17           HA       TYR  17 -12.502  -4.464   1.059
  139    HB2  TYR  17           HB2      TYR  17  -9.543  -3.849   0.950
  140    HB3  TYR  17           HB1      TYR  17 -10.812  -2.743   0.433
  141    HD1  TYR  17           HD1      TYR  17 -12.388  -1.798   2.104
  142    HD2  TYR  17           HD2      TYR  17  -9.050  -4.168   3.237
  143    HE1  TYR  17           HE1      TYR  17 -12.607  -0.985   4.412
  144    HE2  TYR  17           HE2      TYR  17  -9.249  -3.375   5.542
  145    HH   TYR  17           HH       TYR  17 -10.393  -0.990   6.581
  146    H    GLY  18           HN       GLY  18 -10.613  -6.872  -0.174
  147    HA2  GLY  18           HA2      GLY  18 -11.117  -7.841  -2.276
  148    HA3  GLY  18           HA1      GLY  18 -11.581  -6.258  -2.847
  149    H    PHE  19           HN       PHE  19  -8.618  -6.253  -1.174
  150    HA   PHE  19           HA       PHE  19  -7.168  -6.784  -3.638
  151    HB2  PHE  19           HB2      PHE  19  -5.972  -4.746  -3.726
  152    HB3  PHE  19           HB1      PHE  19  -7.669  -4.354  -3.636
  153    HD1  PHE  19           HD1      PHE  19  -8.607  -3.394  -1.531
  154    HD2  PHE  19           HD2      PHE  19  -4.438  -4.076  -2.065
  155    HE1  PHE  19           HE1      PHE  19  -8.115  -1.854   0.329
  156    HE2  PHE  19           HE2      PHE  19  -3.942  -2.553  -0.202
  157    HZ   PHE  19           HZ       PHE  19  -5.783  -1.435   0.994
  158    H    THR  20           HN       THR  20  -4.877  -6.584  -3.426
  159    HA   THR  20           HA       THR  20  -3.963  -7.825  -0.909
  160    HB   THR  20           HB       THR  20  -2.743  -7.984  -3.662
  161    HG1  THR  20           HG1      THR  20  -3.599 -10.091  -3.684
  162   HG21  THR  20          HG21      THR  20  -1.410  -9.852  -2.672
  163   HG22  THR  20          HG22      THR  20  -2.046  -9.408  -1.088
  164   HG23  THR  20          HG23      THR  20  -1.023  -8.275  -1.979
  165    H    LEU  21           HN       LEU  21  -2.681  -6.602   0.313
  166    HA   LEU  21           HA       LEU  21  -1.309  -4.342  -0.927
  167    HB2  LEU  21           HB2      LEU  21  -2.702  -3.879   1.054
  168    HB3  LEU  21           HB1      LEU  21  -1.746  -5.010   1.988
  169    HG   LEU  21           HG       LEU  21   0.220  -3.567   1.752
  170   HD11  LEU  21          HD11      LEU  21  -0.190  -2.577  -0.390
  171   HD12  LEU  21          HD12      LEU  21  -0.078  -1.293   0.814
  172   HD13  LEU  21          HD13      LEU  21  -1.655  -1.794   0.204
  173   HD21  LEU  21          HD21      LEU  21  -2.258  -2.185   2.759
  174   HD22  LEU  21          HD22      LEU  21  -0.608  -1.671   3.102
  175   HD23  LEU  21          HD23      LEU  21  -1.180  -3.237   3.677
  176    H    ARG  22           HN       ARG  22   0.810  -4.497  -1.341
  177    HA   ARG  22           HA       ARG  22   2.276  -6.637   0.040
  178    HB2  ARG  22           HB2      ARG  22   2.284  -5.850  -2.848
  179    HB3  ARG  22           HB1      ARG  22   3.681  -6.633  -2.136
  180    HG2  ARG  22           HG2      ARG  22   1.679  -8.276  -1.308
  181    HG3  ARG  22           HG1      ARG  22   1.063  -7.715  -2.856
  182    HD2  ARG  22           HD2      ARG  22   2.620  -9.811  -2.736
  183    HD3  ARG  22           HD1      ARG  22   2.757  -8.664  -4.061
  184    HE   ARG  22           HE       ARG  22   4.480  -8.099  -1.817
  185   HH11  ARG  22          HH11      ARG  22   4.166  -9.892  -4.800
  186   HH12  ARG  22          HH12      ARG  22   5.874  -9.944  -5.097
  187   HH21  ARG  22          HH21      ARG  22   6.733  -8.154  -2.213
  188   HH22  ARG  22          HH22      ARG  22   7.334  -8.952  -3.630
  189    H    ALA  23           HN       ALA  23   4.092  -6.167   0.958
  190    HA   ALA  23           HA       ALA  23   5.022  -3.407   0.954
  191    HB1  ALA  23           HB1      ALA  23   4.760  -4.307   3.127
  192    HB2  ALA  23           HB2      ALA  23   6.499  -4.311   2.826
  193    HB3  ALA  23           HB3      ALA  23   5.570  -5.810   2.685
  194    H    ILE  24           HN       ILE  24   6.283  -3.050  -0.801
  195    HA   ILE  24           HA       ILE  24   8.243  -5.076  -1.580
  196    HB   ILE  24           HB       ILE  24   8.699  -3.475  -3.508
  197   HG12  ILE  24          HG12      ILE  24   6.011  -2.306  -2.801
  198   HG13  ILE  24          HG11      ILE  24   7.511  -1.555  -2.268
  199   HG21  ILE  24          HG21      ILE  24   6.750  -4.252  -4.767
  200   HG22  ILE  24          HG22      ILE  24   5.950  -4.689  -3.256
  201   HG23  ILE  24          HG23      ILE  24   7.418  -5.531  -3.753
  202   HD11  ILE  24          HD11      ILE  24   8.205  -1.257  -4.565
  203   HD12  ILE  24          HD12      ILE  24   6.616  -0.537  -4.303
  204   HD13  ILE  24          HD13      ILE  24   6.756  -2.088  -5.131
  205    H    ARG  25           HN       ARG  25  10.366  -4.869  -1.263
  206    HA   ARG  25           HA       ARG  25  11.265  -2.491   0.194
  207    HB2  ARG  25           HB2      ARG  25  11.605  -4.497   1.438
  208    HB3  ARG  25           HB1      ARG  25  12.316  -5.316   0.060
  209    HG2  ARG  25           HG2      ARG  25  14.222  -3.698   0.187
  210    HG3  ARG  25           HG1      ARG  25  13.524  -3.096   1.695
  211    HD2  ARG  25           HD2      ARG  25  13.706  -5.297   2.688
  212    HD3  ARG  25           HD1      ARG  25  14.307  -5.965   1.175
  213    HE   ARG  25           HE       ARG  25  16.311  -4.629   1.493
  214   HH11  ARG  25          HH11      ARG  25  14.209  -4.937   4.280
  215   HH12  ARG  25          HH12      ARG  25  15.493  -4.732   5.428
  216   HH21  ARG  25          HH21      ARG  25  18.006  -4.316   3.024
  217   HH22  ARG  25          HH22      ARG  25  17.634  -4.371   4.720
  218    H    VAL  26           HN       VAL  26  12.409  -1.050  -0.844
  219    HA   VAL  26           HA       VAL  26  14.007  -1.864  -3.187
  220    HB   VAL  26           HB       VAL  26  13.135   0.975  -2.691
  221   HG11  VAL  26          HG11      VAL  26  13.143   0.966  -5.226
  222   HG12  VAL  26          HG12      VAL  26  13.908  -0.619  -5.119
  223   HG13  VAL  26          HG13      VAL  26  14.707   0.796  -4.433
  224   HG21  VAL  26          HG21      VAL  26  11.118   0.643  -4.006
  225   HG22  VAL  26          HG22      VAL  26  11.087  -0.375  -2.564
  226   HG23  VAL  26          HG23      VAL  26  11.466  -1.081  -4.136
  227    H    TYR  27           HN       TYR  27  15.896  -0.052  -3.430
  228    HA   TYR  27           HA       TYR  27  16.923   0.451  -0.727
  229    HB2  TYR  27           HB2      TYR  27  18.113  -1.096  -2.871
  230    HB3  TYR  27           HB1      TYR  27  19.174   0.181  -2.311
  231    HD1  TYR  27           HD2      TYR  27  17.080  -2.625  -1.053
  232    HD2  TYR  27           HD1      TYR  27  20.478  -0.156  -0.419
  233    HE1  TYR  27           HE2      TYR  27  17.719  -4.012   0.871
  234    HE2  TYR  27           HE1      TYR  27  21.127  -1.533   1.512
  235    HH   TYR  27           HH       TYR  27  20.413  -3.133   2.962
  236    H    MET  28           HN       MET  28  18.167   2.244  -0.445
  237    HA   MET  28           HA       MET  28  17.742   4.363  -2.379
  238    HB2  MET  28           HB2      MET  28  18.769   4.355   0.457
  239    HB3  MET  28           HB1      MET  28  18.603   5.786  -0.526
  240    HG2  MET  28           HG2      MET  28  16.386   3.973   0.356
  241    HG3  MET  28           HG1      MET  28  16.765   5.557   1.017
  242    HE1  MET  28           HE1      MET  28  16.553   7.806  -0.346
  243    HE2  MET  28           HE2      MET  28  15.901   7.924  -1.980
  244    HE3  MET  28           HE3      MET  28  17.476   7.180  -1.712
  245    H    GLY  29           HN       GLY  29  19.270   4.754  -3.831
  246    HA2  GLY  29           HA2      GLY  29  21.877   3.627  -3.712
  247    HA3  GLY  29           HA1      GLY  29  21.316   4.821  -4.876
  248    H    ASP  30           HN       ASP  30  22.703   4.342  -1.701
  249    HA   ASP  30           HA       ASP  30  24.401   6.577  -1.839
  250    HB2  ASP  30           HB2      ASP  30  22.558   8.032  -1.498
  251    HB3  ASP  30           HB1      ASP  30  21.825   6.957  -0.314
  252    H    SER  31           HN       SER  31  22.446   4.744   0.490
  253    HA   SER  31           HA       SER  31  24.926   3.971   1.850
  254    HB2  SER  31           HB2      SER  31  22.328   4.821   3.154
  255    HB3  SER  31           HB1      SER  31  23.716   4.156   4.010
  256    HG   SER  31           HG       SER  31  23.580   6.596   2.558
  257    H    ASP  32           HN       ASP  32  23.395   2.437   3.839
  258    HA   ASP  32           HA       ASP  32  22.742   0.141   2.112
  259    HB2  ASP  32           HB2      ASP  32  24.039   0.432   4.742
  260    HB3  ASP  32           HB1      ASP  32  22.849  -0.863   4.666
  261    H    VAL  33           HN       VAL  33  21.178   2.567   3.238
  262    HA   VAL  33           HA       VAL  33  19.103   1.358   4.784
  263    HB   VAL  33           HB       VAL  33  19.656   3.690   5.115
  264   HG11  VAL  33          HG11      VAL  33  18.531   4.259   2.391
  265   HG12  VAL  33          HG12      VAL  33  20.258   4.151   2.729
  266   HG13  VAL  33          HG13      VAL  33  19.284   5.401   3.504
  267   HG21  VAL  33          HG21      VAL  33  17.406   2.988   5.650
  268   HG22  VAL  33          HG22      VAL  33  16.889   3.342   4.004
  269   HG23  VAL  33          HG23      VAL  33  17.412   4.650   5.064
  270    H    TYR  34           HN       TYR  34  17.018   0.979   4.168
  271    HA   TYR  34           HA       TYR  34  16.681   0.487   1.286
  272    HB2  TYR  34           HB2      TYR  34  15.004  -1.235   1.961
  273    HB3  TYR  34           HB1      TYR  34  16.645  -1.599   2.466
  274    HD1  TYR  34           HD1      TYR  34  17.253  -1.561   4.833
  275    HD2  TYR  34           HD2      TYR  34  13.281  -0.701   3.575
  276    HE1  TYR  34           HE1      TYR  34  16.465  -1.841   7.147
  277    HE2  TYR  34           HE2      TYR  34  12.483  -0.975   5.880
  278    HH   TYR  34           HH       TYR  34  14.594  -1.149   8.552
  279    H    THR  35           HN       THR  35  14.447   0.484   0.558
  280    HA   THR  35           HA       THR  35  12.867   2.601   1.861
  281    HB   THR  35           HB       THR  35  12.627   2.275  -1.071
  282    HG1  THR  35           HG1      THR  35  14.636   3.942  -0.765
  283   HG21  THR  35          HG21      THR  35  11.478   3.987   0.448
  284   HG22  THR  35          HG22      THR  35  12.234   4.591  -1.026
  285   HG23  THR  35          HG23      THR  35  13.049   4.786   0.525
  286    H    VAL  36           HN       VAL  36  11.322   1.342   2.806
  287    HA   VAL  36           HA       VAL  36  10.117  -0.825   1.304
  288    HB   VAL  36           HB       VAL  36  10.527  -1.327   3.604
  289   HG11  VAL  36          HG11      VAL  36   9.404  -0.061   5.440
  290   HG12  VAL  36          HG12      VAL  36   8.955   1.160   4.250
  291   HG13  VAL  36          HG13      VAL  36  10.657   0.844   4.590
  292   HG21  VAL  36          HG21      VAL  36   7.579  -0.853   3.176
  293   HG22  VAL  36          HG22      VAL  36   8.276  -1.904   4.409
  294   HG23  VAL  36          HG23      VAL  36   8.489  -2.284   2.699
  295    H    HIS  37           HN       HIS  37   8.459  -0.524   0.009
  296    HA   HIS  37           HA       HIS  37   6.725   1.810   0.467
  297    HB2  HIS  37           HB2      HIS  37   7.414   0.343  -2.077
  298    HB3  HIS  37           HB1      HIS  37   6.136   1.534  -1.973
  299    HD2  HIS  37           HD2      HIS  37  10.050   1.396  -1.658
  300    HE1  HIS  37           HE1      HIS  37   8.822   5.307  -2.696
  301    HE2  HIS  37           HE2      HIS  37  10.789   3.724  -2.534
  302    H    HIS  38           HN       HIS  38   4.494   1.556   0.185
  303    HA   HIS  38           HA       HIS  38   3.554  -1.212   0.509
  304    HB2  HIS  38           HB2      HIS  38   2.222   1.372   1.385
  305    HB3  HIS  38           HB1      HIS  38   1.595  -0.252   1.664
  306    HD2  HIS  38           HD2      HIS  38   3.781   2.327   3.350
  307    HE1  HIS  38           HE1      HIS  38   4.599  -1.366   5.243
  308    HE2  HIS  38           HE2      HIS  38   4.780   1.152   5.435
  309    H    MET  39           HN       MET  39   3.024  -1.905  -1.463
  310    HA   MET  39           HA       MET  39   1.345  -0.143  -3.120
  311    HB2  MET  39           HB2      MET  39   3.323  -0.271  -4.334
  312    HB3  MET  39           HB1      MET  39   3.639  -1.928  -3.839
  313    HG2  MET  39           HG2      MET  39   1.206  -1.627  -5.422
  314    HG3  MET  39           HG1      MET  39   2.667  -1.134  -6.275
  315    HE1  MET  39           HE1      MET  39   4.528  -4.265  -7.031
  316    HE2  MET  39           HE2      MET  39   4.882  -2.733  -6.229
  317    HE3  MET  39           HE3      MET  39   3.899  -2.757  -7.696
  318    H    VAL  40           HN       VAL  40  -0.490  -0.941  -3.930
  319    HA   VAL  40           HA       VAL  40  -1.503  -3.441  -3.000
  320    HB   VAL  40           HB       VAL  40  -3.220  -1.912  -3.292
  321   HG11  VAL  40          HG11      VAL  40  -3.435  -0.518  -5.394
  322   HG12  VAL  40          HG12      VAL  40  -1.795  -1.034  -5.781
  323   HG13  VAL  40          HG13      VAL  40  -2.108  -0.116  -4.309
  324   HG21  VAL  40          HG21      VAL  40  -4.346  -2.476  -5.595
  325   HG22  VAL  40          HG22      VAL  40  -4.209  -3.702  -4.330
  326   HG23  VAL  40          HG23      VAL  40  -3.067  -3.692  -5.675
  327    H    TRP  41           HN       TRP  41  -1.056  -5.349  -3.878
  328    HA   TRP  41           HA       TRP  41   0.437  -5.471  -6.355
  329    HB2  TRP  41           HB2      TRP  41   1.195  -6.737  -4.435
  330    HB3  TRP  41           HB1      TRP  41  -0.333  -7.613  -4.369
  331    HD1  TRP  41           HD1      TRP  41  -0.517  -9.762  -5.826
  332    HE1  TRP  41           HE1      TRP  41   1.068 -10.980  -7.453
  333    HE3  TRP  41           HE3      TRP  41   3.107  -6.185  -6.250
  334    HZ2  TRP  41           HZ2      TRP  41   3.534 -10.482  -8.740
  335    HZ3  TRP  41           HZ3      TRP  41   5.046  -6.634  -7.694
  336    HH2  TRP  41           HH2      TRP  41   5.253  -8.739  -8.912
  337    H    HIS  42           HN       HIS  42  -2.754  -6.416  -5.220
  338    HA   HIS  42           HA       HIS  42  -3.574  -6.807  -7.970
  339    HB2  HIS  42           HB2      HIS  42  -2.623  -9.036  -7.118
  340    HB3  HIS  42           HB1      HIS  42  -3.987  -9.085  -6.011
  341    HD2  HIS  42           HD2      HIS  42  -3.170  -9.653  -9.743
  342    HE1  HIS  42           HE1      HIS  42  -7.271 -10.490  -9.124
  343    HE2  HIS  42           HE2      HIS  42  -5.314 -10.741 -10.713
  344    H    VAL  43           HN       VAL  43  -5.845  -6.887  -8.212
  345    HA   VAL  43           HA       VAL  43  -7.420  -6.217  -5.823
  346    HB   VAL  43           HB       VAL  43  -7.740  -4.813  -8.487
  347   HG11  VAL  43          HG11      VAL  43  -9.785  -4.970  -7.185
  348   HG12  VAL  43          HG12      VAL  43  -9.206  -3.304  -7.233
  349   HG13  VAL  43          HG13      VAL  43  -8.963  -4.281  -5.785
  350   HG21  VAL  43          HG21      VAL  43  -6.758  -2.845  -7.499
  351   HG22  VAL  43          HG22      VAL  43  -5.615  -4.184  -7.388
  352   HG23  VAL  43          HG23      VAL  43  -6.531  -3.687  -5.965
  353    H    GLU  44           HN       GLU  44  -9.139  -7.543  -5.669
  354    HA   GLU  44           HA       GLU  44  -9.736  -9.573  -7.418
  355    HB2  GLU  44           HB2      GLU  44 -11.545  -8.171  -5.449
  356    HB3  GLU  44           HB1      GLU  44 -11.811  -9.748  -6.138
  357    HG2  GLU  44           HG2      GLU  44  -9.522  -8.994  -4.357
  358    HG3  GLU  44           HG1      GLU  44 -10.949  -9.907  -3.876
  359    H    ASP  45           HN       ASP  45 -10.903  -9.740  -9.236
  360    HA   ASP  45           HA       ASP  45 -11.650  -7.503 -10.739
  361    HB2  ASP  45           HB2      ASP  45 -12.325 -10.426 -10.982
  362    HB3  ASP  45           HB1      ASP  45 -12.970  -9.239 -12.110
  363    H    GLY  46           HN       GLY  46 -13.221  -6.127 -10.343
  364    HA2  GLY  46           HA2      GLY  46 -15.397  -5.384 -10.084
  365    HA3  GLY  46           HA1      GLY  46 -15.921  -7.056  -9.964
  366    H    GLY  47           HN       GLY  47 -13.366  -6.308  -7.862
  367    HA2  GLY  47           HA2      GLY  47 -15.045  -6.677  -5.554
  368    HA3  GLY  47           HA1      GLY  47 -13.309  -6.397  -5.554
  369    HA   PRO  48           HA       PRO  48 -15.793  -2.643  -3.935
  370    HB2  PRO  48           HB2      PRO  48 -13.719  -3.095  -1.847
  371    HB3  PRO  48           HB1      PRO  48 -15.403  -2.592  -1.646
  372    HG2  PRO  48           HG2      PRO  48 -14.742  -5.037  -1.057
  373    HG3  PRO  48           HG1      PRO  48 -16.157  -4.762  -2.080
  374    HD2  PRO  48           HD2      PRO  48 -13.395  -5.536  -2.914
  375    HD3  PRO  48           HD1      PRO  48 -14.939  -6.253  -3.370
  376    H    ALA  49           HN       ALA  49 -12.382  -3.349  -3.440
  377    HA   ALA  49           HA       ALA  49 -11.454  -0.725  -3.748
  378    HB1  ALA  49           HB1      ALA  49 -10.010  -3.328  -4.248
  379    HB2  ALA  49           HB2      ALA  49 -10.044  -2.413  -2.743
  380    HB3  ALA  49           HB3      ALA  49  -9.226  -1.752  -4.158
  381    H    SER  50           HN       SER  50 -12.035  -3.238  -6.100
  382    HA   SER  50           HA       SER  50 -10.861  -1.982  -8.333
  383    HB2  SER  50           HB2      SER  50 -12.139  -4.385  -7.815
  384    HB3  SER  50           HB1      SER  50 -13.252  -3.556  -8.902
  385    HG   SER  50           HG       SER  50 -11.461  -3.274 -10.341
  386    H    GLU  51           HN       GLU  51 -14.006  -1.847  -6.833
  387    HA   GLU  51           HA       GLU  51 -15.266  -0.223  -8.821
  388    HB2  GLU  51           HB2      GLU  51 -16.024  -0.733  -5.937
  389    HB3  GLU  51           HB1      GLU  51 -17.051   0.059  -7.125
  390    HG2  GLU  51           HG2      GLU  51 -16.728  -2.137  -8.469
  391    HG3  GLU  51           HG1      GLU  51 -16.261  -2.807  -6.908
  392    H    ALA  52           HN       ALA  52 -13.404   0.330  -5.977
  393    HA   ALA  52           HA       ALA  52 -14.059   3.100  -5.694
  394    HB1  ALA  52           HB1      ALA  52 -11.769   1.540  -4.527
  395    HB2  ALA  52           HB2      ALA  52 -13.377   1.668  -3.812
  396    HB3  ALA  52           HB3      ALA  52 -12.365   3.106  -3.978
  397    H    GLY  53           HN       GLY  53 -11.831   1.263  -7.573
  398    HA2  GLY  53           HA2      GLY  53 -10.850   2.302  -9.501
  399    HA3  GLY  53           HA1      GLY  53 -10.719   3.775  -8.566
  400    H    LEU  54           HN       LEU  54  -9.786   1.117  -6.716
  401    HA   LEU  54           HA       LEU  54  -7.086   1.990  -6.611
  402    HB2  LEU  54           HB2      LEU  54  -8.687   0.366  -5.075
  403    HB3  LEU  54           HB1      LEU  54  -7.544  -0.765  -5.751
  404    HG   LEU  54           HG       LEU  54  -7.076   1.500  -3.857
  405   HD11  LEU  54          HD11      LEU  54  -7.393  -0.819  -3.059
  406   HD12  LEU  54          HD12      LEU  54  -5.814  -0.138  -2.645
  407   HD13  LEU  54          HD13      LEU  54  -5.958  -1.290  -3.974
  408   HD21  LEU  54          HD21      LEU  54  -5.511   2.047  -5.549
  409   HD22  LEU  54          HD22      LEU  54  -5.058   0.361  -5.768
  410   HD23  LEU  54          HD23      LEU  54  -4.621   1.206  -4.282
  411    H    ARG  55           HN       ARG  55  -5.364   1.365  -7.714
  412    HA   ARG  55           HA       ARG  55  -5.702  -0.785  -9.702
  413    HB2  ARG  55           HB2      ARG  55  -3.842   1.582  -9.943
  414    HB3  ARG  55           HB1      ARG  55  -4.287   0.429 -11.198
  415    HG2  ARG  55           HG2      ARG  55  -6.327   2.185  -9.885
  416    HG3  ARG  55           HG1      ARG  55  -5.370   2.734 -11.257
  417    HD2  ARG  55           HD2      ARG  55  -6.277   1.087 -12.679
  418    HD3  ARG  55           HD1      ARG  55  -6.919   0.163 -11.322
  419    HE   ARG  55           HE       ARG  55  -7.988   2.839 -11.907
  420   HH11  ARG  55          HH11      ARG  55  -8.435  -0.628 -11.666
  421   HH12  ARG  55          HH12      ARG  55 -10.161  -0.547 -11.799
  422   HH21  ARG  55          HH21      ARG  55 -10.266   2.955 -12.075
  423   HH22  ARG  55          HH22      ARG  55 -11.208   1.496 -12.040
  424    H    GLN  56           HN       GLN  56  -4.292  -2.410  -9.650
  425    HA   GLN  56           HA       GLN  56  -2.403  -2.550  -7.518
  426    HB2  GLN  56           HB2      GLN  56  -1.802  -4.694  -9.146
  427    HB3  GLN  56           HB1      GLN  56  -2.891  -4.704  -7.780
  428    HG2  GLN  56           HG2      GLN  56  -4.767  -4.625  -9.084
  429    HG3  GLN  56           HG1      GLN  56  -3.893  -3.949 -10.432
  430   HE21  GLN  56          HE21      GLN  56  -1.727  -5.831 -10.362
  431   HE22  GLN  56          HE22      GLN  56  -2.353  -7.336 -10.934
  432    H    GLY  57           HN       GLY  57  -0.283  -2.262  -7.513
  433    HA2  GLY  57           HA2      GLY  57   1.870  -2.262  -8.528
  434    HA3  GLY  57           HA1      GLY  57   1.120  -1.895 -10.068
  435    H    ASP  58           HN       ASP  58  -0.368  -0.001  -7.795
  436    HA   ASP  58           HA       ASP  58   1.138   2.343  -8.610
  437    HB2  ASP  58           HB2      ASP  58  -1.257   2.082  -6.773
  438    HB3  ASP  58           HB1      ASP  58  -0.550   3.600  -7.294
  439    H    LEU  59           HN       LEU  59   0.588   3.799  -6.153
  440    HA   LEU  59           HA       LEU  59   2.225   2.454  -4.195
  441    HB2  LEU  59           HB2      LEU  59   2.914   4.925  -5.668
  442    HB3  LEU  59           HB1      LEU  59   3.204   4.947  -3.940
  443    HG   LEU  59           HG       LEU  59   4.393   3.060  -5.951
  444   HD11  LEU  59          HD11      LEU  59   5.375   5.306  -5.891
  445   HD12  LEU  59          HD12      LEU  59   6.499   4.084  -5.295
  446   HD13  LEU  59          HD13      LEU  59   5.650   5.130  -4.159
  447   HD21  LEU  59          HD21      LEU  59   4.051   1.728  -4.039
  448   HD22  LEU  59          HD22      LEU  59   4.480   3.044  -2.948
  449   HD23  LEU  59          HD23      LEU  59   5.724   2.273  -3.932
  450    H    ILE  60           HN       ILE  60   1.045   2.482  -2.418
  451    HA   ILE  60           HA       ILE  60  -0.952   4.519  -2.023
  452    HB   ILE  60           HB       ILE  60  -0.079   2.243  -0.226
  453   HG12  ILE  60          HG12      ILE  60  -2.669   2.497  -1.759
  454   HG13  ILE  60          HG11      ILE  60  -1.241   1.749  -2.462
  455   HG21  ILE  60          HG21      ILE  60  -2.127   2.706   1.053
  456   HG22  ILE  60          HG22      ILE  60  -2.405   4.137   0.059
  457   HG23  ILE  60          HG23      ILE  60  -0.987   4.053   1.104
  458   HD11  ILE  60          HD11      ILE  60  -2.832   0.829  -0.096
  459   HD12  ILE  60          HD12      ILE  60  -1.238   0.184  -0.489
  460   HD13  ILE  60          HD13      ILE  60  -2.571   0.003  -1.632
  461    H    THR  61           HN       THR  61  -0.430   6.449  -1.214
  462    HA   THR  61           HA       THR  61   2.031   6.681   0.337
  463    HB   THR  61           HB       THR  61   1.994   8.189  -1.492
  464    HG1  THR  61           HG1      THR  61   1.228   9.889   0.628
  465   HG21  THR  61          HG21      THR  61   0.239   9.855  -1.849
  466   HG22  THR  61          HG22      THR  61  -0.671   9.193  -0.491
  467   HG23  THR  61          HG23      THR  61  -0.410   8.216  -1.938
  468    H    HIS  62           HN       HIS  62  -1.440   7.201   0.651
  469    HA   HIS  62           HA       HIS  62  -1.011   7.498   3.529
  470    HB2  HIS  62           HB2      HIS  62  -2.739   9.420   1.955
  471    HB3  HIS  62           HB1      HIS  62  -2.664   9.331   3.702
  472    HD2  HIS  62           HD2      HIS  62  -0.365  10.390   4.881
  473    HE1  HIS  62           HE1      HIS  62   1.025  12.200   1.317
  474    HE2  HIS  62           HE2      HIS  62   1.294  12.089   3.834
  475    H    VAL  63           HN       VAL  63  -2.709   6.846   4.803
  476    HA   VAL  63           HA       VAL  63  -4.970   5.563   3.420
  477    HB   VAL  63           HB       VAL  63  -3.377   4.472   5.747
  478   HG11  VAL  63          HG11      VAL  63  -5.855   3.281   4.516
  479   HG12  VAL  63          HG12      VAL  63  -5.841   4.200   6.020
  480   HG13  VAL  63          HG13      VAL  63  -4.954   2.682   5.908
  481   HG21  VAL  63          HG21      VAL  63  -2.911   2.592   4.298
  482   HG22  VAL  63          HG22      VAL  63  -2.432   4.084   3.489
  483   HG23  VAL  63          HG23      VAL  63  -3.931   3.277   3.030
  484    H    ASN  64           HN       ASN  64  -6.782   6.531   4.010
  485    HA   ASN  64           HA       ASN  64  -8.383   7.588   5.230
  486    HB2  ASN  64           HB2      ASN  64  -6.849   6.376   7.535
  487    HB3  ASN  64           HB1      ASN  64  -8.359   7.256   7.733
  488   HD21  ASN  64          HD21      ASN  64  -7.563   4.421   8.202
  489   HD22  ASN  64          HD22      ASN  64  -8.733   3.492   7.339
  490    H    GLY  65           HN       GLY  65  -5.736   8.806   4.575
  491    HA2  GLY  65           HA2      GLY  65  -5.074  11.032   4.654
  492    HA3  GLY  65           HA1      GLY  65  -6.163  11.285   6.010
  493    H    GLU  66           HN       GLU  66  -3.944   8.620   6.141
  494    HA   GLU  66           HA       GLU  66  -2.326  10.130   8.091
  495    HB2  GLU  66           HB2      GLU  66  -2.713   7.150   8.025
  496    HB3  GLU  66           HB1      GLU  66  -2.058   8.119   9.337
  497    HG2  GLU  66           HG2      GLU  66  -4.866   8.502   8.413
  498    HG3  GLU  66           HG1      GLU  66  -4.452   7.189   9.500
  499    HA   PRO  67           HA       PRO  67   1.118   9.145   5.461
  500    HB2  PRO  67           HB2      PRO  67   3.129   9.748   7.185
  501    HB3  PRO  67           HB1      PRO  67   2.182  10.972   6.336
  502    HG2  PRO  67           HG2      PRO  67   2.031  10.089   9.162
  503    HG3  PRO  67           HG1      PRO  67   1.714  11.680   8.460
  504    HD2  PRO  67           HD2      PRO  67  -0.217   9.838   9.235
  505    HD3  PRO  67           HD1      PRO  67  -0.481  11.212   8.150
  506    H    VAL  68           HN       VAL  68   1.373   7.052   5.065
  507    HA   VAL  68           HA       VAL  68   1.892   5.169   7.218
  508    HB   VAL  68           HB       VAL  68   1.624   3.431   5.564
  509   HG11  VAL  68          HG11      VAL  68  -0.705   3.871   4.903
  510   HG12  VAL  68          HG12      VAL  68  -0.490   5.568   5.332
  511   HG13  VAL  68          HG13      VAL  68  -0.386   4.322   6.576
  512   HG21  VAL  68          HG21      VAL  68   1.088   3.935   3.224
  513   HG22  VAL  68          HG22      VAL  68   2.700   4.505   3.656
  514   HG23  VAL  68          HG23      VAL  68   1.363   5.648   3.531
  515    H    HIS  69           HN       HIS  69   3.715   7.052   5.121
  516    HA   HIS  69           HA       HIS  69   5.853   5.270   4.596
  517    HB2  HIS  69           HB2      HIS  69   5.359   7.443   3.381
  518    HB3  HIS  69           HB1      HIS  69   6.047   8.277   4.768
  519    HD2  HIS  69           HD2      HIS  69   8.725   8.547   4.722
  520    HE1  HIS  69           HE1      HIS  69   9.461   5.869   1.532
  521    HE2  HIS  69           HE2      HIS  69  10.436   7.728   2.953
  522    H    GLY  70           HN       GLY  70   6.722   4.268   6.296
  523    HA2  GLY  70           HA2      GLY  70   8.695   4.869   7.821
  524    HA3  GLY  70           HA1      GLY  70   7.508   5.888   8.620
  525    H    LEU  71           HN       LEU  71   5.332   3.945   8.189
  526    HA   LEU  71           HA       LEU  71   5.822   2.385  10.557
  527    HB2  LEU  71           HB2      LEU  71   3.473   1.872   8.805
  528    HB3  LEU  71           HB1      LEU  71   3.586   1.856  10.552
  529    HG   LEU  71           HG       LEU  71   3.632   4.337   8.903
  530   HD11  LEU  71          HD11      LEU  71   1.540   3.726   8.422
  531   HD12  LEU  71          HD12      LEU  71   1.211   4.344  10.043
  532   HD13  LEU  71          HD13      LEU  71   1.444   2.608   9.782
  533   HD21  LEU  71          HD21      LEU  71   2.981   5.394  11.052
  534   HD22  LEU  71          HD22      LEU  71   4.581   4.654  11.096
  535   HD23  LEU  71          HD23      LEU  71   3.209   3.832  11.839
  536    H    VAL  72           HN       VAL  72   4.864   0.069  10.426
  537    HA   VAL  72           HA       VAL  72   6.471  -1.423   8.528
  538    HB   VAL  72           HB       VAL  72   5.660  -3.410   9.790
  539   HG11  VAL  72          HG11      VAL  72   7.730  -2.351  10.474
  540   HG12  VAL  72          HG12      VAL  72   6.851  -2.928  11.889
  541   HG13  VAL  72          HG13      VAL  72   6.839  -1.213  11.485
  542   HG21  VAL  72          HG21      VAL  72   3.707  -3.190  10.845
  543   HG22  VAL  72          HG22      VAL  72   3.806  -1.423  10.844
  544   HG23  VAL  72          HG23      VAL  72   4.607  -2.362  12.116
  545    H    HIS  73           HN       HIS  73   5.225  -3.527   7.751
  546    HA   HIS  73           HA       HIS  73   3.285  -2.652   5.911
  547    HB2  HIS  73           HB2      HIS  73   4.749  -4.583   5.532
  548    HB3  HIS  73           HB1      HIS  73   3.931  -5.462   6.814
  549    HD1  HIS  73           HD1      HIS  73   2.787  -3.714   3.595
  550    HD2  HIS  73           HD2      HIS  73   2.150  -7.160   5.830
  551    HE1  HIS  73           HE1      HIS  73   1.114  -5.105   2.306
  552    H    THR  74           HN       THR  74   3.007  -4.326   9.006
  553    HA   THR  74           HA       THR  74   0.197  -4.752   8.800
  554    HB   THR  74           HB       THR  74   0.494  -5.047  11.374
  555    HG1  THR  74           HG1      THR  74   2.591  -5.278  12.028
  556   HG21  THR  74          HG21      THR  74   1.393  -7.318  10.976
  557   HG22  THR  74          HG22      THR  74   1.804  -6.835   9.330
  558   HG23  THR  74          HG23      THR  74   0.116  -6.879   9.839
  559    H    GLU  75           HN       GLU  75   2.142  -2.080  10.093
  560    HA   GLU  75           HA       GLU  75   0.152  -0.895  11.652
  561    HB2  GLU  75           HB2      GLU  75   2.511   0.316  10.194
  562    HB3  GLU  75           HB1      GLU  75   1.393   1.245  11.125
  563    HG2  GLU  75           HG2      GLU  75   2.616  -1.097  12.422
  564    HG3  GLU  75           HG1      GLU  75   3.566   0.379  12.235
  565    H    VAL  76           HN       VAL  76   0.978  -0.558   8.263
  566    HA   VAL  76           HA       VAL  76  -1.073   1.365   7.743
  567    HB   VAL  76           HB       VAL  76  -0.408   1.335   5.500
  568   HG11  VAL  76          HG11      VAL  76   1.317   2.158   7.023
  569   HG12  VAL  76          HG12      VAL  76   2.030   1.436   5.579
  570   HG13  VAL  76          HG13      VAL  76   2.024   0.546   7.101
  571   HG21  VAL  76          HG21      VAL  76   0.856  -0.434   4.423
  572   HG22  VAL  76          HG22      VAL  76  -0.645  -1.074   5.092
  573   HG23  VAL  76          HG23      VAL  76   0.883  -1.357   5.926
  574    H    VAL  77           HN       VAL  77  -0.795  -2.136   7.541
  575    HA   VAL  77           HA       VAL  77  -3.175  -2.702   6.159
  576    HB   VAL  77           HB       VAL  77  -1.509  -4.243   8.131
  577   HG11  VAL  77          HG11      VAL  77  -3.863  -4.875   8.536
  578   HG12  VAL  77          HG12      VAL  77  -2.890  -6.192   7.881
  579   HG13  VAL  77          HG13      VAL  77  -4.008  -5.316   6.834
  580   HG21  VAL  77          HG21      VAL  77  -1.120  -5.692   6.199
  581   HG22  VAL  77          HG22      VAL  77  -0.687  -4.017   5.850
  582   HG23  VAL  77          HG23      VAL  77  -2.196  -4.687   5.229
  583    H    GLU  78           HN       GLU  78  -2.493  -2.432   9.616
  584    HA   GLU  78           HA       GLU  78  -5.102  -2.818  10.517
  585    HB2  GLU  78           HB2      GLU  78  -2.845  -1.305  11.701
  586    HB3  GLU  78           HB1      GLU  78  -4.346  -1.609  12.548
  587    HG2  GLU  78           HG2      GLU  78  -3.897  -4.023  11.895
  588    HG3  GLU  78           HG1      GLU  78  -2.232  -3.505  11.726
  589    H    LEU  79           HN       LEU  79  -3.297   0.071   9.865
  590    HA   LEU  79           HA       LEU  79  -5.063   2.074  10.391
  591    HB2  LEU  79           HB2      LEU  79  -2.717   1.860   8.937
  592    HB3  LEU  79           HB1      LEU  79  -3.873   2.449   7.756
  593    HG   LEU  79           HG       LEU  79  -4.448   4.270   9.428
  594   HD11  LEU  79          HD11      LEU  79  -1.943   3.193  10.697
  595   HD12  LEU  79          HD12      LEU  79  -3.545   3.316  11.423
  596   HD13  LEU  79          HD13      LEU  79  -2.632   4.779  11.046
  597   HD21  LEU  79          HD21      LEU  79  -2.093   3.954   7.733
  598   HD22  LEU  79          HD22      LEU  79  -1.948   5.231   8.944
  599   HD23  LEU  79          HD23      LEU  79  -3.288   5.254   7.795
  600    H    ILE  80           HN       ILE  80  -4.852   0.411   7.224
  601    HA   ILE  80           HA       ILE  80  -7.091   1.429   6.012
  602    HB   ILE  80           HB       ILE  80  -5.962  -1.363   5.911
  603   HG12  ILE  80          HG12      ILE  80  -5.503   0.746   3.864
  604   HG13  ILE  80          HG11      ILE  80  -4.614   0.823   5.368
  605   HG21  ILE  80          HG21      ILE  80  -7.029  -1.522   3.708
  606   HG22  ILE  80          HG22      ILE  80  -7.825   0.024   4.002
  607   HG23  ILE  80          HG23      ILE  80  -8.188  -1.367   5.029
  608   HD11  ILE  80          HD11      ILE  80  -3.558  -1.193   4.996
  609   HD12  ILE  80          HD12      ILE  80  -3.500  -0.359   3.441
  610   HD13  ILE  80          HD13      ILE  80  -4.669  -1.657   3.707
  611    H    LEU  81           HN       LEU  81  -6.890  -1.589   7.873
  612    HA   LEU  81           HA       LEU  81  -9.575  -2.271   7.886
  613    HB2  LEU  81           HB2      LEU  81  -7.301  -2.808   9.738
  614    HB3  LEU  81           HB1      LEU  81  -8.912  -3.306  10.212
  615    HG   LEU  81           HG       LEU  81  -7.629  -4.142   7.617
  616   HD11  LEU  81          HD11      LEU  81  -7.766  -5.652  10.221
  617   HD12  LEU  81          HD12      LEU  81  -6.308  -4.953   9.517
  618   HD13  LEU  81          HD13      LEU  81  -7.145  -6.268   8.689
  619   HD21  LEU  81          HD21      LEU  81  -9.368  -5.959   7.844
  620   HD22  LEU  81          HD22      LEU  81  -9.980  -4.346   7.489
  621   HD23  LEU  81          HD23      LEU  81 -10.087  -4.987   9.128
  622    H    LYS  82           HN       LYS  82  -7.891  -0.095  10.139
  623    HA   LYS  82           HA       LYS  82 -10.037   0.241  11.915
  624    HB2  LYS  82           HB2      LYS  82  -7.688   2.025  11.379
  625    HB3  LYS  82           HB1      LYS  82  -8.757   2.135  12.776
  626    HG2  LYS  82           HG2      LYS  82  -8.166  -0.255  13.246
  627    HG3  LYS  82           HG1      LYS  82  -6.928  -0.095  12.029
  628    HD2  LYS  82           HD2      LYS  82  -7.112   1.761  14.383
  629    HD3  LYS  82           HD1      LYS  82  -6.196   0.258  14.441
  630    HE2  LYS  82           HE2      LYS  82  -4.888   1.055  12.477
  631    HE3  LYS  82           HE1      LYS  82  -5.739   2.594  12.589
  632    HZ1  LYS  82           HZ1      LYS  82  -3.951   1.406  14.641
  633    HZ2  LYS  82           HZ2      LYS  82  -4.863   2.810  14.871
  634    HZ3  LYS  82           HZ3      LYS  82  -3.645   2.778  13.701
  635    H    SER  83           HN       SER  83  -9.888   1.311   8.768
  636    HA   SER  83           HA       SER  83 -10.789   3.926   8.803
  637    HB2  SER  83           HB2      SER  83 -11.752   3.445   6.583
  638    HB3  SER  83           HB1      SER  83 -10.130   2.782   6.758
  639    HG   SER  83           HG       SER  83 -12.240   1.487   6.009
  640    H    GLY  84           HN       GLY  84 -12.833   1.010   8.583
  641    HA2  GLY  84           HA2      GLY  84 -14.850   0.681   9.763
  642    HA3  GLY  84           HA1      GLY  84 -14.907   2.404  10.108
  643    H    ASN  85           HN       ASN  85 -15.842  -0.108   7.998
  644    HA   ASN  85           HA       ASN  85 -17.464  -0.255   6.436
  645    HB2  ASN  85           HB2      ASN  85 -19.028   1.155   7.337
  646    HB3  ASN  85           HB1      ASN  85 -17.927   2.525   7.399
  647   HD21  ASN  85          HD21      ASN  85 -19.963   0.600   5.283
  648   HD22  ASN  85          HD22      ASN  85 -20.187   1.825   4.086
  649    H    LYS  86           HN       LYS  86 -15.401   2.617   5.960
  650    HA   LYS  86           HA       LYS  86 -14.651   1.573   3.397
  651    HB2  LYS  86           HB2      LYS  86 -15.002   3.688   2.231
  652    HB3  LYS  86           HB1      LYS  86 -16.490   2.935   2.738
  653    HG2  LYS  86           HG2      LYS  86 -16.246   4.477   4.813
  654    HG3  LYS  86           HG1      LYS  86 -15.183   5.379   3.736
  655    HD2  LYS  86           HD2      LYS  86 -17.145   5.180   2.058
  656    HD3  LYS  86           HD1      LYS  86 -18.100   4.828   3.499
  657    HE2  LYS  86           HE2      LYS  86 -17.460   6.942   4.478
  658    HE3  LYS  86           HE1      LYS  86 -16.401   7.286   3.112
  659    HZ1  LYS  86           HZ1      LYS  86 -19.358   7.028   3.012
  660    HZ2  LYS  86           HZ2      LYS  86 -18.361   7.282   1.670
  661    HZ3  LYS  86           HZ3      LYS  86 -18.473   8.461   2.873
  662    H    VAL  87           HN       VAL  87 -12.828   2.547   2.562
  663    HA   VAL  87           HA       VAL  87 -11.293   4.100   4.535
  664    HB   VAL  87           HB       VAL  87 -10.625   1.829   4.831
  665   HG11  VAL  87          HG11      VAL  87 -11.429   0.995   2.657
  666   HG12  VAL  87          HG12      VAL  87  -9.810   0.410   3.058
  667   HG13  VAL  87          HG13      VAL  87 -10.011   1.709   1.880
  668   HG21  VAL  87          HG21      VAL  87  -8.231   1.947   4.274
  669   HG22  VAL  87          HG22      VAL  87  -8.831   3.463   4.942
  670   HG23  VAL  87          HG23      VAL  87  -8.557   3.311   3.207
  671    H    ALA  88           HN       ALA  88 -10.053   5.684   3.754
  672    HA   ALA  88           HA       ALA  88 -10.169   6.162   0.876
  673    HB1  ALA  88           HB1      ALA  88 -10.842   8.005   2.316
  674    HB2  ALA  88           HB2      ALA  88  -9.379   8.415   1.416
  675    HB3  ALA  88           HB3      ALA  88  -9.270   7.965   3.118
  676    H    ILE  89           HN       ILE  89  -8.524   5.527  -0.320
  677    HA   ILE  89           HA       ILE  89  -5.879   5.286   0.956
  678    HB   ILE  89           HB       ILE  89  -6.844   3.712  -1.425
  679   HG12  ILE  89          HG12      ILE  89  -7.226   3.276   1.473
  680   HG13  ILE  89          HG11      ILE  89  -8.142   2.681   0.103
  681   HG21  ILE  89          HG21      ILE  89  -4.903   2.449  -1.217
  682   HG22  ILE  89          HG22      ILE  89  -4.558   3.081   0.390
  683   HG23  ILE  89          HG23      ILE  89  -4.372   4.122  -1.023
  684   HD11  ILE  89          HD11      ILE  89  -7.180   0.837   1.298
  685   HD12  ILE  89          HD12      ILE  89  -5.569   1.540   1.143
  686   HD13  ILE  89          HD13      ILE  89  -6.425   0.969  -0.290
  687    H    SER  90           HN       SER  90  -4.650   6.947   0.353
  688    HA   SER  90           HA       SER  90  -5.032   8.307  -2.153
  689    HB2  SER  90           HB2      SER  90  -2.813   8.625  -0.116
  690    HB3  SER  90           HB1      SER  90  -3.239   9.762  -1.392
  691    HG   SER  90           HG       SER  90  -4.662  10.574  -0.103
  692    H    THR  91           HN       THR  91  -4.298   7.479  -4.002
  693    HA   THR  91           HA       THR  91  -1.897   5.804  -3.923
  694    HB   THR  91           HB       THR  91  -2.751   5.082  -6.244
  695    HG1  THR  91           HG1      THR  91  -5.014   5.384  -6.519
  696   HG21  THR  91          HG21      THR  91  -4.507   3.569  -5.181
  697   HG22  THR  91          HG22      THR  91  -4.153   4.408  -3.666
  698   HG23  THR  91          HG23      THR  91  -2.882   3.504  -4.491
  699    H    THR  92           HN       THR  92  -0.346   5.977  -5.571
  700    HA   THR  92           HA       THR  92  -0.385   8.231  -7.387
  701    HB   THR  92           HB       THR  92   0.533   9.365  -5.490
  702    HG1  THR  92           HG1      THR  92   2.816   8.492  -6.947
  703   HG21  THR  92          HG21      THR  92   1.035   7.353  -4.147
  704   HG22  THR  92          HG22      THR  92   2.355   8.526  -4.135
  705   HG23  THR  92          HG23      THR  92   2.470   7.076  -5.135
  706    HA   PRO  93           HA       PRO  93   1.733   5.367 -10.076
  707    HB2  PRO  93           HB2      PRO  93   3.776   7.503 -10.433
  708    HB3  PRO  93           HB1      PRO  93   2.935   6.553 -11.655
  709    HG2  PRO  93           HG2      PRO  93   2.213   9.070 -11.175
  710    HG3  PRO  93           HG1      PRO  93   0.993   7.825 -11.502
  711    HD2  PRO  93           HD2      PRO  93   1.724   9.132  -8.928
  712    HD3  PRO  93           HD1      PRO  93   0.157   8.503  -9.475
  713    H    LEU  94           HN       LEU  94   3.433   3.968 -10.111
  714    HA   LEU  94           HA       LEU  94   5.322   4.169  -7.870
  715    HB2  LEU  94           HB2      LEU  94   4.024   2.195  -7.610
  716    HB3  LEU  94           HB1      LEU  94   4.159   1.791  -9.311
  717    HG   LEU  94           HG       LEU  94   6.580   1.308  -8.973
  718   HD11  LEU  94          HD11      LEU  94   5.950   1.642  -6.046
  719   HD12  LEU  94          HD12      LEU  94   6.944   2.732  -7.009
  720   HD13  LEU  94          HD13      LEU  94   7.470   1.071  -6.733
  721   HD21  LEU  94          HD21      LEU  94   6.249  -0.817  -7.840
  722   HD22  LEU  94          HD22      LEU  94   4.882  -0.470  -8.902
  723   HD23  LEU  94          HD23      LEU  94   4.727  -0.238  -7.161
  724    H    GLU  95           HN       GLU  95   6.374   5.696  -9.424
  725    HA   GLU  95           HA       GLU  95   7.860   4.377 -11.546
  726    HB2  GLU  95           HB2      GLU  95   7.908   7.252 -10.685
  727    HB3  GLU  95           HB1      GLU  95   8.646   6.600 -12.131
  728    HG2  GLU  95           HG2      GLU  95   5.684   6.596 -11.563
  729    HG3  GLU  95           HG1      GLU  95   6.525   7.756 -12.597
  730    H    ASN  96           HN       ASN  96   9.763   3.610 -11.234
  731    HA   ASN  96           HA       ASN  96  11.702   4.773  -9.479
  732    HB2  ASN  96           HB2      ASN  96  10.064   3.206  -8.092
  733    HB3  ASN  96           HB1      ASN  96  11.061   1.932  -8.785
  734   HD21  ASN  96          HD21      ASN  96  13.521   3.340  -8.804
  735   HD22  ASN  96          HD22      ASN  96  14.023   3.519  -7.155
  736    H2   PRO  97           HT1      PRO  97  10.136  -6.450 -12.578
  737    H3   PRO  97           HT2      PRO  97   9.990  -8.073 -12.494
  738    HA   PRO  97           HA       PRO  97  11.818  -8.357 -11.460
  739    HB2  PRO  97           HB2      PRO  97  13.670  -6.404 -12.314
  740    HB3  PRO  97           HB1      PRO  97  13.635  -8.114 -12.772
  741    HG2  PRO  97           HG2      PRO  97  12.533  -5.753 -14.199
  742    HG3  PRO  97           HG1      PRO  97  13.206  -7.254 -14.857
  743    HD2  PRO  97           HD2      PRO  97  10.575  -6.826 -14.886
  744    HD3  PRO  97           HD1      PRO  97  11.223  -8.435 -14.524
  745    H    PHE  98           HN       PHE  98  13.021  -7.260  -9.708
  746    HA   PHE  98           HA       PHE  98  12.088  -4.565  -9.100
  747    HB2  PHE  98           HB2      PHE  98  11.191  -6.988  -7.735
  748    HB3  PHE  98           HB1      PHE  98  11.898  -5.811  -6.631
  749    HD1  PHE  98           HD2      PHE  98  10.992  -3.432  -6.693
  750    HD2  PHE  98           HD1      PHE  98   9.022  -6.732  -8.521
  751    HE1  PHE  98           HE2      PHE  98   8.886  -2.161  -6.700
  752    HE2  PHE  98           HE1      PHE  98   6.912  -5.466  -8.534
  753    HZ   PHE  98           HZ       PHE  98   6.852  -3.162  -7.636
  754    H    ASP  99           HN       ASP  99  13.071  -4.178  -6.659
  755    HA   ASP  99           HA       ASP  99  15.935  -4.323  -7.114
  756    HB2  ASP  99           HB2      ASP  99  14.468  -2.278  -6.289
  757    HB3  ASP  99           HB1      ASP  99  14.736  -3.012  -4.711
  758    H    GLU 100           HN       GLU 100  16.429  -4.070  -4.172
  759    HA   GLU 100           HA       GLU 100  16.758  -6.879  -3.636
  760    HB2  GLU 100           HB2      GLU 100  17.351  -4.469  -1.909
  761    HB3  GLU 100           HB1      GLU 100  17.862  -6.116  -1.570
  762    HG2  GLU 100           HG2      GLU 100  18.683  -4.480  -3.956
  763    HG3  GLU 100           HG1      GLU 100  19.662  -4.781  -2.522
  764    H    ASP 101           HN       ASP 101  14.387  -7.212  -3.758
  765    HA   ASP 101           HA       ASP 101  12.849  -6.364  -1.453
  766    HB2  ASP 101           HB2      ASP 101  10.951  -7.330  -2.571
  767    HB3  ASP 101           HB1      ASP 101  11.877  -6.413  -3.752
  768    H    GLN 102           HN       GLN 102  15.052  -8.061  -0.824
  769    HA   GLN 102           HA       GLN 102  14.361 -10.764  -0.522
  770    HB2  GLN 102           HB2      GLN 102  16.210  -9.004   1.085
  771    HB3  GLN 102           HB1      GLN 102  16.037 -10.727   1.388
  772    HG2  GLN 102           HG2      GLN 102  17.842 -10.758   0.021
  773    HG3  GLN 102           HG1      GLN 102  16.566 -10.880  -1.187
  774   HE21  GLN 102          HE21      GLN 102  17.782  -9.976  -2.807
  775   HE22  GLN 102          HE22      GLN 102  18.216  -8.303  -2.832
  776    H    HIS 103           HN       HIS 103  14.048  -8.074   1.775
  777    HA   HIS 103           HA       HIS 103  12.369  -9.725   3.494
  778    HB2  HIS 103           HB2      HIS 103  13.580  -6.979   3.814
  779    HB3  HIS 103           HB1      HIS 103  12.366  -7.595   4.928
  780    HD2  HIS 103           HD2      HIS 103  16.124  -7.901   4.183
  781    HE1  HIS 103           HE1      HIS 103  15.178 -10.557   7.338
  782    HE2  HIS 103           HE2      HIS 103  17.038  -9.623   5.896
  783    H    THR 104           HN       THR 104  10.630  -9.915   2.007
  784    HA   THR 104           HA       THR 104   9.109  -7.439   1.569
  785    HB   THR 104           HB       THR 104   7.912  -9.385   0.013
  786    HG1  THR 104           HG1      THR 104  10.692  -9.631  -0.487
  787   HG21  THR 104          HG21      THR 104   8.299  -7.114  -0.704
  788   HG22  THR 104          HG22      THR 104   9.033  -8.211  -1.873
  789   HG23  THR 104          HG23      THR 104  10.045  -7.369  -0.697
  790    H    GLN 105           HN       GLN 105   6.921  -7.363   2.030
  791    HA   GLN 105           HA       GLN 105   5.894  -9.581   3.675
  792    HB2  GLN 105           HB2      GLN 105   6.274  -6.850   4.377
  793    HB3  GLN 105           HB1      GLN 105   4.542  -7.134   4.284
  794    HG2  GLN 105           HG2      GLN 105   6.508  -8.689   5.946
  795    HG3  GLN 105           HG1      GLN 105   5.371  -7.478   6.534
  796   HE21  GLN 105          HE21      GLN 105   5.787 -10.716   5.425
  797   HE22  GLN 105          HE22      GLN 105   4.196 -11.280   5.804
  798    H    ILE 106           HN       ILE 106   3.750 -10.173   3.361
  799    HA   ILE 106           HA       ILE 106   2.269  -8.801   1.227
  800    HB   ILE 106           HB       ILE 106   2.739 -11.773   1.364
  801   HG12  ILE 106          HG12      ILE 106   3.587  -9.883  -0.825
  802   HG13  ILE 106          HG11      ILE 106   4.644 -10.361   0.499
  803   HG21  ILE 106          HG21      ILE 106   1.413 -11.964  -0.637
  804   HG22  ILE 106          HG22      ILE 106   1.215 -10.214  -0.714
  805   HG23  ILE 106          HG23      ILE 106   0.468 -11.129   0.597
  806   HD11  ILE 106          HD11      ILE 106   3.429 -12.169  -1.571
  807   HD12  ILE 106          HD12      ILE 106   4.397 -12.713  -0.200
  808   HD13  ILE 106          HD13      ILE 106   5.121 -11.689  -1.443
  809    H    THR 107           HN       THR 107   0.267  -8.352   1.971
  810    HA   THR 107           HA       THR 107  -1.162 -10.361   3.520
  811    HB   THR 107           HB       THR 107  -0.884  -7.545   4.590
  812    HG1  THR 107           HG1      THR 107   1.061  -8.456   5.027
  813   HG21  THR 107          HG21      THR 107  -2.062 -10.031   5.831
  814   HG22  THR 107          HG22      THR 107  -2.983  -8.686   5.159
  815   HG23  THR 107          HG23      THR 107  -1.967  -8.436   6.579
  816    H    LYS 108           HN       LYS 108  -3.109 -10.530   2.594
  817    HA   LYS 108           HA       LYS 108  -4.212  -8.395   1.012
  818    HB2  LYS 108           HB2      LYS 108  -5.402 -11.037   1.902
  819    HB3  LYS 108           HB1      LYS 108  -6.196  -9.910   0.814
  820    HG2  LYS 108           HG2      LYS 108  -4.203 -10.149  -0.705
  821    HG3  LYS 108           HG1      LYS 108  -3.686 -11.484   0.323
  822    HD2  LYS 108           HD2      LYS 108  -4.870 -12.582  -1.340
  823    HD3  LYS 108           HD1      LYS 108  -6.093 -12.380  -0.084
  824    HE2  LYS 108           HE2      LYS 108  -7.000 -10.453  -1.222
  825    HE3  LYS 108           HE1      LYS 108  -5.719 -10.519  -2.430
  826    HZ1  LYS 108           HZ1      LYS 108  -7.916 -12.461  -2.015
  827    HZ2  LYS 108           HZ2      LYS 108  -6.580 -12.781  -2.999
  828    HZ3  LYS 108           HZ3      LYS 108  -7.626 -11.505  -3.384
  829    H    VAL 109           HN       VAL 109  -5.919  -7.014   1.623
  830    HA   VAL 109           HA       VAL 109  -6.627  -7.185   4.462
  831    HB   VAL 109           HB       VAL 109  -4.991  -5.434   4.137
  832   HG11  VAL 109          HG11      VAL 109  -5.402  -3.516   2.698
  833   HG12  VAL 109          HG12      VAL 109  -6.907  -4.246   2.140
  834   HG13  VAL 109          HG13      VAL 109  -5.363  -5.018   1.766
  835   HG21  VAL 109          HG21      VAL 109  -6.512  -4.928   5.853
  836   HG22  VAL 109          HG22      VAL 109  -7.785  -4.503   4.714
  837   HG23  VAL 109          HG23      VAL 109  -6.382  -3.452   4.897
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1   5.490  19.444  -2.666
    2    H2   GLY   1           HT2      GLY   1   5.558  19.842  -4.304
    3    H3   GLY   1           HT3      GLY   1   5.501  18.222  -3.830
    4    HA2  GLY   1           HA1      GLY   1   3.334  20.163  -3.298
    5    HA3  GLY   1           HA2      GLY   1   3.364  19.092  -4.694
    6    H    GLY   2           HN       GLY   2   1.702  19.361  -2.096
    7    HA2  GLY   2           HA2      GLY   2   2.080  16.657  -1.018
    8    HA3  GLY   2           HA1      GLY   2   1.076  17.921  -0.319
    9    H    SER   3           HN       SER   3  -0.938  18.431  -1.363
   10    HA   SER   3           HA       SER   3  -2.320  16.093  -2.224
   11    HB2  SER   3           HB2      SER   3  -3.408  18.891  -2.440
   12    HB3  SER   3           HB1      SER   3  -4.266  17.397  -2.061
   13    HG   SER   3           HG       SER   3  -2.903  17.377  -0.095
   14    H    MET   4           HN       MET   4  -2.171  15.303  -4.209
   15    HA   MET   4           HA       MET   4  -2.531  17.009  -6.513
   16    HB2  MET   4           HB2      MET   4  -0.157  17.251  -6.297
   17    HB3  MET   4           HB1      MET   4   0.053  15.528  -6.025
   18    HG2  MET   4           HG2      MET   4   0.778  16.016  -8.232
   19    HG3  MET   4           HG1      MET   4  -0.739  15.129  -8.347
   20    HE1  MET   4           HE1      MET   4  -1.161  15.801 -10.826
   21    HE2  MET   4           HE2      MET   4   0.391  16.637 -10.851
   22    HE3  MET   4           HE3      MET   4  -1.059  17.450 -11.440
   23    H    ARG   5           HN       ARG   5  -1.720  13.789  -5.300
   24    HA   ARG   5           HA       ARG   5  -2.980  12.543  -7.610
   25    HB2  ARG   5           HB2      ARG   5  -1.326  11.547  -5.323
   26    HB3  ARG   5           HB1      ARG   5  -2.288  10.419  -6.264
   27    HG2  ARG   5           HG2      ARG   5  -0.203  10.327  -7.267
   28    HG3  ARG   5           HG1      ARG   5  -1.101  11.435  -8.305
   29    HD2  ARG   5           HD2      ARG   5  -0.098  13.323  -6.996
   30    HD3  ARG   5           HD1      ARG   5   0.928  12.134  -6.189
   31    HE   ARG   5           HE       ARG   5   1.037  12.040  -9.067
   32   HH11  ARG   5          HH11      ARG   5   2.392  13.535  -6.200
   33   HH12  ARG   5          HH12      ARG   5   3.905  13.905  -6.964
   34   HH21  ARG   5          HH21      ARG   5   3.025  12.521 -10.055
   35   HH22  ARG   5          HH22      ARG   5   4.276  13.306  -9.143
   36    HA   PRO   6           HA       PRO   6  -6.827  12.324  -5.324
   37    HB2  PRO   6           HB2      PRO   6  -8.212  10.936  -7.209
   38    HB3  PRO   6           HB1      PRO   6  -7.890  12.663  -7.330
   39    HG2  PRO   6           HG2      PRO   6  -6.463  10.374  -8.603
   40    HG3  PRO   6           HG1      PRO   6  -6.992  11.908  -9.299
   41    HD2  PRO   6           HD2      PRO   6  -4.443  11.489  -8.543
   42    HD3  PRO   6           HD1      PRO   6  -5.208  13.084  -8.411
   43    HA   PRO   7           HA       PRO   7  -5.924   8.351  -3.449
   44    HB2  PRO   7           HB2      PRO   7  -8.411   8.875  -1.958
   45    HB3  PRO   7           HB1      PRO   7  -6.779   8.568  -1.358
   46    HG2  PRO   7           HG2      PRO   7  -7.887  11.002  -1.243
   47    HG3  PRO   7           HG1      PRO   7  -6.151  10.776  -1.539
   48    HD2  PRO   7           HD2      PRO   7  -8.333  11.451  -3.470
   49    HD3  PRO   7           HD1      PRO   7  -6.657  12.039  -3.408
   50    H    ILE   8           HN       ILE   8  -6.751   6.316  -3.390
   51    HA   ILE   8           HA       ILE   8  -8.903   5.737  -5.266
   52    HB   ILE   8           HB       ILE   8  -7.012   3.859  -3.855
   53   HG12  ILE   8          HG12      ILE   8  -5.956   5.582  -5.413
   54   HG13  ILE   8          HG11      ILE   8  -5.605   3.893  -5.745
   55   HG21  ILE   8          HG21      ILE   8  -7.656   2.294  -5.674
   56   HG22  ILE   8          HG22      ILE   8  -8.888   3.457  -6.169
   57   HG23  ILE   8          HG23      ILE   8  -8.973   2.707  -4.577
   58   HD11  ILE   8          HD11      ILE   8  -7.580   5.625  -7.204
   59   HD12  ILE   8          HD12      ILE   8  -7.316   3.905  -7.508
   60   HD13  ILE   8          HD13      ILE   8  -6.017   5.065  -7.800
   61    H    ILE   9           HN       ILE   9 -10.727   6.282  -3.973
   62    HA   ILE   9           HA       ILE   9 -11.083   5.310  -1.336
   63    HB   ILE   9           HB       ILE   9 -13.018   6.430  -3.358
   64   HG12  ILE   9          HG12      ILE   9 -13.019   8.383  -2.107
   65   HG13  ILE   9          HG11      ILE   9 -12.325   7.617  -0.700
   66   HG21  ILE   9          HG21      ILE   9 -14.526   6.623  -1.269
   67   HG22  ILE   9          HG22      ILE   9 -13.539   5.294  -0.650
   68   HG23  ILE   9          HG23      ILE   9 -14.456   5.090  -2.143
   69   HD11  ILE   9          HD11      ILE   9 -10.196   7.419  -2.035
   70   HD12  ILE   9          HD12      ILE   9 -10.684   9.053  -1.590
   71   HD13  ILE   9          HD13      ILE   9 -10.959   8.465  -3.231
   72    H    ILE  10           HN       ILE  10 -10.842   3.143  -1.188
   73    HA   ILE  10           HA       ILE  10 -12.361   1.364  -2.909
   74    HB   ILE  10           HB       ILE  10 -10.467   0.699  -0.657
   75   HG12  ILE  10          HG12      ILE  10  -9.882   0.603  -3.605
   76   HG13  ILE  10          HG11      ILE  10  -9.551   2.032  -2.639
   77   HG21  ILE  10          HG21      ILE  10 -11.862  -1.175  -1.108
   78   HG22  ILE  10          HG22      ILE  10 -10.326  -1.483  -1.922
   79   HG23  ILE  10          HG23      ILE  10 -11.722  -0.938  -2.850
   80   HD11  ILE  10          HD11      ILE  10  -8.052   0.710  -1.228
   81   HD12  ILE  10          HD12      ILE  10  -7.560   0.694  -2.923
   82   HD13  ILE  10          HD13      ILE  10  -8.380  -0.705  -2.231
   83    H    HIS  11           HN       HIS  11 -14.221   0.521  -2.363
   84    HA   HIS  11           HA       HIS  11 -15.337   1.022   0.251
   85    HB2  HIS  11           HB2      HIS  11 -16.377  -0.182  -2.301
   86    HB3  HIS  11           HB1      HIS  11 -17.306  -0.254  -0.806
   87    HD2  HIS  11           HD2      HIS  11 -15.706   3.036  -0.693
   88    HE1  HIS  11           HE1      HIS  11 -19.276   3.640  -2.867
   89    HE2  HIS  11           HE2      HIS  11 -17.502   4.751  -1.441
   90    H    ARG  12           HN       ARG  12 -15.988  -0.574   1.709
   91    HA   ARG  12           HA       ARG  12 -14.296  -2.838   1.881
   92    HB2  ARG  12           HB2      ARG  12 -15.538  -3.280   3.937
   93    HB3  ARG  12           HB1      ARG  12 -15.138  -1.577   3.820
   94    HG2  ARG  12           HG2      ARG  12 -17.360  -1.007   3.240
   95    HG3  ARG  12           HG1      ARG  12 -17.801  -2.703   3.013
   96    HD2  ARG  12           HD2      ARG  12 -17.291  -3.085   5.393
   97    HD3  ARG  12           HD1      ARG  12 -17.036  -1.362   5.594
   98    HE   ARG  12           HE       ARG  12 -19.601  -2.077   4.483
   99   HH11  ARG  12          HH11      ARG  12 -17.778  -1.472   7.415
  100   HH12  ARG  12          HH12      ARG  12 -19.185  -1.100   8.360
  101   HH21  ARG  12          HH21      ARG  12 -21.454  -1.606   5.741
  102   HH22  ARG  12          HH22      ARG  12 -21.267  -1.193   7.416
  103    H    ALA  13           HN       ALA  13 -14.746  -5.001   1.571
  104    HA   ALA  13           HA       ALA  13 -17.156  -5.567  -0.006
  105    HB1  ALA  13           HB1      ALA  13 -14.528  -7.000   0.287
  106    HB2  ALA  13           HB2      ALA  13 -15.238  -6.284  -1.161
  107    HB3  ALA  13           HB3      ALA  13 -15.931  -7.752  -0.473
  108    H    GLY  14           HN       GLY  14 -16.007  -5.789   3.102
  109    HA2  GLY  14           HA2      GLY  14 -17.850  -6.592   4.638
  110    HA3  GLY  14           HA1      GLY  14 -17.743  -8.090   3.723
  111    H    LYS  15           HN       LYS  15 -14.993  -8.256   3.423
  112    HA   LYS  15           HA       LYS  15 -13.989  -8.359   6.175
  113    HB2  LYS  15           HB2      LYS  15 -14.277 -10.601   4.240
  114    HB3  LYS  15           HB1      LYS  15 -12.841 -10.573   5.248
  115    HG2  LYS  15           HG2      LYS  15 -15.630 -10.419   6.329
  116    HG3  LYS  15           HG1      LYS  15 -14.722 -11.917   6.149
  117    HD2  LYS  15           HD2      LYS  15 -13.016 -11.109   7.645
  118    HD3  LYS  15           HD1      LYS  15 -13.825  -9.547   7.780
  119    HE2  LYS  15           HE2      LYS  15 -15.718 -10.577   8.868
  120    HE3  LYS  15           HE1      LYS  15 -15.031 -12.181   8.613
  121    HZ1  LYS  15           HZ1      LYS  15 -14.511 -11.658  10.804
  122    HZ2  LYS  15           HZ2      LYS  15 -14.101 -10.061  10.444
  123    HZ3  LYS  15           HZ3      LYS  15 -13.080 -11.321   9.971
  124    H    LYS  16           HN       LYS  16 -13.274  -8.342   2.731
  125    HA   LYS  16           HA       LYS  16 -10.694  -7.103   3.362
  126    HB2  LYS  16           HB2      LYS  16 -11.161  -9.221   1.261
  127    HB3  LYS  16           HB1      LYS  16  -9.662  -8.338   1.482
  128    HG2  LYS  16           HG2      LYS  16 -10.317  -9.404   3.989
  129    HG3  LYS  16           HG1      LYS  16 -10.577 -10.690   2.808
  130    HD2  LYS  16           HD2      LYS  16  -8.134  -9.138   2.392
  131    HD3  LYS  16           HD1      LYS  16  -8.174 -10.033   3.910
  132    HE2  LYS  16           HE2      LYS  16  -7.167 -11.355   2.121
  133    HE3  LYS  16           HE1      LYS  16  -8.661 -12.086   2.699
  134    HZ1  LYS  16           HZ1      LYS  16  -9.801 -11.107   0.786
  135    HZ2  LYS  16           HZ2      LYS  16  -8.575 -12.162   0.315
  136    HZ3  LYS  16           HZ3      LYS  16  -8.334 -10.491   0.215
  137    H    TYR  17           HN       TYR  17  -9.760  -5.962   1.377
  138    HA   TYR  17           HA       TYR  17 -11.946  -4.463   0.127
  139    HB2  TYR  17           HB2      TYR  17  -8.981  -3.868   0.205
  140    HB3  TYR  17           HB1      TYR  17 -10.216  -2.821  -0.485
  141    HD1  TYR  17           HD1      TYR  17 -11.847  -1.683   0.991
  142    HD2  TYR  17           HD2      TYR  17  -8.646  -3.998   2.544
  143    HE1  TYR  17           HE1      TYR  17 -12.182  -0.647   3.197
  144    HE2  TYR  17           HE2      TYR  17  -8.960  -2.995   4.747
  145    HH   TYR  17           HH       TYR  17  -9.937  -0.862   5.683
  146    H    GLY  18           HN       GLY  18  -9.857  -6.980  -0.608
  147    HA2  GLY  18           HA2      GLY  18 -10.128  -8.195  -2.631
  148    HA3  GLY  18           HA1      GLY  18 -10.598  -6.704  -3.416
  149    H    PHE  19           HN       PHE  19  -7.867  -6.154  -1.551
  150    HA   PHE  19           HA       PHE  19  -6.184  -6.839  -3.846
  151    HB2  PHE  19           HB2      PHE  19  -4.996  -4.808  -3.825
  152    HB3  PHE  19           HB1      PHE  19  -6.689  -4.407  -3.834
  153    HD1  PHE  19           HD1      PHE  19  -7.739  -3.420  -1.810
  154    HD2  PHE  19           HD2      PHE  19  -3.565  -4.226  -2.036
  155    HE1  PHE  19           HE1      PHE  19  -7.342  -1.901   0.091
  156    HE2  PHE  19           HE2      PHE  19  -3.162  -2.727  -0.131
  157    HZ   PHE  19           HZ       PHE  19  -5.056  -1.557   0.933
  158    H    THR  20           HN       THR  20  -3.923  -6.727  -3.440
  159    HA   THR  20           HA       THR  20  -3.287  -7.939  -0.816
  160    HB   THR  20           HB       THR  20  -1.842  -8.284  -3.436
  161    HG1  THR  20           HG1      THR  20  -3.948  -9.284  -3.309
  162   HG21  THR  20          HG21      THR  20  -0.760 -10.219  -2.214
  163   HG22  THR  20          HG22      THR  20  -1.434  -9.554  -0.727
  164   HG23  THR  20          HG23      THR  20  -0.261  -8.617  -1.661
  165    H    LEU  21           HN       LEU  21  -2.012  -6.794   0.473
  166    HA   LEU  21           HA       LEU  21  -0.492  -4.595  -0.703
  167    HB2  LEU  21           HB2      LEU  21  -2.023  -4.106   1.186
  168    HB3  LEU  21           HB1      LEU  21  -1.101  -5.199   2.193
  169    HG   LEU  21           HG       LEU  21   0.851  -3.747   2.038
  170   HD11  LEU  21          HD11      LEU  21  -0.911  -2.066   0.268
  171   HD12  LEU  21          HD12      LEU  21   0.609  -2.850  -0.162
  172   HD13  LEU  21          HD13      LEU  21   0.603  -1.509   0.982
  173   HD21  LEU  21          HD21      LEU  21  -1.703  -2.344   2.803
  174   HD22  LEU  21          HD22      LEU  21  -0.084  -1.787   3.226
  175   HD23  LEU  21          HD23      LEU  21  -0.673  -3.330   3.841
  176    H    ARG  22           HN       ARG  22   1.595  -4.894  -1.071
  177    HA   ARG  22           HA       ARG  22   2.936  -7.018   0.452
  178    HB2  ARG  22           HB2      ARG  22   3.163  -6.224  -2.429
  179    HB3  ARG  22           HB1      ARG  22   4.490  -7.043  -1.629
  180    HG2  ARG  22           HG2      ARG  22   2.430  -8.660  -0.948
  181    HG3  ARG  22           HG1      ARG  22   1.883  -8.052  -2.503
  182    HD2  ARG  22           HD2      ARG  22   3.271 -10.163  -2.573
  183    HD3  ARG  22           HD1      ARG  22   3.777  -8.856  -3.636
  184    HE   ARG  22           HE       ARG  22   5.087  -9.163  -1.027
  185   HH11  ARG  22          HH11      ARG  22   5.268  -9.349  -4.524
  186   HH12  ARG  22          HH12      ARG  22   6.997  -9.449  -4.555
  187   HH21  ARG  22          HH21      ARG  22   7.374  -9.325  -1.074
  188   HH22  ARG  22          HH22      ARG  22   8.201  -9.429  -2.603
  189    H    ALA  23           HN       ALA  23   4.303  -6.304   1.835
  190    HA   ALA  23           HA       ALA  23   5.385  -3.638   1.750
  191    HB1  ALA  23           HB1      ALA  23   6.613  -4.607   3.833
  192    HB2  ALA  23           HB2      ALA  23   5.495  -5.961   3.627
  193    HB3  ALA  23           HB3      ALA  23   4.871  -4.334   3.904
  194    H    ILE  24           HN       ILE  24   6.695  -3.623  -0.094
  195    HA   ILE  24           HA       ILE  24   8.744  -5.617  -0.442
  196    HB   ILE  24           HB       ILE  24   9.482  -4.183  -2.363
  197   HG12  ILE  24          HG12      ILE  24   6.894  -2.682  -2.011
  198   HG13  ILE  24          HG11      ILE  24   8.390  -2.083  -1.301
  199   HG21  ILE  24          HG21      ILE  24   7.581  -4.795  -3.776
  200   HG22  ILE  24          HG22      ILE  24   6.599  -5.066  -2.335
  201   HG23  ILE  24          HG23      ILE  24   8.000  -6.091  -2.652
  202   HD11  ILE  24          HD11      ILE  24   9.412  -2.017  -3.517
  203   HD12  ILE  24          HD12      ILE  24   7.948  -1.035  -3.443
  204   HD13  ILE  24          HD13      ILE  24   7.910  -2.616  -4.225
  205    H    ARG  25           HN       ARG  25  10.835  -5.495   0.078
  206    HA   ARG  25           HA       ARG  25  11.729  -3.054   1.445
  207    HB2  ARG  25           HB2      ARG  25  12.395  -5.951   1.828
  208    HB3  ARG  25           HB1      ARG  25  13.550  -4.718   2.315
  209    HG2  ARG  25           HG2      ARG  25  11.818  -3.703   3.750
  210    HG3  ARG  25           HG1      ARG  25  10.723  -5.014   3.311
  211    HD2  ARG  25           HD2      ARG  25  11.943  -6.597   4.478
  212    HD3  ARG  25           HD1      ARG  25  13.419  -5.636   4.436
  213    HE   ARG  25           HE       ARG  25  12.196  -4.112   6.035
  214   HH11  ARG  25          HH11      ARG  25  11.468  -7.530   5.850
  215   HH12  ARG  25          HH12      ARG  25  10.999  -7.640   7.517
  216   HH21  ARG  25          HH21      ARG  25  11.600  -4.257   8.230
  217   HH22  ARG  25          HH22      ARG  25  11.083  -5.789   8.870
  218    H    VAL  26           HN       VAL  26  12.850  -1.815   0.154
  219    HA   VAL  26           HA       VAL  26  14.669  -3.040  -1.814
  220    HB   VAL  26           HB       VAL  26  13.427  -0.279  -1.785
  221   HG11  VAL  26          HG11      VAL  26  15.216  -1.562  -3.846
  222   HG12  VAL  26          HG12      VAL  26  15.645  -0.225  -2.776
  223   HG13  VAL  26          HG13      VAL  26  14.404  -0.004  -4.010
  224   HG21  VAL  26          HG21      VAL  26  12.195  -1.041  -3.756
  225   HG22  VAL  26          HG22      VAL  26  11.821  -2.017  -2.334
  226   HG23  VAL  26          HG23      VAL  26  12.909  -2.642  -3.571
  227    H    TYR  27           HN       TYR  27  16.782  -2.905  -1.302
  228    HA   TYR  27           HA       TYR  27  17.636  -1.416   0.946
  229    HB2  TYR  27           HB2      TYR  27  18.969  -3.074  -1.100
  230    HB3  TYR  27           HB1      TYR  27  19.967  -1.930  -0.232
  231    HD1  TYR  27           HD2      TYR  27  17.754  -4.856   0.158
  232    HD2  TYR  27           HD1      TYR  27  20.583  -2.296   2.029
  233    HE1  TYR  27           HE2      TYR  27  17.905  -6.419   2.049
  234    HE2  TYR  27           HE1      TYR  27  20.744  -3.850   3.924
  235    HH   TYR  27           HH       TYR  27  19.520  -7.003   3.832
  236    H    MET  28           HN       MET  28  18.826   0.400   1.100
  237    HA   MET  28           HA       MET  28  18.273   2.447  -0.754
  238    HB2  MET  28           HB2      MET  28  19.792   2.202   1.791
  239    HB3  MET  28           HB1      MET  28  20.121   3.592   0.783
  240    HG2  MET  28           HG2      MET  28  17.386   2.803   1.737
  241    HG3  MET  28           HG1      MET  28  18.425   3.974   2.537
  242    HE1  MET  28           HE1      MET  28  19.731   5.715   0.191
  243    HE2  MET  28           HE2      MET  28  19.027   6.252   1.713
  244    HE3  MET  28           HE3      MET  28  18.516   6.993   0.199
  245    H    GLY  29           HN       GLY  29  20.774   0.127  -0.574
  246    HA2  GLY  29           HA2      GLY  29  22.355  -0.332  -2.212
  247    HA3  GLY  29           HA1      GLY  29  21.982   1.207  -2.968
  248    H    ASP  30           HN       ASP  30  22.544   3.068  -1.144
  249    HA   ASP  30           HA       ASP  30  25.436   2.899  -0.977
  250    HB2  ASP  30           HB2      ASP  30  25.376   5.252  -0.488
  251    HB3  ASP  30           HB1      ASP  30  24.228   4.946  -1.788
  252    H    SER  31           HN       SER  31  23.401   1.493   0.899
  253    HA   SER  31           HA       SER  31  24.986   1.751   3.259
  254    HB2  SER  31           HB2      SER  31  23.566   3.748   3.483
  255    HB3  SER  31           HB1      SER  31  22.128   2.745   3.332
  256    HG   SER  31           HG       SER  31  24.072   2.635   5.405
  257    H    ASP  32           HN       ASP  32  23.706   0.552   5.130
  258    HA   ASP  32           HA       ASP  32  23.020  -2.067   4.027
  259    HB2  ASP  32           HB2      ASP  32  24.698  -1.829   5.881
  260    HB3  ASP  32           HB1      ASP  32  23.407  -1.246   6.918
  261    H    VAL  33           HN       VAL  33  21.632   0.725   5.207
  262    HA   VAL  33           HA       VAL  33  19.286  -0.345   6.395
  263    HB   VAL  33           HB       VAL  33  19.998   1.901   6.940
  264   HG11  VAL  33          HG11      VAL  33  19.636   3.728   5.233
  265   HG12  VAL  33          HG12      VAL  33  19.560   2.446   4.024
  266   HG13  VAL  33          HG13      VAL  33  21.030   2.682   4.970
  267   HG21  VAL  33          HG21      VAL  33  17.590   1.328   7.021
  268   HG22  VAL  33          HG22      VAL  33  17.414   2.074   5.431
  269   HG23  VAL  33          HG23      VAL  33  17.917   3.047   6.813
  270    H    TYR  34           HN       TYR  34  17.230  -0.450   5.579
  271    HA   TYR  34           HA       TYR  34  17.093  -0.686   2.652
  272    HB2  TYR  34           HB2      TYR  34  15.287  -2.273   2.925
  273    HB3  TYR  34           HB1      TYR  34  16.683  -2.807   3.839
  274    HD1  TYR  34           HD2      TYR  34  13.253  -1.546   4.040
  275    HD2  TYR  34           HD1      TYR  34  16.622  -2.850   6.284
  276    HE1  TYR  34           HE2      TYR  34  11.838  -1.771   6.035
  277    HE2  TYR  34           HE1      TYR  34  15.207  -3.082   8.280
  278    HH   TYR  34           HH       TYR  34  12.818  -1.890   9.012
  279    H    THR  35           HN       THR  35  14.879  -0.428   1.828
  280    HA   THR  35           HA       THR  35  13.485   1.813   3.120
  281    HB   THR  35           HB       THR  35  13.463   1.700   0.160
  282    HG1  THR  35           HG1      THR  35  15.619   1.348   0.363
  283   HG21  THR  35          HG21      THR  35  12.463   3.466   1.788
  284   HG22  THR  35          HG22      THR  35  13.285   4.017   0.327
  285   HG23  THR  35          HG23      THR  35  14.122   4.065   1.880
  286    H    VAL  36           HN       VAL  36  11.738   0.698   3.855
  287    HA   VAL  36           HA       VAL  36  10.503  -1.322   2.188
  288    HB   VAL  36           HB       VAL  36  10.640  -1.836   4.530
  289   HG11  VAL  36          HG11      VAL  36   9.472  -0.568   6.247
  290   HG12  VAL  36          HG12      VAL  36   8.965   0.615   5.042
  291   HG13  VAL  36          HG13      VAL  36  10.674   0.428   5.431
  292   HG21  VAL  36          HG21      VAL  36   8.284  -2.339   5.025
  293   HG22  VAL  36          HG22      VAL  36   8.720  -2.729   3.362
  294   HG23  VAL  36          HG23      VAL  36   7.795  -1.269   3.712
  295    H    HIS  37           HN       HIS  37   8.962  -0.985   0.822
  296    HA   HIS  37           HA       HIS  37   7.354   1.468   1.057
  297    HB2  HIS  37           HB2      HIS  37   8.180  -0.091  -1.389
  298    HB3  HIS  37           HB1      HIS  37   7.004   1.206  -1.417
  299    HD2  HIS  37           HD2      HIS  37  10.830   0.658  -1.226
  300    HE1  HIS  37           HE1      HIS  37  10.074   4.814  -1.450
  301    HE2  HIS  37           HE2      HIS  37  11.827   3.004  -1.709
  302    H    HIS  38           HN       HIS  38   5.152   1.300   0.693
  303    HA   HIS  38           HA       HIS  38   4.078  -1.413   0.999
  304    HB2  HIS  38           HB2      HIS  38   2.754   1.252   1.587
  305    HB3  HIS  38           HB1      HIS  38   2.056  -0.334   1.897
  306    HD2  HIS  38           HD2      HIS  38   4.263   2.259   3.591
  307    HE1  HIS  38           HE1      HIS  38   4.595  -1.305   5.840
  308    HE2  HIS  38           HE2      HIS  38   5.290   1.122   5.681
  309    H    MET  39           HN       MET  39   3.926  -2.131  -1.034
  310    HA   MET  39           HA       MET  39   2.410  -0.484  -2.937
  311    HB2  MET  39           HB2      MET  39   4.543  -0.747  -3.870
  312    HB3  MET  39           HB1      MET  39   4.679  -2.414  -3.326
  313    HG2  MET  39           HG2      MET  39   2.455  -2.043  -5.144
  314    HG3  MET  39           HG1      MET  39   3.988  -1.550  -5.859
  315    HE1  MET  39           HE1      MET  39   5.926  -4.688  -6.429
  316    HE2  MET  39           HE2      MET  39   6.199  -3.176  -5.562
  317    HE3  MET  39           HE3      MET  39   5.392  -3.159  -7.136
  318    H    VAL  40           HN       VAL  40   0.639  -1.255  -3.836
  319    HA   VAL  40           HA       VAL  40  -0.512  -3.691  -2.891
  320    HB   VAL  40           HB       VAL  40  -2.176  -2.152  -3.315
  321   HG11  VAL  40          HG11      VAL  40  -2.231  -0.711  -5.366
  322   HG12  VAL  40          HG12      VAL  40  -0.616  -1.312  -5.744
  323   HG13  VAL  40          HG13      VAL  40  -0.895  -0.402  -4.257
  324   HG21  VAL  40          HG21      VAL  40  -1.903  -3.865  -5.753
  325   HG22  VAL  40          HG22      VAL  40  -3.226  -2.705  -5.611
  326   HG23  VAL  40          HG23      VAL  40  -3.048  -3.997  -4.419
  327    H    TRP  41           HN       TRP  41  -0.158  -5.636  -3.708
  328    HA   TRP  41           HA       TRP  41   1.458  -5.882  -6.119
  329    HB2  TRP  41           HB2      TRP  41   2.170  -7.061  -4.121
  330    HB3  TRP  41           HB1      TRP  41   0.614  -7.887  -4.022
  331    HD1  TRP  41           HD1      TRP  41   0.394 -10.130  -5.317
  332    HE1  TRP  41           HE1      TRP  41   1.958 -11.491  -6.847
  333    HE3  TRP  41           HE3      TRP  41   4.097  -6.672  -5.941
  334    HZ2  TRP  41           HZ2      TRP  41   4.442 -11.129  -8.151
  335    HZ3  TRP  41           HZ3      TRP  41   6.029  -7.253  -7.346
  336    HH2  TRP  41           HH2      TRP  41   6.198  -9.430  -8.424
  337    H    HIS  42           HN       HIS  42  -1.758  -6.775  -5.004
  338    HA   HIS  42           HA       HIS  42  -2.410  -7.372  -7.772
  339    HB2  HIS  42           HB2      HIS  42  -1.739  -9.555  -6.737
  340    HB3  HIS  42           HB1      HIS  42  -3.039  -9.363  -5.568
  341    HD2  HIS  42           HD2      HIS  42  -2.509 -10.265  -9.311
  342    HE1  HIS  42           HE1      HIS  42  -6.583 -10.862  -8.331
  343    HE2  HIS  42           HE2      HIS  42  -4.807 -11.187 -10.104
  344    H    VAL  43           HN       VAL  43  -4.529  -7.164  -8.283
  345    HA   VAL  43           HA       VAL  43  -6.356  -6.219  -6.184
  346    HB   VAL  43           HB       VAL  43  -6.032  -4.995  -8.938
  347   HG11  VAL  43          HG11      VAL  43  -8.338  -4.963  -8.318
  348   HG12  VAL  43          HG12      VAL  43  -7.688  -3.339  -8.097
  349   HG13  VAL  43          HG13      VAL  43  -7.949  -4.382  -6.699
  350   HG21  VAL  43          HG21      VAL  43  -4.268  -4.387  -7.258
  351   HG22  VAL  43          HG22      VAL  43  -5.550  -3.688  -6.267
  352   HG23  VAL  43          HG23      VAL  43  -5.213  -3.030  -7.868
  353    H    GLU  44           HN       GLU  44  -7.964  -7.649  -6.113
  354    HA   GLU  44           HA       GLU  44  -8.491  -9.672  -7.877
  355    HB2  GLU  44           HB2      GLU  44 -10.215  -8.231  -5.881
  356    HB3  GLU  44           HB1      GLU  44 -10.765  -9.631  -6.757
  357    HG2  GLU  44           HG2      GLU  44  -8.340  -9.595  -5.001
  358    HG3  GLU  44           HG1      GLU  44  -9.937 -10.134  -4.493
  359    H    ASP  45           HN       ASP  45  -9.506  -9.859  -9.754
  360    HA   ASP  45           HA       ASP  45 -10.296  -7.607 -11.259
  361    HB2  ASP  45           HB2      ASP  45 -10.665 -10.572 -11.668
  362    HB3  ASP  45           HB1      ASP  45 -11.282  -9.389 -12.816
  363    H    GLY  46           HN       GLY  46 -12.053  -6.450 -10.993
  364    HA2  GLY  46           HA2      GLY  46 -14.344  -6.017 -10.891
  365    HA3  GLY  46           HA1      GLY  46 -14.630  -7.732 -10.625
  366    H    GLY  47           HN       GLY  47 -12.200  -6.592  -8.634
  367    HA2  GLY  47           HA2      GLY  47 -13.878  -6.845  -6.298
  368    HA3  GLY  47           HA1      GLY  47 -12.141  -6.580  -6.319
  369    HA   PRO  48           HA       PRO  48 -14.712  -2.700  -5.089
  370    HB2  PRO  48           HB2      PRO  48 -12.861  -3.086  -2.788
  371    HB3  PRO  48           HB1      PRO  48 -14.541  -2.537  -2.777
  372    HG2  PRO  48           HG2      PRO  48 -14.003  -4.958  -1.994
  373    HG3  PRO  48           HG1      PRO  48 -15.313  -4.707  -3.154
  374    HD2  PRO  48           HD2      PRO  48 -12.517  -5.604  -3.690
  375    HD3  PRO  48           HD1      PRO  48 -14.040  -6.291  -4.252
  376    H    ALA  49           HN       ALA  49 -11.377  -3.477  -4.292
  377    HA   ALA  49           HA       ALA  49 -10.360  -0.878  -4.581
  378    HB1  ALA  49           HB1      ALA  49  -8.907  -3.497  -4.944
  379    HB2  ALA  49           HB2      ALA  49  -9.110  -2.615  -3.430
  380    HB3  ALA  49           HB3      ALA  49  -8.140  -1.923  -4.731
  381    H    SER  50           HN       SER  50 -10.784  -3.433  -6.950
  382    HA   SER  50           HA       SER  50  -9.364  -2.192  -9.058
  383    HB2  SER  50           HB2      SER  50 -10.455  -4.630  -8.747
  384    HB3  SER  50           HB1      SER  50 -11.750  -3.865  -9.666
  385    HG   SER  50           HG       SER  50 -10.561  -4.078 -11.379
  386    H    GLU  51           HN       GLU  51 -12.627  -2.037  -7.868
  387    HA   GLU  51           HA       GLU  51 -13.679  -0.472 -10.011
  388    HB2  GLU  51           HB2      GLU  51 -14.711  -0.843  -7.193
  389    HB3  GLU  51           HB1      GLU  51 -15.612  -0.144  -8.532
  390    HG2  GLU  51           HG2      GLU  51 -15.186  -2.380  -9.713
  391    HG3  GLU  51           HG1      GLU  51 -14.775  -2.982  -8.110
  392    H    ALA  52           HN       ALA  52 -12.065   0.168  -7.040
  393    HA   ALA  52           HA       ALA  52 -12.713   2.955  -6.922
  394    HB1  ALA  52           HB1      ALA  52 -10.530   1.457  -5.497
  395    HB2  ALA  52           HB2      ALA  52 -12.197   1.573  -4.940
  396    HB3  ALA  52           HB3      ALA  52 -11.206   3.025  -5.059
  397    H    GLY  53           HN       GLY  53 -10.354   1.021  -8.505
  398    HA2  GLY  53           HA2      GLY  53  -9.198   1.971 -10.387
  399    HA3  GLY  53           HA1      GLY  53  -9.083   3.464  -9.483
  400    H    LEU  54           HN       LEU  54  -8.413   0.861  -7.466
  401    HA   LEU  54           HA       LEU  54  -5.698   1.625  -7.182
  402    HB2  LEU  54           HB2      LEU  54  -7.505   0.108  -5.749
  403    HB3  LEU  54           HB1      LEU  54  -6.316  -1.064  -6.251
  404    HG   LEU  54           HG       LEU  54  -6.038   1.249  -4.387
  405   HD11  LEU  54          HD11      LEU  54  -6.392  -1.000  -3.512
  406   HD12  LEU  54          HD12      LEU  54  -4.800  -0.375  -3.069
  407   HD13  LEU  54          HD13      LEU  54  -4.953  -1.559  -4.368
  408   HD21  LEU  54          HD21      LEU  54  -4.317   1.823  -5.874
  409   HD22  LEU  54          HD22      LEU  54  -3.854   0.142  -6.120
  410   HD23  LEU  54          HD23      LEU  54  -3.535   0.927  -4.572
  411    H    ARG  55           HN       ARG  55  -3.941   0.915  -8.123
  412    HA   ARG  55           HA       ARG  55  -4.160  -1.331 -10.010
  413    HB2  ARG  55           HB2      ARG  55  -2.314   1.055 -10.211
  414    HB3  ARG  55           HB1      ARG  55  -2.524  -0.219 -11.406
  415    HG2  ARG  55           HG2      ARG  55  -4.864   1.423 -10.560
  416    HG3  ARG  55           HG1      ARG  55  -3.712   2.062 -11.729
  417    HD2  ARG  55           HD2      ARG  55  -4.369   0.624 -13.352
  418    HD3  ARG  55           HD1      ARG  55  -4.655  -0.687 -12.212
  419    HE   ARG  55           HE       ARG  55  -6.531   1.558 -12.595
  420   HH11  ARG  55          HH11      ARG  55  -5.882  -1.852 -12.108
  421   HH12  ARG  55          HH12      ARG  55  -7.554  -2.298 -12.092
  422   HH21  ARG  55          HH21      ARG  55  -8.746   0.964 -12.587
  423   HH22  ARG  55          HH22      ARG  55  -9.182  -0.699 -12.358
  424    H    GLN  56           HN       GLN  56  -2.464  -2.809 -10.072
  425    HA   GLN  56           HA       GLN  56  -0.968  -2.927  -7.596
  426    HB2  GLN  56           HB2      GLN  56  -0.238  -5.004  -9.487
  427    HB3  GLN  56           HB1      GLN  56  -0.890  -5.129  -7.876
  428    HG2  GLN  56           HG2      GLN  56  -3.088  -5.126  -8.596
  429    HG3  GLN  56           HG1      GLN  56  -2.653  -4.524 -10.170
  430   HE21  GLN  56          HE21      GLN  56  -0.461  -6.300 -10.593
  431   HE22  GLN  56          HE22      GLN  56  -1.135  -7.868 -10.870
  432    H    GLY  57           HN       GLY  57   1.173  -2.680  -7.343
  433    HA2  GLY  57           HA2      GLY  57   3.416  -2.546  -8.100
  434    HA3  GLY  57           HA1      GLY  57   2.830  -2.225  -9.721
  435    H    ASP  58           HN       ASP  58   1.042  -0.371  -7.610
  436    HA   ASP  58           HA       ASP  58   2.512   2.028  -8.325
  437    HB2  ASP  58           HB2      ASP  58  -0.022   1.644  -6.714
  438    HB3  ASP  58           HB1      ASP  58   0.686   3.206  -7.067
  439    H    LEU  59           HN       LEU  59   1.909   3.583  -6.051
  440    HA   LEU  59           HA       LEU  59   3.345   2.274  -3.912
  441    HB2  LEU  59           HB2      LEU  59   4.158   4.693  -5.407
  442    HB3  LEU  59           HB1      LEU  59   4.295   4.794  -3.663
  443    HG   LEU  59           HG       LEU  59   5.644   2.783  -5.445
  444   HD11  LEU  59          HD11      LEU  59   6.582   5.048  -5.536
  445   HD12  LEU  59          HD12      LEU  59   7.688   3.904  -4.777
  446   HD13  LEU  59          HD13      LEU  59   6.767   5.031  -3.782
  447   HD21  LEU  59          HD21      LEU  59   5.142   1.679  -3.400
  448   HD22  LEU  59          HD22      LEU  59   5.623   3.087  -2.452
  449   HD23  LEU  59          HD23      LEU  59   6.838   2.158  -3.332
  450    H    ILE  60           HN       ILE  60   1.967   2.301  -2.274
  451    HA   ILE  60           HA       ILE  60  -0.017   4.372  -2.076
  452    HB   ILE  60           HB       ILE  60   0.649   2.113  -0.165
  453   HG12  ILE  60          HG12      ILE  60  -1.789   2.319  -1.924
  454   HG13  ILE  60          HG11      ILE  60  -0.292   1.624  -2.533
  455   HG21  ILE  60          HG21      ILE  60  -1.559   2.613   0.840
  456   HG22  ILE  60          HG22      ILE  60  -1.662   4.051  -0.178
  457   HG23  ILE  60          HG23      ILE  60  -0.393   3.922   1.041
  458   HD11  ILE  60          HD11      ILE  60  -0.359  -0.061  -0.768
  459   HD12  ILE  60          HD12      ILE  60  -1.812  -0.098  -1.768
  460   HD13  ILE  60          HD13      ILE  60  -1.863   0.638  -0.165
  461    H    THR  61           HN       THR  61   0.654   6.317  -1.430
  462    HA   THR  61           HA       THR  61   2.880   6.517   0.433
  463    HB   THR  61           HB       THR  61   3.101   7.922  -1.472
  464    HG1  THR  61           HG1      THR  61   2.311   9.448   0.802
  465   HG21  THR  61          HG21      THR  61   1.464   9.646  -2.078
  466   HG22  THR  61          HG22      THR  61   0.394   9.078  -0.796
  467   HG23  THR  61          HG23      THR  61   0.761   8.026  -2.168
  468    H    HIS  62           HN       HIS  62  -0.584   7.081   0.357
  469    HA   HIS  62           HA       HIS  62  -0.459   7.596   3.235
  470    HB2  HIS  62           HB2      HIS  62  -2.156   9.324   1.421
  471    HB3  HIS  62           HB1      HIS  62  -2.042   9.429   3.167
  472    HD2  HIS  62           HD2      HIS  62   0.318  10.596   4.154
  473    HE1  HIS  62           HE1      HIS  62   1.404  12.219   0.400
  474    HE2  HIS  62           HE2      HIS  62   1.854  12.269   2.895
  475    H    VAL  63           HN       VAL  63  -2.194   6.884   4.373
  476    HA   VAL  63           HA       VAL  63  -4.353   5.576   2.848
  477    HB   VAL  63           HB       VAL  63  -2.993   4.603   5.369
  478   HG11  VAL  63          HG11      VAL  63  -5.456   4.368   5.491
  479   HG12  VAL  63          HG12      VAL  63  -4.611   2.822   5.459
  480   HG13  VAL  63          HG13      VAL  63  -5.409   3.420   4.004
  481   HG21  VAL  63          HG21      VAL  63  -1.886   4.073   3.206
  482   HG22  VAL  63          HG22      VAL  63  -3.355   3.231   2.707
  483   HG23  VAL  63          HG23      VAL  63  -2.428   2.647   4.089
  484    H    ASN  64           HN       ASN  64  -6.176   6.635   3.202
  485    HA   ASN  64           HA       ASN  64  -7.863   7.783   4.189
  486    HB2  ASN  64           HB2      ASN  64  -6.583   6.749   6.733
  487    HB3  ASN  64           HB1      ASN  64  -8.101   7.641   6.696
  488   HD21  ASN  64          HD21      ASN  64  -7.441   4.906   7.535
  489   HD22  ASN  64          HD22      ASN  64  -8.489   3.883   6.623
  490    H    GLY  65           HN       GLY  65  -5.096   8.866   3.719
  491    HA2  GLY  65           HA2      GLY  65  -4.452  11.117   3.649
  492    HA3  GLY  65           HA1      GLY  65  -5.585  11.458   4.946
  493    H    GLU  66           HN       GLU  66  -3.635   8.735   5.506
  494    HA   GLU  66           HA       GLU  66  -2.024  10.282   7.417
  495    HB2  GLU  66           HB2      GLU  66  -2.463   7.303   7.344
  496    HB3  GLU  66           HB1      GLU  66  -1.749   8.237   8.648
  497    HG2  GLU  66           HG2      GLU  66  -4.549   8.769   7.789
  498    HG3  GLU  66           HG1      GLU  66  -4.181   7.396   8.825
  499    HA   PRO  67           HA       PRO  67   1.535   9.318   4.864
  500    HB2  PRO  67           HB2      PRO  67   3.157  10.075   7.176
  501    HB3  PRO  67           HB1      PRO  67   3.043  10.857   5.599
  502    HG2  PRO  67           HG2      PRO  67   2.051  11.971   7.860
  503    HG3  PRO  67           HG1      PRO  67   1.334  12.239   6.265
  504    HD2  PRO  67           HD2      PRO  67   0.434  10.447   8.464
  505    HD3  PRO  67           HD1      PRO  67  -0.528  11.431   7.348
  506    H    VAL  68           HN       VAL  68   1.740   7.154   4.676
  507    HA   VAL  68           HA       VAL  68   2.146   5.514   7.025
  508    HB   VAL  68           HB       VAL  68   2.026   3.607   5.559
  509   HG11  VAL  68          HG11      VAL  68  -0.250   3.893   4.751
  510   HG12  VAL  68          HG12      VAL  68  -0.083   5.646   4.862
  511   HG13  VAL  68          HG13      VAL  68  -0.050   4.662   6.325
  512   HG21  VAL  68          HG21      VAL  68   1.650   3.868   3.138
  513   HG22  VAL  68          HG22      VAL  68   3.235   4.464   3.630
  514   HG23  VAL  68          HG23      VAL  68   1.929   5.602   3.293
  515    H    HIS  69           HN       HIS  69   4.143   7.228   4.995
  516    HA   HIS  69           HA       HIS  69   6.299   5.482   4.603
  517    HB2  HIS  69           HB2      HIS  69   6.179   7.590   3.407
  518    HB3  HIS  69           HB1      HIS  69   6.272   8.493   4.914
  519    HD2  HIS  69           HD2      HIS  69   8.724   9.403   5.390
  520    HE1  HIS  69           HE1      HIS  69  10.869   6.421   3.292
  521    HE2  HIS  69           HE2      HIS  69  11.056   8.389   4.878
  522    H    GLY  70           HN       GLY  70   7.364   4.422   6.115
  523    HA2  GLY  70           HA2      GLY  70   9.051   4.656   7.875
  524    HA3  GLY  70           HA1      GLY  70   7.991   5.838   8.630
  525    H    LEU  71           HN       LEU  71   5.627   4.022   7.898
  526    HA   LEU  71           HA       LEU  71   5.583   2.623  10.380
  527    HB2  LEU  71           HB2      LEU  71   3.773   2.557   7.987
  528    HB3  LEU  71           HB1      LEU  71   3.458   1.689   9.467
  529    HG   LEU  71           HG       LEU  71   3.620   4.645   9.164
  530   HD11  LEU  71          HD11      LEU  71   1.673   3.906   8.161
  531   HD12  LEU  71          HD12      LEU  71   1.193   4.450   9.772
  532   HD13  LEU  71          HD13      LEU  71   1.372   2.720   9.433
  533   HD21  LEU  71          HD21      LEU  71   2.803   4.724  11.483
  534   HD22  LEU  71          HD22      LEU  71   4.409   4.009  11.361
  535   HD23  LEU  71          HD23      LEU  71   2.999   2.974  11.582
  536    H    VAL  72           HN       VAL  72   4.613   0.376  10.312
  537    HA   VAL  72           HA       VAL  72   6.393  -1.381   8.798
  538    HB   VAL  72           HB       VAL  72   5.602  -3.145  10.352
  539   HG11  VAL  72          HG11      VAL  72   6.683  -2.300  12.388
  540   HG12  VAL  72          HG12      VAL  72   6.611  -0.663  11.736
  541   HG13  VAL  72          HG13      VAL  72   7.599  -1.886  10.937
  542   HG21  VAL  72          HG21      VAL  72   3.708  -1.009  11.099
  543   HG22  VAL  72          HG22      VAL  72   4.400  -1.925  12.447
  544   HG23  VAL  72          HG23      VAL  72   3.535  -2.769  11.162
  545    H    HIS  73           HN       HIS  73   5.189  -3.523   8.178
  546    HA   HIS  73           HA       HIS  73   3.284  -2.902   6.235
  547    HB2  HIS  73           HB2      HIS  73   4.697  -4.922   6.196
  548    HB3  HIS  73           HB1      HIS  73   3.786  -5.580   7.550
  549    HD1  HIS  73           HD1      HIS  73   2.769  -4.160   4.143
  550    HD2  HIS  73           HD2      HIS  73   2.049  -7.392   6.653
  551    HE1  HIS  73           HE1      HIS  73   1.099  -5.629   2.947
  552    H    THR  74           HN       THR  74   2.849  -4.213   9.501
  553    HA   THR  74           HA       THR  74   0.046  -4.557   9.234
  554    HB   THR  74           HB       THR  74   0.210  -4.568  11.824
  555    HG1  THR  74           HG1      THR  74   2.279  -4.796  12.607
  556   HG21  THR  74          HG21      THR  74   1.075  -6.880  11.740
  557   HG22  THR  74          HG22      THR  74   1.609  -6.595  10.083
  558   HG23  THR  74          HG23      THR  74  -0.111  -6.557  10.474
  559    H    GLU  75           HN       GLU  75   2.001  -1.820  10.418
  560    HA   GLU  75           HA       GLU  75  -0.034  -0.439  11.698
  561    HB2  GLU  75           HB2      GLU  75   2.448   0.546  10.307
  562    HB3  GLU  75           HB1      GLU  75   1.290   1.621  11.000
  563    HG2  GLU  75           HG2      GLU  75   2.416  -0.583  12.625
  564    HG3  GLU  75           HG1      GLU  75   3.262   0.958  12.451
  565    H    VAL  76           HN       VAL  76   0.958  -0.438   8.331
  566    HA   VAL  76           HA       VAL  76  -1.031   1.468   7.558
  567    HB   VAL  76           HB       VAL  76  -0.344   1.124   5.296
  568   HG11  VAL  76          HG11      VAL  76   2.024   1.570   5.456
  569   HG12  VAL  76          HG12      VAL  76   2.076   0.863   7.072
  570   HG13  VAL  76          HG13      VAL  76   1.178   2.354   6.791
  571   HG21  VAL  76          HG21      VAL  76   1.192  -0.635   4.604
  572   HG22  VAL  76          HG22      VAL  76  -0.292  -1.322   5.269
  573   HG23  VAL  76          HG23      VAL  76   1.182  -1.299   6.238
  574    H    VAL  77           HN       VAL  77  -0.780  -2.050   7.591
  575    HA   VAL  77           HA       VAL  77  -3.074  -2.712   6.141
  576    HB   VAL  77           HB       VAL  77  -1.579  -4.076   8.366
  577   HG11  VAL  77          HG11      VAL  77  -2.994  -6.006   8.252
  578   HG12  VAL  77          HG12      VAL  77  -4.013  -5.247   7.030
  579   HG13  VAL  77          HG13      VAL  77  -3.982  -4.608   8.673
  580   HG21  VAL  77          HG21      VAL  77  -1.131  -5.731   6.610
  581   HG22  VAL  77          HG22      VAL  77  -0.614  -4.112   6.136
  582   HG23  VAL  77          HG23      VAL  77  -2.108  -4.789   5.484
  583    H    GLU  78           HN       GLU  78  -2.671  -2.160   9.618
  584    HA   GLU  78           HA       GLU  78  -5.364  -2.409  10.333
  585    HB2  GLU  78           HB2      GLU  78  -3.289  -0.687  11.574
  586    HB3  GLU  78           HB1      GLU  78  -4.772  -1.200  12.342
  587    HG2  GLU  78           HG2      GLU  78  -4.004  -3.516  12.028
  588    HG3  GLU  78           HG1      GLU  78  -2.454  -2.887  11.516
  589    H    LEU  79           HN       LEU  79  -3.410   0.382   9.679
  590    HA   LEU  79           HA       LEU  79  -5.144   2.465   9.878
  591    HB2  LEU  79           HB2      LEU  79  -2.687   2.053   8.646
  592    HB3  LEU  79           HB1      LEU  79  -3.711   2.657   7.361
  593    HG   LEU  79           HG       LEU  79  -4.313   4.557   8.976
  594   HD11  LEU  79          HD11      LEU  79  -3.490   3.675  11.025
  595   HD12  LEU  79          HD12      LEU  79  -2.476   5.050  10.593
  596   HD13  LEU  79          HD13      LEU  79  -1.891   3.407  10.335
  597   HD21  LEU  79          HD21      LEU  79  -1.779   5.422   8.512
  598   HD22  LEU  79          HD22      LEU  79  -3.086   5.437   7.330
  599   HD23  LEU  79          HD23      LEU  79  -1.927   4.102   7.349
  600    H    ILE  80           HN       ILE  80  -4.684   0.601   6.849
  601    HA   ILE  80           HA       ILE  80  -6.765   1.619   5.369
  602    HB   ILE  80           HB       ILE  80  -5.711  -1.201   5.505
  603   HG12  ILE  80          HG12      ILE  80  -4.990   0.817   3.437
  604   HG13  ILE  80          HG11      ILE  80  -4.232   0.898   5.013
  605   HG21  ILE  80          HG21      ILE  80  -7.819  -1.225   4.399
  606   HG22  ILE  80          HG22      ILE  80  -6.546  -1.395   3.185
  607   HG23  ILE  80          HG23      ILE  80  -7.366   0.154   3.395
  608   HD11  ILE  80          HD11      ILE  80  -3.330  -1.251   4.796
  609   HD12  ILE  80          HD12      ILE  80  -2.943  -0.361   3.320
  610   HD13  ILE  80          HD13      ILE  80  -4.237  -1.565   3.316
  611    H    LEU  81           HN       LEU  81  -6.814  -1.295   7.400
  612    HA   LEU  81           HA       LEU  81  -9.486  -1.966   7.184
  613    HB2  LEU  81           HB2      LEU  81  -7.520  -2.288   9.429
  614    HB3  LEU  81           HB1      LEU  81  -9.143  -2.933   9.540
  615    HG   LEU  81           HG       LEU  81  -7.259  -3.655   7.305
  616   HD11  LEU  81          HD11      LEU  81  -7.707  -5.092   9.916
  617   HD12  LEU  81          HD12      LEU  81  -6.219  -4.296   9.405
  618   HD13  LEU  81          HD13      LEU  81  -6.798  -5.719   8.540
  619   HD21  LEU  81          HD21      LEU  81  -8.741  -5.561   7.032
  620   HD22  LEU  81          HD22      LEU  81  -9.643  -4.052   6.896
  621   HD23  LEU  81          HD23      LEU  81  -9.735  -5.002   8.380
  622    H    LYS  82           HN       LYS  82  -8.018   0.281   9.527
  623    HA   LYS  82           HA       LYS  82 -10.331   0.773  11.017
  624    HB2  LYS  82           HB2      LYS  82  -7.884   2.471  10.644
  625    HB3  LYS  82           HB1      LYS  82  -9.102   2.706  11.897
  626    HG2  LYS  82           HG2      LYS  82  -8.665   0.342  12.594
  627    HG3  LYS  82           HG1      LYS  82  -7.290   0.368  11.518
  628    HD2  LYS  82           HD2      LYS  82  -7.577   2.535  13.546
  629    HD3  LYS  82           HD1      LYS  82  -6.995   0.952  14.060
  630    HE2  LYS  82           HE2      LYS  82  -5.169   1.072  12.479
  631    HE3  LYS  82           HE1      LYS  82  -5.789   2.591  11.833
  632    HZ1  LYS  82           HZ1      LYS  82  -5.157   3.745  13.705
  633    HZ2  LYS  82           HZ2      LYS  82  -3.889   2.638  13.544
  634    HZ3  LYS  82           HZ3      LYS  82  -5.107   2.370  14.687
  635    H    SER  83           HN       SER  83  -9.786   1.719   7.854
  636    HA   SER  83           HA       SER  83 -10.684   4.315   7.662
  637    HB2  SER  83           HB2      SER  83 -11.478   3.669   5.387
  638    HB3  SER  83           HB1      SER  83  -9.841   3.122   5.743
  639    HG   SER  83           HG       SER  83 -10.480   1.107   5.692
  640    H    GLY  84           HN       GLY  84 -12.764   1.446   7.217
  641    HA2  GLY  84           HA2      GLY  84 -14.883   1.131   8.221
  642    HA3  GLY  84           HA1      GLY  84 -14.946   2.850   8.584
  643    H    ASN  85           HN       ASN  85 -15.781   0.383   6.409
  644    HA   ASN  85           HA       ASN  85 -17.247   0.281   4.694
  645    HB2  ASN  85           HB2      ASN  85 -18.811   1.795   5.459
  646    HB3  ASN  85           HB1      ASN  85 -17.663   3.129   5.496
  647   HD21  ASN  85          HD21      ASN  85 -19.471   1.037   3.291
  648   HD22  ASN  85          HD22      ASN  85 -19.615   2.212   2.036
  649    H    LYS  86           HN       LYS  86 -15.004   3.011   4.451
  650    HA   LYS  86           HA       LYS  86 -14.053   1.951   1.957
  651    HB2  LYS  86           HB2      LYS  86 -14.212   4.066   0.779
  652    HB3  LYS  86           HB1      LYS  86 -15.786   3.443   1.195
  653    HG2  LYS  86           HG2      LYS  86 -15.525   4.946   3.292
  654    HG3  LYS  86           HG1      LYS  86 -14.332   5.759   2.286
  655    HD2  LYS  86           HD2      LYS  86 -16.113   5.907   0.509
  656    HD3  LYS  86           HD1      LYS  86 -17.249   5.370   1.750
  657    HE2  LYS  86           HE2      LYS  86 -16.616   7.293   3.135
  658    HE3  LYS  86           HE1      LYS  86 -15.531   7.841   1.859
  659    HZ1  LYS  86           HZ1      LYS  86 -17.445   8.045   0.391
  660    HZ2  LYS  86           HZ2      LYS  86 -17.625   9.010   1.768
  661    HZ3  LYS  86           HZ3      LYS  86 -18.476   7.554   1.639
  662    H    VAL  87           HN       VAL  87 -12.126   2.891   1.309
  663    HA   VAL  87           HA       VAL  87 -10.736   4.406   3.409
  664    HB   VAL  87           HB       VAL  87 -10.150   2.130   3.826
  665   HG11  VAL  87          HG11      VAL  87 -10.770   1.112   1.751
  666   HG12  VAL  87          HG12      VAL  87  -9.081   0.717   2.084
  667   HG13  VAL  87          HG13      VAL  87  -9.478   1.959   0.896
  668   HG21  VAL  87          HG21      VAL  87  -8.300   3.614   4.114
  669   HG22  VAL  87          HG22      VAL  87  -7.951   3.612   2.387
  670   HG23  VAL  87          HG23      VAL  87  -7.682   2.155   3.342
  671    H    ALA  88           HN       ALA  88  -9.490   5.996   2.680
  672    HA   ALA  88           HA       ALA  88  -9.306   6.341  -0.213
  673    HB1  ALA  88           HB1      ALA  88 -10.113   8.249   1.052
  674    HB2  ALA  88           HB2      ALA  88  -8.567   8.614   0.281
  675    HB3  ALA  88           HB3      ALA  88  -8.632   8.260   2.010
  676    H    ILE  89           HN       ILE  89  -7.678   5.338  -1.063
  677    HA   ILE  89           HA       ILE  89  -5.118   5.235   0.361
  678    HB   ILE  89           HB       ILE  89  -5.956   3.657  -2.068
  679   HG12  ILE  89          HG12      ILE  89  -6.545   3.303   0.784
  680   HG13  ILE  89          HG11      ILE  89  -7.306   2.594  -0.626
  681   HG21  ILE  89          HG21      ILE  89  -4.037   2.366  -1.736
  682   HG22  ILE  89          HG22      ILE  89  -3.752   3.051  -0.138
  683   HG23  ILE  89          HG23      ILE  89  -3.506   4.042  -1.577
  684   HD11  ILE  89          HD11      ILE  89  -6.445   0.821   0.678
  685   HD12  ILE  89          HD12      ILE  89  -4.871   1.610   0.814
  686   HD13  ILE  89          HD13      ILE  89  -5.408   0.977  -0.743
  687    H    SER  90           HN       SER  90  -3.834   6.885  -0.141
  688    HA   SER  90           HA       SER  90  -4.006   8.231  -2.676
  689    HB2  SER  90           HB2      SER  90  -1.869   8.639  -0.588
  690    HB3  SER  90           HB1      SER  90  -2.497   9.801  -1.755
  691    HG   SER  90           HG       SER  90  -3.904  10.351  -0.300
  692    H    THR  91           HN       THR  91  -3.243   7.183  -4.385
  693    HA   THR  91           HA       THR  91  -0.819   5.580  -4.142
  694    HB   THR  91           HB       THR  91  -1.505   4.942  -6.559
  695    HG1  THR  91           HG1      THR  91  -3.332   5.747  -7.262
  696   HG21  THR  91          HG21      THR  91  -1.730   3.348  -4.786
  697   HG22  THR  91          HG22      THR  91  -3.240   3.345  -5.705
  698   HG23  THR  91          HG23      THR  91  -3.154   4.178  -4.151
  699    H    THR  92           HN       THR  92   0.809   5.724  -5.750
  700    HA   THR  92           HA       THR  92   0.952   7.957  -7.540
  701    HB   THR  92           HB       THR  92   1.557   9.141  -5.520
  702    HG1  THR  92           HG1      THR  92   4.053   8.525  -6.725
  703   HG21  THR  92          HG21      THR  92   2.109   7.202  -4.132
  704   HG22  THR  92          HG22      THR  92   3.370   8.436  -4.055
  705   HG23  THR  92          HG23      THR  92   3.613   6.989  -5.032
  706    HA   PRO  93           HA       PRO  93   3.408   5.148  -9.931
  707    HB2  PRO  93           HB2      PRO  93   5.440   7.325  -9.965
  708    HB3  PRO  93           HB1      PRO  93   4.838   6.348 -11.300
  709    HG2  PRO  93           HG2      PRO  93   3.955   8.832 -10.956
  710    HG3  PRO  93           HG1      PRO  93   2.845   7.540 -11.450
  711    HD2  PRO  93           HD2      PRO  93   3.115   8.901  -8.821
  712    HD3  PRO  93           HD1      PRO  93   1.688   8.167  -9.576
  713    H    LEU  94           HN       LEU  94   5.066   3.744  -9.779
  714    HA   LEU  94           HA       LEU  94   6.744   3.908  -7.367
  715    HB2  LEU  94           HB2      LEU  94   5.372   1.975  -7.164
  716    HB3  LEU  94           HB1      LEU  94   5.607   1.541  -8.848
  717    HG   LEU  94           HG       LEU  94   7.970   0.974  -8.355
  718   HD11  LEU  94          HD11      LEU  94   7.211   1.427  -5.479
  719   HD12  LEU  94          HD12      LEU  94   8.277   2.462  -6.428
  720   HD13  LEU  94          HD13      LEU  94   8.745   0.799  -6.075
  721   HD21  LEU  94          HD21      LEU  94   7.492  -1.069  -7.055
  722   HD22  LEU  94          HD22      LEU  94   6.328  -0.785  -8.350
  723   HD23  LEU  94          HD23      LEU  94   5.894  -0.423  -6.678
  724    H    GLU  95           HN       GLU  95   8.138   5.275  -8.601
  725    HA   GLU  95           HA       GLU  95   9.579   3.971 -10.782
  726    HB2  GLU  95           HB2      GLU  95  10.203   6.741  -9.920
  727    HB3  GLU  95           HB1      GLU  95  10.172   6.055 -11.534
  728    HG2  GLU  95           HG2      GLU  95   7.522   5.987 -10.494
  729    HG3  GLU  95           HG1      GLU  95   8.185   7.601 -10.247
  730    H    ASN  96           HN       ASN  96  11.399   2.995 -10.394
  731    HA   ASN  96           HA       ASN  96  13.171   3.931  -8.266
  732    HB2  ASN  96           HB2      ASN  96  11.920   2.122  -7.224
  733    HB3  ASN  96           HB1      ASN  96  12.216   1.075  -8.605
  734   HD21  ASN  96          HD21      ASN  96  14.119  -0.014  -8.763
  735   HD22  ASN  96          HD22      ASN  96  15.332  -0.008  -7.528
  736    H2   PRO  97           HT1      PRO  97   9.738  -5.275 -12.858
  737    H3   PRO  97           HT2      PRO  97  10.273  -4.466 -14.174
  738    HA   PRO  97           HA       PRO  97   9.918  -2.543 -13.362
  739    HB2  PRO  97           HB2      PRO  97   7.703  -2.703 -11.610
  740    HB3  PRO  97           HB1      PRO  97   7.748  -1.969 -13.221
  741    HG2  PRO  97           HG2      PRO  97   6.874  -4.688 -12.405
  742    HG3  PRO  97           HG1      PRO  97   6.294  -3.673 -13.737
  743    HD2  PRO  97           HD2      PRO  97   7.846  -5.783 -14.223
  744    HD3  PRO  97           HD1      PRO  97   8.067  -4.276 -15.131
  745    H    PHE  98           HN       PHE  98  10.031  -1.486 -11.178
  746    HA   PHE  98           HA       PHE  98  11.200  -1.272  -9.272
  747    HB2  PHE  98           HB2      PHE  98  10.381  -2.592  -7.353
  748    HB3  PHE  98           HB1      PHE  98   9.090  -1.902  -8.317
  749    HD1  PHE  98           HD1      PHE  98  10.888  -5.029  -7.528
  750    HD2  PHE  98           HD2      PHE  98   7.434  -3.275  -9.292
  751    HE1  PHE  98           HE1      PHE  98   9.843  -7.248  -7.682
  752    HE2  PHE  98           HE2      PHE  98   6.381  -5.493  -9.442
  753    HZ   PHE  98           HZ       PHE  98   7.574  -7.475  -8.663
  754    H    ASP  99           HN       ASP  99  12.184  -2.874  -7.329
  755    HA   ASP  99           HA       ASP  99  13.797  -5.004  -8.356
  756    HB2  ASP  99           HB2      ASP  99  15.023  -3.054  -9.267
  757    HB3  ASP  99           HB1      ASP  99  15.139  -2.375  -7.650
  758    H    GLU 100           HN       GLU 100  14.995  -6.031  -6.660
  759    HA   GLU 100           HA       GLU 100  15.519  -6.682  -4.552
  760    HB2  GLU 100           HB2      GLU 100  14.477  -3.975  -3.727
  761    HB3  GLU 100           HB1      GLU 100  15.285  -5.108  -2.655
  762    HG2  GLU 100           HG2      GLU 100  16.626  -4.189  -5.157
  763    HG3  GLU 100           HG1      GLU 100  16.622  -3.167  -3.720
  764    H    ASP 101           HN       ASP 101  14.547  -7.459  -2.575
  765    HA   ASP 101           HA       ASP 101  11.725  -7.272  -2.142
  766    HB2  ASP 101           HB2      ASP 101  11.949  -8.920  -4.086
  767    HB3  ASP 101           HB1      ASP 101  12.740 -10.005  -2.948
  768    H    GLN 102           HN       GLN 102  13.962  -9.970  -1.670
  769    HA   GLN 102           HA       GLN 102  14.783 -11.001   0.162
  770    HB2  GLN 102           HB2      GLN 102  14.820  -8.144   1.123
  771    HB3  GLN 102           HB1      GLN 102  15.494  -9.471   2.057
  772    HG2  GLN 102           HG2      GLN 102  17.350  -8.679   0.973
  773    HG3  GLN 102           HG1      GLN 102  16.834  -9.976  -0.103
  774   HE21  GLN 102          HE21      GLN 102  17.055  -6.550   0.347
  775   HE22  GLN 102          HE22      GLN 102  16.798  -6.101  -1.303
  776    H    HIS 103           HN       HIS 103  14.104  -9.607   2.928
  777    HA   HIS 103           HA       HIS 103  11.895 -11.359   3.470
  778    HB2  HIS 103           HB2      HIS 103  13.795 -10.908   5.066
  779    HB3  HIS 103           HB1      HIS 103  13.110  -9.309   5.325
  780    HD2  HIS 103           HD2      HIS 103  11.733 -13.006   5.667
  781    HE1  HIS 103           HE1      HIS 103  10.254 -10.583   8.802
  782    HE2  HIS 103           HE2      HIS 103  10.150 -12.867   7.717
  783    H    THR 104           HN       THR 104  10.279 -10.473   2.124
  784    HA   THR 104           HA       THR 104   9.300  -7.815   2.839
  785    HB   THR 104           HB       THR 104   7.689  -8.283   0.892
  786    HG1  THR 104           HG1      THR 104   9.540 -10.058  -0.174
  787   HG21  THR 104          HG21      THR 104   9.297  -7.580  -0.748
  788   HG22  THR 104          HG22      THR 104  10.631  -8.197   0.225
  789   HG23  THR 104          HG23      THR 104   9.699  -6.808   0.785
  790    H    GLN 105           HN       GLN 105   7.109  -7.467   3.402
  791    HA   GLN 105           HA       GLN 105   5.891  -9.796   4.712
  792    HB2  GLN 105           HB2      GLN 105   5.830  -6.868   5.237
  793    HB3  GLN 105           HB1      GLN 105   4.389  -7.789   5.639
  794    HG2  GLN 105           HG2      GLN 105   5.671  -7.682   7.605
  795    HG3  GLN 105           HG1      GLN 105   5.888  -9.314   6.977
  796   HE21  GLN 105          HE21      GLN 105   7.891  -9.982   6.361
  797   HE22  GLN 105          HE22      GLN 105   9.319  -9.021   6.542
  798    H    ILE 106           HN       ILE 106   3.918 -10.541   4.090
  799    HA   ILE 106           HA       ILE 106   2.542  -9.063   1.945
  800    HB   ILE 106           HB       ILE 106   3.050 -12.028   2.051
  801   HG12  ILE 106          HG12      ILE 106   4.002 -10.079  -0.036
  802   HG13  ILE 106          HG11      ILE 106   4.975 -10.518   1.365
  803   HG21  ILE 106          HG21      ILE 106   1.588 -10.411  -0.031
  804   HG22  ILE 106          HG22      ILE 106   0.846 -11.520   1.121
  805   HG23  ILE 106          HG23      ILE 106   1.934 -12.136  -0.123
  806   HD11  ILE 106          HD11      ILE 106   4.974 -12.837   0.652
  807   HD12  ILE 106          HD12      ILE 106   5.592 -11.787  -0.623
  808   HD13  ILE 106          HD13      ILE 106   3.951 -12.425  -0.723
  809    H    THR 107           HN       THR 107   0.479  -8.686   2.440
  810    HA   THR 107           HA       THR 107  -1.121 -10.712   3.738
  811    HB   THR 107           HB       THR 107  -0.719  -8.017   5.070
  812    HG1  THR 107           HG1      THR 107   0.550 -10.363   5.346
  813   HG21  THR 107          HG21      THR 107  -2.252  -8.843   6.786
  814   HG22  THR 107          HG22      THR 107  -2.500 -10.326   5.863
  815   HG23  THR 107          HG23      THR 107  -3.049  -8.781   5.213
  816    H    LYS 108           HN       LYS 108  -3.025 -10.743   2.778
  817    HA   LYS 108           HA       LYS 108  -3.861  -8.575   1.075
  818    HB2  LYS 108           HB2      LYS 108  -5.152 -11.206   1.823
  819    HB3  LYS 108           HB1      LYS 108  -5.883 -10.053   0.715
  820    HG2  LYS 108           HG2      LYS 108  -4.036 -10.296  -0.818
  821    HG3  LYS 108           HG1      LYS 108  -3.193 -11.351   0.316
  822    HD2  LYS 108           HD2      LYS 108  -5.104 -12.936   0.157
  823    HD3  LYS 108           HD1      LYS 108  -5.797 -11.910  -1.095
  824    HE2  LYS 108           HE2      LYS 108  -3.010 -12.988  -1.336
  825    HE3  LYS 108           HE1      LYS 108  -4.402 -13.960  -1.805
  826    HZ1  LYS 108           HZ1      LYS 108  -3.520 -12.806  -3.704
  827    HZ2  LYS 108           HZ2      LYS 108  -3.652 -11.310  -2.920
  828    HZ3  LYS 108           HZ3      LYS 108  -5.046 -12.177  -3.333
  829    H    VAL 109           HN       VAL 109  -5.533  -7.123   1.486
  830    HA   VAL 109           HA       VAL 109  -6.678  -7.251   4.179
  831    HB   VAL 109           HB       VAL 109  -4.871  -5.649   4.193
  832   HG11  VAL 109          HG11      VAL 109  -6.263  -4.286   1.897
  833   HG12  VAL 109          HG12      VAL 109  -4.777  -5.231   1.785
  834   HG13  VAL 109          HG13      VAL 109  -4.803  -3.728   2.712
  835   HG21  VAL 109          HG21      VAL 109  -6.132  -3.554   4.745
  836   HG22  VAL 109          HG22      VAL 109  -6.700  -5.005   5.568
  837   HG23  VAL 109          HG23      VAL 109  -7.593  -4.369   4.191
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1   3.259  20.081  -3.273
    2    H2   GLY   1           HT2      GLY   1   2.690  21.668  -3.190
    3    H3   GLY   1           HT3      GLY   1   1.693  20.442  -3.791
    4    HA2  GLY   1           HA1      GLY   1   2.666  20.712  -1.004
    5    HA3  GLY   1           HA2      GLY   1   1.027  21.004  -1.562
    6    H    GLY   2           HN       GLY   2   0.387  19.403   0.041
    7    HA2  GLY   2           HA2      GLY   2   1.199  16.648  -0.495
    8    HA3  GLY   2           HA1      GLY   2   0.213  17.206   0.849
    9    H    SER   3           HN       SER   3  -1.937  18.292  -0.045
   10    HA   SER   3           HA       SER   3  -3.445  16.175  -1.145
   11    HB2  SER   3           HB2      SER   3  -4.323  19.059  -1.064
   12    HB3  SER   3           HB1      SER   3  -5.321  17.610  -0.954
   13    HG   SER   3           HG       SER   3  -3.576  17.432   0.997
   14    H    MET   4           HN       MET   4  -3.362  15.513  -3.177
   15    HA   MET   4           HA       MET   4  -3.787  17.391  -5.329
   16    HB2  MET   4           HB2      MET   4  -1.352  17.492  -5.124
   17    HB3  MET   4           HB1      MET   4  -1.255  15.740  -5.222
   18    HG2  MET   4           HG2      MET   4  -0.651  16.762  -7.331
   19    HG3  MET   4           HG1      MET   4  -2.122  15.803  -7.493
   20    HE1  MET   4           HE1      MET   4  -1.490  17.546  -9.778
   21    HE2  MET   4           HE2      MET   4  -2.883  18.594 -10.046
   22    HE3  MET   4           HE3      MET   4  -3.120  16.884  -9.681
   23    H    ARG   5           HN       ARG   5  -2.790  14.054  -4.605
   24    HA   ARG   5           HA       ARG   5  -4.341  13.037  -6.829
   25    HB2  ARG   5           HB2      ARG   5  -2.531  11.780  -4.796
   26    HB3  ARG   5           HB1      ARG   5  -3.565  10.788  -5.807
   27    HG2  ARG   5           HG2      ARG   5  -1.553  10.789  -6.944
   28    HG3  ARG   5           HG1      ARG   5  -2.476  12.042  -7.774
   29    HD2  ARG   5           HD2      ARG   5  -1.322  13.768  -6.572
   30    HD3  ARG   5           HD1      ARG   5  -0.514  12.575  -5.554
   31    HE   ARG   5           HE       ARG   5   0.022  12.242  -8.357
   32   HH11  ARG   5          HH11      ARG   5   0.967  13.895  -5.430
   33   HH12  ARG   5          HH12      ARG   5   2.580  14.222  -5.973
   34   HH21  ARG   5          HH21      ARG   5   2.152  12.674  -9.098
   35   HH22  ARG   5          HH22      ARG   5   3.251  13.539  -8.069
   36    HA   PRO   6           HA       PRO   6  -7.969  12.427  -4.325
   37    HB2  PRO   6           HB2      PRO   6  -9.387  10.971  -6.112
   38    HB3  PRO   6           HB1      PRO   6  -9.139  12.705  -6.286
   39    HG2  PRO   6           HG2      PRO   6  -7.685  10.442  -7.583
   40    HG3  PRO   6           HG1      PRO   6  -8.328  11.928  -8.292
   41    HD2  PRO   6           HD2      PRO   6  -5.720  11.655  -7.657
   42    HD3  PRO   6           HD1      PRO   6  -6.560  13.214  -7.541
   43    HA   PRO   7           HA       PRO   7  -6.824   8.483  -2.529
   44    HB2  PRO   7           HB2      PRO   7  -9.252   8.859  -0.912
   45    HB3  PRO   7           HB1      PRO   7  -7.578   8.660  -0.392
   46    HG2  PRO   7           HG2      PRO   7  -8.858  11.006  -0.216
   47    HG3  PRO   7           HG1      PRO   7  -7.122  10.911  -0.565
   48    HD2  PRO   7           HD2      PRO   7  -9.401  11.445  -2.424
   49    HD3  PRO   7           HD1      PRO   7  -7.769  12.141  -2.412
   50    H    ILE   8           HN       ILE   8  -7.578   6.417  -2.509
   51    HA   ILE   8           HA       ILE   8  -9.800   5.858  -4.290
   52    HB   ILE   8           HB       ILE   8  -7.865   3.925  -3.036
   53   HG12  ILE   8          HG12      ILE   8  -6.803   5.778  -4.425
   54   HG13  ILE   8          HG11      ILE   8  -6.444   4.128  -4.904
   55   HG21  ILE   8          HG21      ILE   8  -9.676   2.713  -3.850
   56   HG22  ILE   8          HG22      ILE   8  -8.482   2.625  -5.145
   57   HG23  ILE   8          HG23      ILE   8  -9.843   3.740  -5.275
   58   HD11  ILE   8          HD11      ILE   8  -6.872   5.624  -6.800
   59   HD12  ILE   8          HD12      ILE   8  -8.515   5.866  -6.209
   60   HD13  ILE   8          HD13      ILE   8  -7.990   4.262  -6.729
   61    H    ILE   9           HN       ILE   9 -11.586   6.311  -2.886
   62    HA   ILE   9           HA       ILE   9 -11.796   5.183  -0.292
   63    HB   ILE   9           HB       ILE   9 -13.898   6.321  -2.135
   64   HG12  ILE   9          HG12      ILE   9 -13.896   8.223  -0.718
   65   HG13  ILE   9          HG11      ILE   9 -12.841   7.453   0.441
   66   HG21  ILE   9          HG21      ILE   9 -15.068   4.796  -0.766
   67   HG22  ILE   9          HG22      ILE   9 -15.310   6.389  -0.042
   68   HG23  ILE   9          HG23      ILE   9 -14.145   5.265   0.661
   69   HD11  ILE   9          HD11      ILE   9 -11.001   7.638  -1.089
   70   HD12  ILE   9          HD12      ILE   9 -11.763   9.215  -0.888
   71   HD13  ILE   9          HD13      ILE   9 -12.067   8.266  -2.345
   72    H    ILE  10           HN       ILE  10 -11.497   3.034  -0.289
   73    HA   ILE  10           HA       ILE  10 -13.052   1.313  -2.037
   74    HB   ILE  10           HB       ILE  10 -10.968   0.568   0.011
   75   HG12  ILE  10          HG12      ILE  10 -10.600   0.799  -2.963
   76   HG13  ILE  10          HG11      ILE  10 -10.262   2.135  -1.879
   77   HG21  ILE  10          HG21      ILE  10 -12.301  -1.320  -0.538
   78   HG22  ILE  10          HG22      ILE  10 -10.810  -1.463  -1.472
   79   HG23  ILE  10          HG23      ILE  10 -12.287  -0.904  -2.252
   80   HD11  ILE  10          HD11      ILE  10  -8.570   0.819  -0.756
   81   HD12  ILE  10          HD12      ILE  10  -8.253   0.889  -2.490
   82   HD13  ILE  10          HD13      ILE  10  -8.950  -0.566  -1.777
   83    H    HIS  11           HN       HIS  11 -14.845   0.434  -1.447
   84    HA   HIS  11           HA       HIS  11 -15.879   0.637   1.218
   85    HB2  HIS  11           HB2      HIS  11 -16.890  -0.663  -1.312
   86    HB3  HIS  11           HB1      HIS  11 -17.823  -0.592   0.180
   87    HD2  HIS  11           HD2      HIS  11 -17.360   2.514   0.911
   88    HE1  HIS  11           HE1      HIS  11 -18.885   3.227  -2.960
   89    HE2  HIS  11           HE2      HIS  11 -18.257   4.291  -0.748
   90    H    ARG  12           HN       ARG  12 -16.368  -1.081   2.613
   91    HA   ARG  12           HA       ARG  12 -14.536  -3.212   2.712
   92    HB2  ARG  12           HB2      ARG  12 -15.980  -3.989   4.593
   93    HB3  ARG  12           HB1      ARG  12 -15.516  -2.303   4.719
   94    HG2  ARG  12           HG2      ARG  12 -17.670  -1.579   4.020
   95    HG3  ARG  12           HG1      ARG  12 -18.148  -3.227   3.601
   96    HD2  ARG  12           HD2      ARG  12 -17.990  -3.875   5.918
   97    HD3  ARG  12           HD1      ARG  12 -17.444  -2.268   6.366
   98    HE   ARG  12           HE       ARG  12 -20.065  -2.563   5.087
   99   HH11  ARG  12          HH11      ARG  12 -18.205  -1.901   7.992
  100   HH12  ARG  12          HH12      ARG  12 -19.527  -1.141   8.817
  101   HH21  ARG  12          HH21      ARG  12 -21.804  -1.566   6.171
  102   HH22  ARG  12          HH22      ARG  12 -21.578  -0.941   7.777
  103    H    ALA  13           HN       ALA  13 -14.743  -5.371   2.229
  104    HA   ALA  13           HA       ALA  13 -17.170  -6.154   0.748
  105    HB1  ALA  13           HB1      ALA  13 -14.289  -6.620   0.160
  106    HB2  ALA  13           HB2      ALA  13 -15.616  -6.204  -0.929
  107    HB3  ALA  13           HB3      ALA  13 -15.464  -7.848  -0.314
  108    H    GLY  14           HN       GLY  14 -14.538  -7.255   2.829
  109    HA2  GLY  14           HA2      GLY  14 -15.894  -8.660   4.673
  110    HA3  GLY  14           HA1      GLY  14 -15.838  -9.794   3.331
  111    H    LYS  15           HN       LYS  15 -13.833 -10.629   2.652
  112    HA   LYS  15           HA       LYS  15 -11.929 -10.831   4.814
  113    HB2  LYS  15           HB2      LYS  15 -12.050 -12.123   2.088
  114    HB3  LYS  15           HB1      LYS  15 -10.751 -12.402   3.232
  115    HG2  LYS  15           HG2      LYS  15 -13.625 -12.913   3.895
  116    HG3  LYS  15           HG1      LYS  15 -12.576 -14.132   3.188
  117    HD2  LYS  15           HD2      LYS  15 -12.038 -12.695   5.773
  118    HD3  LYS  15           HD1      LYS  15 -12.750 -14.300   5.637
  119    HE2  LYS  15           HE2      LYS  15 -10.716 -15.062   4.461
  120    HE3  LYS  15           HE1      LYS  15 -10.003 -13.470   4.717
  121    HZ1  LYS  15           HZ1      LYS  15  -9.262 -15.044   6.385
  122    HZ2  LYS  15           HZ2      LYS  15 -10.855 -15.347   6.854
  123    HZ3  LYS  15           HZ3      LYS  15 -10.178 -13.819   7.099
  124    H    LYS  16           HN       LYS  16 -12.096  -9.394   1.620
  125    HA   LYS  16           HA       LYS  16  -9.658  -7.885   2.235
  126    HB2  LYS  16           HB2      LYS  16 -10.233  -9.363  -0.338
  127    HB3  LYS  16           HB1      LYS  16  -9.010  -8.110  -0.197
  128    HG2  LYS  16           HG2      LYS  16  -7.738  -9.429   1.335
  129    HG3  LYS  16           HG1      LYS  16  -9.027 -10.629   1.450
  130    HD2  LYS  16           HD2      LYS  16  -7.522 -11.609  -0.030
  131    HD3  LYS  16           HD1      LYS  16  -8.719 -10.879  -1.097
  132    HE2  LYS  16           HE2      LYS  16  -7.225  -8.916  -1.354
  133    HE3  LYS  16           HE1      LYS  16  -6.012  -9.745  -0.378
  134    HZ1  LYS  16           HZ1      LYS  16  -6.990 -10.444  -3.087
  135    HZ2  LYS  16           HZ2      LYS  16  -6.230 -11.592  -2.104
  136    HZ3  LYS  16           HZ3      LYS  16  -5.395 -10.190  -2.559
  137    H    TYR  17           HN       TYR  17  -9.502  -5.873   1.174
  138    HA   TYR  17           HA       TYR  17 -12.043  -4.626   0.586
  139    HB2  TYR  17           HB2      TYR  17  -9.184  -3.635   0.556
  140    HB3  TYR  17           HB1      TYR  17 -10.536  -2.628   0.057
  141    HD1  TYR  17           HD1      TYR  17 -12.151  -1.811   1.693
  142    HD2  TYR  17           HD2      TYR  17  -8.826  -4.180   2.864
  143    HE1  TYR  17           HE1      TYR  17 -12.497  -1.127   4.029
  144    HE2  TYR  17           HE2      TYR  17  -9.155  -3.531   5.193
  145    HH   TYR  17           HH       TYR  17 -10.242  -1.471   6.388
  146    H    GLY  18           HN       GLY  18 -10.158  -6.627  -1.079
  147    HA2  GLY  18           HA2      GLY  18 -10.748  -7.164  -3.355
  148    HA3  GLY  18           HA1      GLY  18 -10.939  -5.443  -3.638
  149    H    PHE  19           HN       PHE  19  -8.230  -6.060  -1.740
  150    HA   PHE  19           HA       PHE  19  -6.518  -6.514  -4.017
  151    HB2  PHE  19           HB2      PHE  19  -5.258  -4.526  -3.904
  152    HB3  PHE  19           HB1      PHE  19  -6.934  -4.068  -3.975
  153    HD1  PHE  19           HD1      PHE  19  -8.078  -3.327  -1.827
  154    HD2  PHE  19           HD2      PHE  19  -3.865  -3.824  -2.174
  155    HE1  PHE  19           HE1      PHE  19  -7.747  -1.898   0.153
  156    HE2  PHE  19           HE2      PHE  19  -3.527  -2.407  -0.193
  157    HZ   PHE  19           HZ       PHE  19  -5.472  -1.440   0.970
  158    H    THR  20           HN       THR  20  -4.309  -6.507  -3.562
  159    HA   THR  20           HA       THR  20  -3.689  -7.722  -0.950
  160    HB   THR  20           HB       THR  20  -2.433  -8.190  -3.666
  161    HG1  THR  20           HG1      THR  20  -3.827  -9.763  -3.741
  162   HG21  THR  20          HG21      THR  20  -0.683  -8.274  -1.953
  163   HG22  THR  20          HG22      THR  20  -1.044  -9.899  -2.541
  164   HG23  THR  20          HG23      THR  20  -1.675  -9.370  -0.981
  165    H    LEU  21           HN       LEU  21  -2.450  -6.506   0.297
  166    HA   LEU  21           HA       LEU  21  -0.916  -4.338  -0.903
  167    HB2  LEU  21           HB2      LEU  21  -2.384  -3.827   1.008
  168    HB3  LEU  21           HB1      LEU  21  -1.496  -4.968   1.995
  169    HG   LEU  21           HG       LEU  21   0.493  -3.581   1.895
  170   HD11  LEU  21          HD11      LEU  21   0.324  -2.654  -0.307
  171   HD12  LEU  21          HD12      LEU  21   0.371  -1.330   0.855
  172   HD13  LEU  21          HD13      LEU  21  -1.159  -1.801   0.114
  173   HD21  LEU  21          HD21      LEU  21  -1.980  -2.008   2.597
  174   HD22  LEU  21          HD22      LEU  21  -0.339  -1.634   3.122
  175   HD23  LEU  21          HD23      LEU  21  -1.114  -3.126   3.652
  176    H    ARG  22           HN       ARG  22   1.246  -4.407  -1.083
  177    HA   ARG  22           HA       ARG  22   2.661  -6.499   0.417
  178    HB2  ARG  22           HB2      ARG  22   2.905  -5.861  -2.517
  179    HB3  ARG  22           HB1      ARG  22   4.116  -6.771  -1.640
  180    HG2  ARG  22           HG2      ARG  22   1.958  -8.212  -0.981
  181    HG3  ARG  22           HG1      ARG  22   1.418  -7.562  -2.522
  182    HD2  ARG  22           HD2      ARG  22   2.581  -9.743  -2.723
  183    HD3  ARG  22           HD1      ARG  22   3.316  -8.454  -3.665
  184    HE   ARG  22           HE       ARG  22   4.452  -8.989  -1.029
  185   HH11  ARG  22          HH11      ARG  22   4.671  -9.321  -4.504
  186   HH12  ARG  22          HH12      ARG  22   6.331  -9.813  -4.481
  187   HH21  ARG  22          HH21      ARG  22   6.653  -9.663  -1.002
  188   HH22  ARG  22          HH22      ARG  22   7.455 -10.011  -2.504
  189    H    ALA  23           HN       ALA  23   4.460  -5.858   1.368
  190    HA   ALA  23           HA       ALA  23   5.249  -3.073   1.085
  191    HB1  ALA  23           HB1      ALA  23   6.473  -5.020   3.010
  192    HB2  ALA  23           HB2      ALA  23   4.885  -4.319   3.319
  193    HB3  ALA  23           HB3      ALA  23   6.297  -3.271   3.160
  194    H    ILE  24           HN       ILE  24   6.463  -2.853  -0.713
  195    HA   ILE  24           HA       ILE  24   8.483  -4.815  -1.385
  196    HB   ILE  24           HB       ILE  24   8.989  -3.322  -3.314
  197   HG12  ILE  24          HG12      ILE  24   6.503  -1.783  -2.607
  198   HG13  ILE  24          HG11      ILE  24   8.080  -1.253  -2.034
  199   HG21  ILE  24          HG21      ILE  24   7.424  -5.168  -3.530
  200   HG22  ILE  24          HG22      ILE  24   6.901  -3.800  -4.514
  201   HG23  ILE  24          HG23      ILE  24   6.106  -4.135  -2.977
  202   HD11  ILE  24          HD11      ILE  24   7.397  -0.094  -4.075
  203   HD12  ILE  24          HD12      ILE  24   7.315  -1.641  -4.920
  204   HD13  ILE  24          HD13      ILE  24   8.863  -1.043  -4.321
  205    H    ARG  25           HN       ARG  25  10.705  -4.408  -1.490
  206    HA   ARG  25           HA       ARG  25  11.567  -2.213   0.264
  207    HB2  ARG  25           HB2      ARG  25  11.874  -4.518   1.168
  208    HB3  ARG  25           HB1      ARG  25  12.955  -4.861  -0.176
  209    HG2  ARG  25           HG2      ARG  25  14.431  -3.042   0.593
  210    HG3  ARG  25           HG1      ARG  25  13.370  -2.806   1.984
  211    HD2  ARG  25           HD2      ARG  25  14.666  -5.445   1.342
  212    HD3  ARG  25           HD1      ARG  25  15.432  -4.230   2.365
  213    HE   ARG  25           HE       ARG  25  12.756  -5.207   3.073
  214   HH11  ARG  25          HH11      ARG  25  16.201  -5.086   3.756
  215   HH12  ARG  25          HH12      ARG  25  16.026  -5.654   5.386
  216   HH21  ARG  25          HH21      ARG  25  12.537  -5.943   5.235
  217   HH22  ARG  25          HH22      ARG  25  13.948  -6.117   6.229
  218    H    VAL  26           HN       VAL  26  12.919  -0.759  -0.507
  219    HA   VAL  26           HA       VAL  26  14.519  -1.387  -2.897
  220    HB   VAL  26           HB       VAL  26  12.926   1.142  -2.410
  221   HG11  VAL  26          HG11      VAL  26  15.163   1.656  -3.301
  222   HG12  VAL  26          HG12      VAL  26  13.886   2.017  -4.461
  223   HG13  VAL  26          HG13      VAL  26  14.862   0.562  -4.650
  224   HG21  VAL  26          HG21      VAL  26  12.815  -0.910  -4.614
  225   HG22  VAL  26          HG22      VAL  26  11.862   0.573  -4.549
  226   HG23  VAL  26          HG23      VAL  26  11.619  -0.684  -3.337
  227    H    TYR  27           HN       TYR  27  16.540  -1.385  -2.154
  228    HA   TYR  27           HA       TYR  27  17.328   0.074   0.152
  229    HB2  TYR  27           HB2      TYR  27  18.721  -1.611  -1.841
  230    HB3  TYR  27           HB1      TYR  27  19.688  -0.565  -0.831
  231    HD1  TYR  27           HD2      TYR  27  17.059  -3.179  -0.634
  232    HD2  TYR  27           HD1      TYR  27  20.320  -1.266   1.307
  233    HE1  TYR  27           HE2      TYR  27  16.936  -4.829   1.180
  234    HE2  TYR  27           HE1      TYR  27  20.202  -2.910   3.131
  235    HH   TYR  27           HH       TYR  27  18.936  -4.535   4.069
  236    H    MET  28           HN       MET  28  18.407   1.877   0.398
  237    HA   MET  28           HA       MET  28  18.420   3.800  -1.735
  238    HB2  MET  28           HB2      MET  28  19.110   3.878   1.192
  239    HB3  MET  28           HB1      MET  28  19.405   5.241   0.143
  240    HG2  MET  28           HG2      MET  28  16.748   3.967   0.699
  241    HG3  MET  28           HG1      MET  28  17.336   5.486   1.364
  242    HE1  MET  28           HE1      MET  28  17.632   7.693   0.016
  243    HE2  MET  28           HE2      MET  28  17.406   7.838  -1.726
  244    HE3  MET  28           HE3      MET  28  18.749   6.890  -1.086
  245    H    GLY  29           HN       GLY  29  20.193   4.622  -2.756
  246    HA2  GLY  29           HA2      GLY  29  22.601   3.040  -2.706
  247    HA3  GLY  29           HA1      GLY  29  22.292   4.447  -3.717
  248    H    ASP  30           HN       ASP  30  22.963   3.533  -0.361
  249    HA   ASP  30           HA       ASP  30  24.942   5.632  -0.155
  250    HB2  ASP  30           HB2      ASP  30  23.034   6.955   0.414
  251    HB3  ASP  30           HB1      ASP  30  22.392   5.694   1.459
  252    H    SER  31           HN       SER  31  22.960   3.509   1.922
  253    HA   SER  31           HA       SER  31  25.423   2.276   2.899
  254    HB2  SER  31           HB2      SER  31  24.654   4.187   4.409
  255    HB3  SER  31           HB1      SER  31  23.256   3.187   4.795
  256    HG   SER  31           HG       SER  31  25.956   2.828   5.454
  257    H    ASP  32           HN       ASP  32  23.716   1.050   5.069
  258    HA   ASP  32           HA       ASP  32  22.761  -1.203   3.476
  259    HB2  ASP  32           HB2      ASP  32  22.646  -2.407   5.530
  260    HB3  ASP  32           HB1      ASP  32  24.171  -1.535   5.544
  261    H    VAL  33           HN       VAL  33  21.667   1.581   4.779
  262    HA   VAL  33           HA       VAL  33  19.130   1.022   5.753
  263    HB   VAL  33           HB       VAL  33  20.103   3.199   6.044
  264   HG11  VAL  33          HG11      VAL  33  20.334   4.785   4.185
  265   HG12  VAL  33          HG12      VAL  33  19.859   3.509   3.064
  266   HG13  VAL  33          HG13      VAL  33  21.359   3.365   3.981
  267   HG21  VAL  33          HG21      VAL  33  18.241   4.623   5.489
  268   HG22  VAL  33          HG22      VAL  33  17.662   3.048   6.027
  269   HG23  VAL  33          HG23      VAL  33  17.664   3.447   4.308
  270    H    TYR  34           HN       TYR  34  17.133   1.016   4.830
  271    HA   TYR  34           HA       TYR  34  16.998   0.810   1.911
  272    HB2  TYR  34           HB2      TYR  34  15.391  -1.089   2.154
  273    HB3  TYR  34           HB1      TYR  34  17.041  -1.477   2.613
  274    HD1  TYR  34           HD2      TYR  34  13.612  -0.971   3.827
  275    HD2  TYR  34           HD1      TYR  34  17.602  -1.958   4.932
  276    HE1  TYR  34           HE2      TYR  34  12.802  -1.807   5.992
  277    HE2  TYR  34           HE1      TYR  34  16.798  -2.798   7.099
  278    HH   TYR  34           HH       TYR  34  14.852  -2.470   8.598
  279    H    THR  35           HN       THR  35  14.762   0.814   1.136
  280    HA   THR  35           HA       THR  35  13.088   2.598   2.773
  281    HB   THR  35           HB       THR  35  12.856   2.664  -0.185
  282    HG1  THR  35           HG1      THR  35  15.072   2.731  -0.031
  283   HG21  THR  35          HG21      THR  35  11.497   4.072   1.383
  284   HG22  THR  35          HG22      THR  35  12.414   4.998   0.197
  285   HG23  THR  35          HG23      THR  35  12.991   4.881   1.858
  286    H    VAL  36           HN       VAL  36  11.318   1.547   3.391
  287    HA   VAL  36           HA       VAL  36  10.327  -0.659   1.752
  288    HB   VAL  36           HB       VAL  36  10.524  -1.351   3.998
  289   HG11  VAL  36          HG11      VAL  36   9.499  -0.101   5.893
  290   HG12  VAL  36          HG12      VAL  36   9.170   1.223   4.774
  291   HG13  VAL  36          HG13      VAL  36  10.834   0.739   5.104
  292   HG21  VAL  36          HG21      VAL  36   8.244  -1.826   4.706
  293   HG22  VAL  36          HG22      VAL  36   8.409  -2.011   2.960
  294   HG23  VAL  36          HG23      VAL  36   7.634  -0.574   3.624
  295    H    HIS  37           HN       HIS  37   8.781  -0.286   0.354
  296    HA   HIS  37           HA       HIS  37   7.017   2.026   0.781
  297    HB2  HIS  37           HB2      HIS  37   7.680   0.605  -1.798
  298    HB3  HIS  37           HB1      HIS  37   6.636   1.998  -1.637
  299    HD2  HIS  37           HD2      HIS  37  10.396   1.101  -1.788
  300    HE1  HIS  37           HE1      HIS  37  10.007   5.312  -1.612
  301    HE2  HIS  37           HE2      HIS  37  11.570   3.389  -2.144
  302    H    HIS  38           HN       HIS  38   4.839   1.798   0.590
  303    HA   HIS  38           HA       HIS  38   3.854  -0.954   0.755
  304    HB2  HIS  38           HB2      HIS  38   2.464   1.629   1.514
  305    HB3  HIS  38           HB1      HIS  38   1.846   0.003   1.784
  306    HD2  HIS  38           HD2      HIS  38   3.944   2.631   3.521
  307    HE1  HIS  38           HE1      HIS  38   4.633  -1.017   5.553
  308    HE2  HIS  38           HE2      HIS  38   5.141   1.462   5.510
  309    H    MET  39           HN       MET  39   3.467  -1.675  -1.233
  310    HA   MET  39           HA       MET  39   1.887   0.050  -3.024
  311    HB2  MET  39           HB2      MET  39   4.035  -0.167  -4.004
  312    HB3  MET  39           HB1      MET  39   4.120  -1.883  -3.631
  313    HG2  MET  39           HG2      MET  39   1.847  -1.275  -5.311
  314    HG3  MET  39           HG1      MET  39   3.357  -0.731  -6.035
  315    HE1  MET  39           HE1      MET  39   5.218  -3.829  -7.005
  316    HE2  MET  39           HE2      MET  39   5.532  -2.379  -6.046
  317    HE3  MET  39           HE3      MET  39   4.660  -2.256  -7.578
  318    H    VAL  40           HN       VAL  40   0.068  -0.733  -3.841
  319    HA   VAL  40           HA       VAL  40  -0.988  -3.219  -2.949
  320    HB   VAL  40           HB       VAL  40  -2.686  -1.692  -3.358
  321   HG11  VAL  40          HG11      VAL  40  -2.820  -0.310  -5.443
  322   HG12  VAL  40          HG12      VAL  40  -1.204  -0.892  -5.851
  323   HG13  VAL  40          HG13      VAL  40  -1.457   0.060  -4.387
  324   HG21  VAL  40          HG21      VAL  40  -2.410  -3.562  -5.646
  325   HG22  VAL  40          HG22      VAL  40  -3.663  -2.320  -5.728
  326   HG23  VAL  40          HG23      VAL  40  -3.649  -3.481  -4.396
  327    H    TRP  41           HN       TRP  41  -0.464  -5.130  -3.749
  328    HA   TRP  41           HA       TRP  41   1.193  -5.292  -6.100
  329    HB2  TRP  41           HB2      TRP  41   1.732  -6.556  -4.081
  330    HB3  TRP  41           HB1      TRP  41   0.215  -7.446  -4.222
  331    HD1  TRP  41           HD1      TRP  41   0.325  -9.642  -5.577
  332    HE1  TRP  41           HE1      TRP  41   2.080 -10.767  -7.092
  333    HE3  TRP  41           HE3      TRP  41   3.723  -5.833  -5.843
  334    HZ2  TRP  41           HZ2      TRP  41   4.575 -10.118  -8.245
  335    HZ3  TRP  41           HZ3      TRP  41   5.773  -6.166  -7.169
  336    HH2  TRP  41           HH2      TRP  41   6.190  -8.266  -8.344
  337    H    HIS  42           HN       HIS  42  -2.084  -6.221  -5.217
  338    HA   HIS  42           HA       HIS  42  -2.689  -6.619  -8.036
  339    HB2  HIS  42           HB2      HIS  42  -1.851  -8.839  -7.176
  340    HB3  HIS  42           HB1      HIS  42  -3.165  -8.842  -6.013
  341    HD2  HIS  42           HD2      HIS  42  -2.439  -9.831  -9.624
  342    HE1  HIS  42           HE1      HIS  42  -6.605 -10.207  -9.003
  343    HE2  HIS  42           HE2      HIS  42  -4.696 -10.631 -10.619
  344    H    VAL  43           HN       VAL  43  -4.901  -6.573  -8.481
  345    HA   VAL  43           HA       VAL  43  -6.668  -5.856  -6.244
  346    HB   VAL  43           HB       VAL  43  -6.706  -4.547  -8.974
  347   HG11  VAL  43          HG11      VAL  43  -8.329  -3.010  -7.917
  348   HG12  VAL  43          HG12      VAL  43  -8.313  -4.028  -6.477
  349   HG13  VAL  43          HG13      VAL  43  -8.908  -4.672  -8.006
  350   HG21  VAL  43          HG21      VAL  43  -5.928  -2.524  -7.872
  351   HG22  VAL  43          HG22      VAL  43  -4.758  -3.829  -7.663
  352   HG23  VAL  43          HG23      VAL  43  -5.828  -3.381  -6.334
  353    H    GLU  44           HN       GLU  44  -8.381  -7.166  -6.157
  354    HA   GLU  44           HA       GLU  44  -8.868  -9.244  -7.916
  355    HB2  GLU  44           HB2      GLU  44 -10.857  -7.948  -6.056
  356    HB3  GLU  44           HB1      GLU  44 -10.847  -9.593  -6.629
  357    HG2  GLU  44           HG2      GLU  44  -8.753  -8.412  -4.842
  358    HG3  GLU  44           HG1      GLU  44 -10.124  -9.371  -4.291
  359    H    ASP  45           HN       ASP  45  -9.964  -9.394  -9.768
  360    HA   ASP  45           HA       ASP  45 -10.879  -7.132 -11.165
  361    HB2  ASP  45           HB2      ASP  45 -11.322 -10.087 -11.614
  362    HB3  ASP  45           HB1      ASP  45 -11.953  -8.860 -12.707
  363    H    GLY  46           HN       GLY  46 -12.648  -5.982 -10.790
  364    HA2  GLY  46           HA2      GLY  46 -14.917  -5.560 -10.512
  365    HA3  GLY  46           HA1      GLY  46 -15.181  -7.290 -10.330
  366    H    GLY  47           HN       GLY  47 -12.676  -6.156  -8.375
  367    HA2  GLY  47           HA2      GLY  47 -14.253  -6.605  -5.997
  368    HA3  GLY  47           HA1      GLY  47 -12.530  -6.261  -6.062
  369    HA   PRO  48           HA       PRO  48 -15.206  -2.545  -4.587
  370    HB2  PRO  48           HB2      PRO  48 -13.297  -2.945  -2.330
  371    HB3  PRO  48           HB1      PRO  48 -15.001  -2.468  -2.271
  372    HG2  PRO  48           HG2      PRO  48 -14.345  -4.894  -1.598
  373    HG3  PRO  48           HG1      PRO  48 -15.683  -4.655  -2.730
  374    HD2  PRO  48           HD2      PRO  48 -12.855  -5.395  -3.344
  375    HD3  PRO  48           HD1      PRO  48 -14.350  -6.142  -3.903
  376    H    ALA  49           HN       ALA  49 -11.818  -3.228  -3.927
  377    HA   ALA  49           HA       ALA  49 -10.891  -0.589  -4.119
  378    HB1  ALA  49           HB1      ALA  49  -9.368  -3.132  -4.716
  379    HB2  ALA  49           HB2      ALA  49  -9.536  -2.372  -3.133
  380    HB3  ALA  49           HB3      ALA  49  -8.649  -1.551  -4.418
  381    H    SER  50           HN       SER  50 -11.332  -3.044  -6.572
  382    HA   SER  50           HA       SER  50 -10.058  -1.712  -8.707
  383    HB2  SER  50           HB2      SER  50 -11.091  -4.171  -8.394
  384    HB3  SER  50           HB1      SER  50 -12.443  -3.409  -9.231
  385    HG   SER  50           HG       SER  50 -11.235  -3.151 -10.999
  386    H    GLU  51           HN       GLU  51 -13.259  -1.656  -7.346
  387    HA   GLU  51           HA       GLU  51 -14.394  -0.004  -9.413
  388    HB2  GLU  51           HB2      GLU  51 -15.480  -0.728  -6.688
  389    HB3  GLU  51           HB1      GLU  51 -16.398   0.013  -7.998
  390    HG2  GLU  51           HG2      GLU  51 -15.554  -2.121  -9.306
  391    HG3  GLU  51           HG1      GLU  51 -15.454  -2.781  -7.676
  392    H    ALA  52           HN       ALA  52 -12.718   0.461  -6.488
  393    HA   ALA  52           HA       ALA  52 -13.591   3.171  -6.072
  394    HB1  ALA  52           HB1      ALA  52 -11.324   1.648  -4.807
  395    HB2  ALA  52           HB2      ALA  52 -12.978   1.728  -4.192
  396    HB3  ALA  52           HB3      ALA  52 -11.986   3.188  -4.254
  397    H    GLY  53           HN       GLY  53 -11.149   1.542  -7.867
  398    HA2  GLY  53           HA2      GLY  53 -10.161   2.794  -9.700
  399    HA3  GLY  53           HA1      GLY  53 -10.026   4.146  -8.598
  400    H    LEU  54           HN       LEU  54  -9.183   1.360  -6.948
  401    HA   LEU  54           HA       LEU  54  -6.441   2.145  -6.821
  402    HB2  LEU  54           HB2      LEU  54  -8.133   0.573  -5.294
  403    HB3  LEU  54           HB1      LEU  54  -6.980  -0.573  -5.931
  404    HG   LEU  54           HG       LEU  54  -6.543   1.703  -4.044
  405   HD11  LEU  54          HD11      LEU  54  -5.364   0.082  -2.769
  406   HD12  LEU  54          HD12      LEU  54  -5.367  -1.061  -4.113
  407   HD13  LEU  54          HD13      LEU  54  -6.881  -0.661  -3.296
  408   HD21  LEU  54          HD21      LEU  54  -4.924   2.282  -5.637
  409   HD22  LEU  54          HD22      LEU  54  -4.523   0.598  -5.964
  410   HD23  LEU  54          HD23      LEU  54  -4.062   1.333  -4.428
  411    H    ARG  55           HN       ARG  55  -4.757   1.429  -7.870
  412    HA   ARG  55           HA       ARG  55  -5.084  -0.793  -9.778
  413    HB2  ARG  55           HB2      ARG  55  -3.247   1.573 -10.148
  414    HB3  ARG  55           HB1      ARG  55  -3.698   0.363 -11.345
  415    HG2  ARG  55           HG2      ARG  55  -5.769   2.117 -10.098
  416    HG3  ARG  55           HG1      ARG  55  -4.788   2.695 -11.440
  417    HD2  ARG  55           HD2      ARG  55  -5.633   1.076 -12.904
  418    HD3  ARG  55           HD1      ARG  55  -6.233   0.077 -11.584
  419    HE   ARG  55           HE       ARG  55  -7.421   2.692 -12.247
  420   HH11  ARG  55          HH11      ARG  55  -7.723  -0.719 -11.495
  421   HH12  ARG  55          HH12      ARG  55  -9.457  -0.695 -11.493
  422   HH21  ARG  55          HH21      ARG  55  -9.701   2.731 -12.225
  423   HH22  ARG  55          HH22      ARG  55 -10.587   1.276 -11.890
  424    H    GLN  56           HN       GLN  56  -3.543  -2.356  -9.747
  425    HA   GLN  56           HA       GLN  56  -1.745  -2.402  -7.547
  426    HB2  GLN  56           HB2      GLN  56  -0.881  -4.486  -9.056
  427    HB3  GLN  56           HB1      GLN  56  -2.173  -4.560  -7.880
  428    HG2  GLN  56           HG2      GLN  56  -3.776  -4.749  -9.425
  429    HG3  GLN  56           HG1      GLN  56  -2.908  -3.776 -10.583
  430   HE21  GLN  56          HE21      GLN  56  -1.370  -4.713 -11.921
  431   HE22  GLN  56          HE22      GLN  56  -1.273  -6.425 -12.135
  432    H    GLY  57           HN       GLY  57   0.313  -1.877  -7.397
  433    HA2  GLY  57           HA2      GLY  57   2.532  -1.768  -8.305
  434    HA3  GLY  57           HA1      GLY  57   1.835  -1.404  -9.871
  435    H    ASP  58           HN       ASP  58   0.213   0.301  -7.490
  436    HA   ASP  58           HA       ASP  58   1.547   2.776  -8.246
  437    HB2  ASP  58           HB2      ASP  58  -0.826   2.320  -6.426
  438    HB3  ASP  58           HB1      ASP  58  -0.218   3.891  -6.916
  439    H    LEU  59           HN       LEU  59   1.107   4.261  -5.919
  440    HA   LEU  59           HA       LEU  59   2.740   2.931  -3.933
  441    HB2  LEU  59           HB2      LEU  59   3.311   5.440  -5.388
  442    HB3  LEU  59           HB1      LEU  59   3.574   5.493  -3.658
  443    HG   LEU  59           HG       LEU  59   4.904   3.649  -5.628
  444   HD11  LEU  59          HD11      LEU  59   5.749   5.944  -5.625
  445   HD12  LEU  59          HD12      LEU  59   6.935   4.822  -4.958
  446   HD13  LEU  59          HD13      LEU  59   5.994   5.853  -3.881
  447   HD21  LEU  59          HD21      LEU  59   6.268   3.023  -3.562
  448   HD22  LEU  59          HD22      LEU  59   4.649   2.336  -3.702
  449   HD23  LEU  59          HD23      LEU  59   4.936   3.705  -2.628
  450    H    ILE  60           HN       ILE  60   1.521   2.852  -2.167
  451    HA   ILE  60           HA       ILE  60  -0.580   4.784  -1.777
  452    HB   ILE  60           HB       ILE  60   0.332   2.465  -0.059
  453   HG12  ILE  60          HG12      ILE  60  -2.264   2.708  -1.575
  454   HG13  ILE  60          HG11      ILE  60  -0.808   2.088  -2.348
  455   HG21  ILE  60          HG21      ILE  60  -1.768   2.815   1.200
  456   HG22  ILE  60          HG22      ILE  60  -2.028   4.306   0.295
  457   HG23  ILE  60          HG23      ILE  60  -0.635   4.158   1.365
  458   HD11  ILE  60          HD11      ILE  60  -0.695   0.313  -0.666
  459   HD12  ILE  60          HD12      ILE  60  -2.208   0.285  -1.573
  460   HD13  ILE  60          HD13      ILE  60  -2.175   0.933   0.066
  461    H    THR  61           HN       THR  61  -0.092   6.727  -0.977
  462    HA   THR  61           HA       THR  61   2.243   6.997   0.760
  463    HB   THR  61           HB       THR  61   2.341   8.467  -1.100
  464    HG1  THR  61           HG1      THR  61   1.933   9.534   1.423
  465   HG21  THR  61          HG21      THR  61   0.613  10.118  -1.620
  466   HG22  THR  61          HG22      THR  61  -0.394   9.480  -0.320
  467   HG23  THR  61          HG23      THR  61  -0.023   8.475  -1.723
  468    H    HIS  62           HN       HIS  62  -1.246   7.357   0.838
  469    HA   HIS  62           HA       HIS  62  -1.050   7.794   3.721
  470    HB2  HIS  62           HB2      HIS  62  -2.984   9.466   2.105
  471    HB3  HIS  62           HB1      HIS  62  -2.623   9.589   3.815
  472    HD2  HIS  62           HD2      HIS  62  -0.019  10.692   4.375
  473    HE1  HIS  62           HE1      HIS  62   0.115  12.659   0.634
  474    HE2  HIS  62           HE2      HIS  62   1.280  12.354   2.861
  475    H    VAL  63           HN       VAL  63  -2.748   6.989   4.884
  476    HA   VAL  63           HA       VAL  63  -4.881   5.627   3.371
  477    HB   VAL  63           HB       VAL  63  -3.388   4.585   5.792
  478   HG11  VAL  63          HG11      VAL  63  -5.868   4.230   5.877
  479   HG12  VAL  63          HG12      VAL  63  -4.909   2.751   5.868
  480   HG13  VAL  63          HG13      VAL  63  -5.720   3.285   4.395
  481   HG21  VAL  63          HG21      VAL  63  -2.271   4.237   3.621
  482   HG22  VAL  63          HG22      VAL  63  -3.711   3.408   3.031
  483   HG23  VAL  63          HG23      VAL  63  -2.781   2.721   4.363
  484    H    ASN  64           HN       ASN  64  -6.716   6.668   3.839
  485    HA   ASN  64           HA       ASN  64  -8.381   7.715   4.972
  486    HB2  ASN  64           HB2      ASN  64  -7.094   6.425   7.397
  487    HB3  ASN  64           HB1      ASN  64  -8.668   7.215   7.392
  488   HD21  ASN  64          HD21      ASN  64  -7.642   4.408   7.809
  489   HD22  ASN  64          HD22      ASN  64  -8.654   3.439   6.804
  490    H    GLY  65           HN       GLY  65  -5.864   9.016   4.436
  491    HA2  GLY  65           HA2      GLY  65  -5.151  11.198   4.711
  492    HA3  GLY  65           HA1      GLY  65  -6.262  11.360   6.062
  493    H    GLU  66           HN       GLU  66  -4.203   8.636   6.231
  494    HA   GLU  66           HA       GLU  66  -2.621  10.004   8.295
  495    HB2  GLU  66           HB2      GLU  66  -2.919   7.035   7.906
  496    HB3  GLU  66           HB1      GLU  66  -2.283   7.864   9.318
  497    HG2  GLU  66           HG2      GLU  66  -5.091   8.339   8.461
  498    HG3  GLU  66           HG1      GLU  66  -4.680   6.863   9.319
  499    HA   PRO  67           HA       PRO  67   0.869   9.525   5.520
  500    HB2  PRO  67           HB2      PRO  67   2.508  10.218   7.851
  501    HB3  PRO  67           HB1      PRO  67   2.307  11.091   6.331
  502    HG2  PRO  67           HG2      PRO  67   1.292  12.014   8.649
  503    HG3  PRO  67           HG1      PRO  67   0.488  12.274   7.095
  504    HD2  PRO  67           HD2      PRO  67  -0.130  10.282   9.225
  505    HD3  PRO  67           HD1      PRO  67  -1.239  11.263   8.250
  506    H    VAL  68           HN       VAL  68   1.345   7.451   5.100
  507    HA   VAL  68           HA       VAL  68   2.003   5.659   7.307
  508    HB   VAL  68           HB       VAL  68   1.799   3.844   5.724
  509   HG11  VAL  68          HG11      VAL  68  -0.578   4.094   5.159
  510   HG12  VAL  68          HG12      VAL  68  -0.464   5.825   5.481
  511   HG13  VAL  68          HG13      VAL  68  -0.230   4.666   6.790
  512   HG21  VAL  68          HG21      VAL  68   1.150   4.221   3.396
  513   HG22  VAL  68          HG22      VAL  68   2.726   4.934   3.740
  514   HG23  VAL  68          HG23      VAL  68   1.296   5.961   3.633
  515    H    HIS  69           HN       HIS  69   3.705   7.725   5.481
  516    HA   HIS  69           HA       HIS  69   5.873   6.203   4.528
  517    HB2  HIS  69           HB2      HIS  69   5.412   8.542   3.838
  518    HB3  HIS  69           HB1      HIS  69   5.858   9.087   5.448
  519    HD2  HIS  69           HD2      HIS  69   8.658   8.581   6.080
  520    HE1  HIS  69           HE1      HIS  69   9.716   8.598   1.985
  521    HE2  HIS  69           HE2      HIS  69  10.598   8.558   4.362
  522    H    GLY  70           HN       GLY  70   6.828   4.809   5.894
  523    HA2  GLY  70           HA2      GLY  70   8.787   4.849   7.420
  524    HA3  GLY  70           HA1      GLY  70   7.834   5.921   8.432
  525    H    LEU  71           HN       LEU  71   5.364   4.268   7.829
  526    HA   LEU  71           HA       LEU  71   5.539   2.598  10.094
  527    HB2  LEU  71           HB2      LEU  71   3.560   2.765   7.851
  528    HB3  LEU  71           HB1      LEU  71   3.379   1.669   9.192
  529    HG   LEU  71           HG       LEU  71   3.428   4.646   9.340
  530   HD11  LEU  71          HD11      LEU  71   1.428   3.920   8.389
  531   HD12  LEU  71          HD12      LEU  71   1.076   4.275  10.083
  532   HD13  LEU  71          HD13      LEU  71   1.278   2.600   9.550
  533   HD21  LEU  71          HD21      LEU  71   2.781   4.308  11.709
  534   HD22  LEU  71          HD22      LEU  71   4.420   3.773  11.352
  535   HD23  LEU  71          HD23      LEU  71   3.123   2.590  11.514
  536    H    VAL  72           HN       VAL  72   4.948   0.350  10.106
  537    HA   VAL  72           HA       VAL  72   6.586  -1.195   8.288
  538    HB   VAL  72           HB       VAL  72   6.088  -3.077   9.757
  539   HG11  VAL  72          HG11      VAL  72   7.883  -1.577  10.446
  540   HG12  VAL  72          HG12      VAL  72   7.047  -2.231  11.852
  541   HG13  VAL  72          HG13      VAL  72   6.729  -0.579  11.328
  542   HG21  VAL  72          HG21      VAL  72   3.944  -1.256  10.691
  543   HG22  VAL  72          HG22      VAL  72   4.727  -2.268  11.917
  544   HG23  VAL  72          HG23      VAL  72   3.956  -3.018  10.520
  545    H    HIS  73           HN       HIS  73   5.454  -3.382   7.633
  546    HA   HIS  73           HA       HIS  73   3.453  -2.748   5.786
  547    HB2  HIS  73           HB2      HIS  73   4.987  -4.675   5.599
  548    HB3  HIS  73           HB1      HIS  73   4.132  -5.466   6.915
  549    HD1  HIS  73           HD1      HIS  73   2.960  -3.867   3.634
  550    HD2  HIS  73           HD2      HIS  73   2.499  -7.305   5.923
  551    HE1  HIS  73           HE1      HIS  73   1.360  -5.355   2.367
  552    H    THR  74           HN       THR  74   3.193  -4.233   8.997
  553    HA   THR  74           HA       THR  74   0.389  -4.717   8.769
  554    HB   THR  74           HB       THR  74   0.636  -4.933  11.343
  555    HG1  THR  74           HG1      THR  74   2.777  -5.199  12.012
  556   HG21  THR  74          HG21      THR  74   2.082  -6.742   9.406
  557   HG22  THR  74          HG22      THR  74   0.375  -6.821   9.839
  558   HG23  THR  74          HG23      THR  74   1.608  -7.186  11.046
  559    H    GLU  75           HN       GLU  75   2.266  -1.996  10.079
  560    HA   GLU  75           HA       GLU  75   0.253  -0.835  11.581
  561    HB2  GLU  75           HB2      GLU  75   2.561   0.436  10.120
  562    HB3  GLU  75           HB1      GLU  75   1.449   1.315  11.102
  563    HG2  GLU  75           HG2      GLU  75   2.859  -1.043  12.190
  564    HG3  GLU  75           HG1      GLU  75   3.582   0.567  12.225
  565    H    VAL  76           HN       VAL  76   1.015  -0.536   8.173
  566    HA   VAL  76           HA       VAL  76  -1.087   1.354   7.692
  567    HB   VAL  76           HB       VAL  76  -0.513   1.232   5.373
  568   HG11  VAL  76          HG11      VAL  76   1.000   2.454   6.829
  569   HG12  VAL  76          HG12      VAL  76   1.884   1.730   5.484
  570   HG13  VAL  76          HG13      VAL  76   1.955   0.997   7.088
  571   HG21  VAL  76          HG21      VAL  76   1.027  -0.379   4.437
  572   HG22  VAL  76          HG22      VAL  76  -0.321  -1.230   5.192
  573   HG23  VAL  76          HG23      VAL  76   1.239  -1.142   6.011
  574    H    VAL  77           HN       VAL  77  -0.681  -2.133   7.404
  575    HA   VAL  77           HA       VAL  77  -3.026  -2.771   6.019
  576    HB   VAL  77           HB       VAL  77  -1.310  -4.251   7.997
  577   HG11  VAL  77          HG11      VAL  77  -3.639  -4.960   8.439
  578   HG12  VAL  77          HG12      VAL  77  -2.629  -6.248   7.786
  579   HG13  VAL  77          HG13      VAL  77  -3.792  -5.426   6.743
  580   HG21  VAL  77          HG21      VAL  77  -0.887  -5.693   6.070
  581   HG22  VAL  77          HG22      VAL  77  -0.543  -4.006   5.693
  582   HG23  VAL  77          HG23      VAL  77  -2.029  -4.754   5.107
  583    H    GLU  78           HN       GLU  78  -2.434  -2.540   9.502
  584    HA   GLU  78           HA       GLU  78  -5.063  -2.995  10.338
  585    HB2  GLU  78           HB2      GLU  78  -2.954  -1.350  11.624
  586    HB3  GLU  78           HB1      GLU  78  -4.379  -1.969  12.422
  587    HG2  GLU  78           HG2      GLU  78  -3.602  -4.222  11.690
  588    HG3  GLU  78           HG1      GLU  78  -2.062  -3.480  11.331
  589    H    LEU  79           HN       LEU  79  -3.274  -0.069   9.819
  590    HA   LEU  79           HA       LEU  79  -5.064   1.904  10.364
  591    HB2  LEU  79           HB2      LEU  79  -2.693   1.725   8.933
  592    HB3  LEU  79           HB1      LEU  79  -3.832   2.388   7.776
  593    HG   LEU  79           HG       LEU  79  -4.401   4.095   9.626
  594   HD11  LEU  79          HD11      LEU  79  -3.278   2.989  11.459
  595   HD12  LEU  79          HD12      LEU  79  -2.515   4.550  11.147
  596   HD13  LEU  79          HD13      LEU  79  -1.743   3.063  10.596
  597   HD21  LEU  79          HD21      LEU  79  -2.110   3.934   7.783
  598   HD22  LEU  79          HD22      LEU  79  -2.038   5.213   8.997
  599   HD23  LEU  79          HD23      LEU  79  -3.407   5.129   7.885
  600    H    ILE  80           HN       ILE  80  -4.774   0.342   7.146
  601    HA   ILE  80           HA       ILE  80  -7.005   1.375   5.924
  602    HB   ILE  80           HB       ILE  80  -5.812  -1.384   5.745
  603   HG12  ILE  80          HG12      ILE  80  -5.383   0.809   3.782
  604   HG13  ILE  80          HG11      ILE  80  -4.501   0.837   5.292
  605   HG21  ILE  80          HG21      ILE  80  -7.732   0.017   3.906
  606   HG22  ILE  80          HG22      ILE  80  -7.994  -1.474   4.814
  607   HG23  ILE  80          HG23      ILE  80  -6.833  -1.442   3.484
  608   HD11  ILE  80          HD11      ILE  80  -3.470  -1.212   4.845
  609   HD12  ILE  80          HD12      ILE  80  -3.311  -0.234   3.382
  610   HD13  ILE  80          HD13      ILE  80  -4.512  -1.527   3.458
  611    H    LEU  81           HN       LEU  81  -6.767  -1.711   7.657
  612    HA   LEU  81           HA       LEU  81  -9.407  -2.494   7.597
  613    HB2  LEU  81           HB2      LEU  81  -7.272  -2.906   9.665
  614    HB3  LEU  81           HB1      LEU  81  -8.847  -3.662   9.799
  615    HG   LEU  81           HG       LEU  81  -7.109  -4.024   7.370
  616   HD11  LEU  81          HD11      LEU  81  -6.392  -6.155   8.360
  617   HD12  LEU  81          HD12      LEU  81  -7.179  -5.704   9.872
  618   HD13  LEU  81          HD13      LEU  81  -5.812  -4.763   9.275
  619   HD21  LEU  81          HD21      LEU  81  -8.472  -6.021   7.063
  620   HD22  LEU  81          HD22      LEU  81  -9.483  -4.580   7.142
  621   HD23  LEU  81          HD23      LEU  81  -9.366  -5.652   8.537
  622    H    LYS  82           HN       LYS  82  -7.886  -0.326   9.968
  623    HA   LYS  82           HA       LYS  82 -10.095  -0.109  11.664
  624    HB2  LYS  82           HB2      LYS  82  -7.777   1.742  11.239
  625    HB3  LYS  82           HB1      LYS  82  -8.930   1.874  12.567
  626    HG2  LYS  82           HG2      LYS  82  -8.345  -0.564  13.036
  627    HG3  LYS  82           HG1      LYS  82  -6.964  -0.279  12.004
  628    HD2  LYS  82           HD2      LYS  82  -7.556   1.582  14.268
  629    HD3  LYS  82           HD1      LYS  82  -6.721   0.060  14.570
  630    HE2  LYS  82           HE2      LYS  82  -5.021   0.718  12.884
  631    HE3  LYS  82           HE1      LYS  82  -5.830   2.278  12.729
  632    HZ1  LYS  82           HZ1      LYS  82  -5.364   2.758  15.015
  633    HZ2  LYS  82           HZ2      LYS  82  -3.919   2.319  14.258
  634    HZ3  LYS  82           HZ3      LYS  82  -4.712   1.218  15.264
  635    H    SER  83           HN       SER  83  -9.789   1.172   8.555
  636    HA   SER  83           HA       SER  83 -10.895   3.684   8.679
  637    HB2  SER  83           HB2      SER  83 -11.792   3.211   6.401
  638    HB3  SER  83           HB1      SER  83 -10.102   2.753   6.598
  639    HG   SER  83           HG       SER  83 -10.608   0.697   6.421
  640    H    GLY  84           HN       GLY  84 -12.794   0.732   8.030
  641    HA2  GLY  84           HA2      GLY  84 -14.811   0.151   9.122
  642    HA3  GLY  84           HA1      GLY  84 -14.960   1.812   9.678
  643    H    ASN  85           HN       ASN  85 -15.846  -0.462   7.341
  644    HA   ASN  85           HA       ASN  85 -17.444  -0.444   5.733
  645    HB2  ASN  85           HB2      ASN  85 -18.918   1.010   6.811
  646    HB3  ASN  85           HB1      ASN  85 -17.798   2.364   6.734
  647   HD21  ASN  85          HD21      ASN  85 -19.564   0.199   4.524
  648   HD22  ASN  85          HD22      ASN  85 -19.994   1.438   3.407
  649    H    LYS  86           HN       LYS  86 -15.308   2.402   5.547
  650    HA   LYS  86           HA       LYS  86 -14.470   1.550   2.937
  651    HB2  LYS  86           HB2      LYS  86 -14.792   3.778   1.953
  652    HB3  LYS  86           HB1      LYS  86 -16.280   2.946   2.315
  653    HG2  LYS  86           HG2      LYS  86 -16.177   4.256   4.544
  654    HG3  LYS  86           HG1      LYS  86 -15.065   5.281   3.645
  655    HD2  LYS  86           HD2      LYS  86 -16.897   5.361   1.857
  656    HD3  LYS  86           HD1      LYS  86 -17.953   4.730   3.122
  657    HE2  LYS  86           HE2      LYS  86 -17.418   6.637   4.537
  658    HE3  LYS  86           HE1      LYS  86 -16.322   7.257   3.303
  659    HZ1  LYS  86           HZ1      LYS  86 -19.222   6.837   2.861
  660    HZ2  LYS  86           HZ2      LYS  86 -18.132   7.633   1.843
  661    HZ3  LYS  86           HZ3      LYS  86 -18.548   8.316   3.330
  662    H    VAL  87           HN       VAL  87 -12.619   2.476   2.250
  663    HA   VAL  87           HA       VAL  87 -11.146   4.041   4.261
  664    HB   VAL  87           HB       VAL  87 -10.474   1.771   4.612
  665   HG11  VAL  87          HG11      VAL  87 -11.216   0.899   2.433
  666   HG12  VAL  87          HG12      VAL  87  -9.596   0.346   2.866
  667   HG13  VAL  87          HG13      VAL  87  -9.798   1.635   1.679
  668   HG21  VAL  87          HG21      VAL  87  -8.055   1.895   4.060
  669   HG22  VAL  87          HG22      VAL  87  -8.680   3.384   4.765
  670   HG23  VAL  87          HG23      VAL  87  -8.395   3.283   3.029
  671    H    ALA  88           HN       ALA  88 -10.066   5.706   3.454
  672    HA   ALA  88           HA       ALA  88  -9.998   6.043   0.551
  673    HB1  ALA  88           HB1      ALA  88 -10.904   7.908   1.763
  674    HB2  ALA  88           HB2      ALA  88  -9.352   8.374   1.061
  675    HB3  ALA  88           HB3      ALA  88  -9.465   7.990   2.782
  676    H    ILE  89           HN       ILE  89  -8.294   5.277  -0.410
  677    HA   ILE  89           HA       ILE  89  -5.711   5.336   0.985
  678    HB   ILE  89           HB       ILE  89  -6.364   3.729  -1.477
  679   HG12  ILE  89          HG12      ILE  89  -7.058   3.247   1.364
  680   HG13  ILE  89          HG11      ILE  89  -7.806   2.649  -0.101
  681   HG21  ILE  89          HG21      ILE  89  -4.070   3.855  -1.258
  682   HG22  ILE  89          HG22      ILE  89  -4.476   2.341  -0.446
  683   HG23  ILE  89          HG23      ILE  89  -4.136   3.789   0.502
  684   HD11  ILE  89          HD11      ILE  89  -6.933   0.809   1.149
  685   HD12  ILE  89          HD12      ILE  89  -5.339   1.564   1.210
  686   HD13  ILE  89          HD13      ILE  89  -5.991   1.003  -0.330
  687    H    SER  90           HN       SER  90  -4.502   7.024   0.456
  688    HA   SER  90           HA       SER  90  -4.838   8.417  -2.037
  689    HB2  SER  90           HB2      SER  90  -2.689   8.834   0.046
  690    HB3  SER  90           HB1      SER  90  -3.260   9.989  -1.156
  691    HG   SER  90           HG       SER  90  -4.438  10.604   0.503
  692    H    THR  91           HN       THR  91  -3.997   7.638  -3.846
  693    HA   THR  91           HA       THR  91  -1.543   6.060  -3.714
  694    HB   THR  91           HB       THR  91  -2.223   5.517  -6.152
  695    HG1  THR  91           HG1      THR  91  -4.528   5.715  -6.456
  696   HG21  THR  91          HG21      THR  91  -2.374   3.825  -4.479
  697   HG22  THR  91          HG22      THR  91  -3.911   3.824  -5.350
  698   HG23  THR  91          HG23      THR  91  -3.795   4.578  -3.758
  699    H    THR  92           HN       THR  92  -0.161   6.257  -5.691
  700    HA   THR  92           HA       THR  92  -0.033   8.667  -7.168
  701    HB   THR  92           HB       THR  92   0.697   9.657  -5.069
  702    HG1  THR  92           HG1      THR  92   2.598  10.524  -5.763
  703   HG21  THR  92          HG21      THR  92   1.382   7.565  -3.959
  704   HG22  THR  92          HG22      THR  92   2.583   8.849  -3.794
  705   HG23  THR  92          HG23      THR  92   2.842   7.544  -4.952
  706    HA   PRO  93           HA       PRO  93   2.272   5.997  -9.858
  707    HB2  PRO  93           HB2      PRO  93   4.268   8.196 -10.043
  708    HB3  PRO  93           HB1      PRO  93   3.494   7.284 -11.336
  709    HG2  PRO  93           HG2      PRO  93   2.689   9.751 -10.784
  710    HG3  PRO  93           HG1      PRO  93   1.506   8.489 -11.173
  711    HD2  PRO  93           HD2      PRO  93   2.191   9.694  -8.533
  712    HD3  PRO  93           HD1      PRO  93   0.629   9.112  -9.138
  713    H    LEU  94           HN       LEU  94   4.005   4.640  -9.886
  714    HA   LEU  94           HA       LEU  94   5.834   4.832  -7.593
  715    HB2  LEU  94           HB2      LEU  94   4.551   2.839  -7.387
  716    HB3  LEU  94           HB1      LEU  94   4.745   2.451  -9.088
  717    HG   LEU  94           HG       LEU  94   7.124   1.945  -8.716
  718   HD11  LEU  94          HD11      LEU  94   7.480   3.485  -6.816
  719   HD12  LEU  94          HD12      LEU  94   8.070   1.854  -6.504
  720   HD13  LEU  94          HD13      LEU  94   6.551   2.392  -5.788
  721   HD21  LEU  94          HD21      LEU  94   6.795  -0.092  -7.362
  722   HD22  LEU  94          HD22      LEU  94   5.524   0.140  -8.563
  723   HD23  LEU  94          HD23      LEU  94   5.214   0.515  -6.867
  724    H    GLU  95           HN       GLU  95   6.753   6.430  -9.200
  725    HA   GLU  95           HA       GLU  95   8.217   5.345 -11.417
  726    HB2  GLU  95           HB2      GLU  95   8.671   8.028 -10.171
  727    HB3  GLU  95           HB1      GLU  95   8.946   7.549 -11.831
  728    HG2  GLU  95           HG2      GLU  95   6.183   7.557 -10.676
  729    HG3  GLU  95           HG1      GLU  95   6.915   9.028 -11.317
  730    H    ASN  96           HN       ASN  96  10.036   4.332 -11.227
  731    HA   ASN  96           HA       ASN  96  11.979   5.095  -9.186
  732    HB2  ASN  96           HB2      ASN  96  10.639   3.228  -8.244
  733    HB3  ASN  96           HB1      ASN  96  11.085   2.233  -9.625
  734   HD21  ASN  96          HD21      ASN  96  13.122   1.355  -9.731
  735   HD22  ASN  96          HD22      ASN  96  14.238   1.402  -8.408
  736    H2   PRO  97           HT1      PRO  97  15.400  -5.586  -6.201
  737    H3   PRO  97           HT2      PRO  97  16.210  -5.158  -4.844
  738    HA   PRO  97           HA       PRO  97  14.629  -3.876  -4.359
  739    HB2  PRO  97           HB2      PRO  97  14.698  -2.030  -6.599
  740    HB3  PRO  97           HB1      PRO  97  15.181  -1.765  -4.917
  741    HG2  PRO  97           HG2      PRO  97  16.967  -1.929  -6.957
  742    HG3  PRO  97           HG1      PRO  97  17.341  -2.422  -5.295
  743    HD2  PRO  97           HD2      PRO  97  16.578  -4.124  -7.650
  744    HD3  PRO  97           HD1      PRO  97  17.847  -4.393  -6.442
  745    H    PHE  98           HN       PHE  98  12.601  -2.631  -5.267
  746    HA   PHE  98           HA       PHE  98  10.549  -2.712  -6.195
  747    HB2  PHE  98           HB2      PHE  98  12.002  -2.567  -8.311
  748    HB3  PHE  98           HB1      PHE  98  11.663  -4.284  -8.508
  749    HD1  PHE  98           HD2      PHE  98  10.104  -0.945  -8.287
  750    HD2  PHE  98           HD1      PHE  98   9.607  -5.023  -9.389
  751    HE1  PHE  98           HE2      PHE  98   7.979  -0.381  -9.390
  752    HE2  PHE  98           HE1      PHE  98   7.482  -4.469 -10.498
  753    HZ   PHE  98           HZ       PHE  98   6.664  -2.147 -10.501
  754    H    ASP  99           HN       ASP  99  11.588  -5.793  -7.596
  755    HA   ASP  99           HA       ASP  99   9.259  -7.140  -6.684
  756    HB2  ASP  99           HB2      ASP  99  11.530  -7.724  -8.369
  757    HB3  ASP  99           HB1      ASP  99  11.210  -9.076  -7.287
  758    H    GLU 100           HN       GLU 100  12.639  -7.183  -5.684
  759    HA   GLU 100           HA       GLU 100  11.958  -7.759  -2.968
  760    HB2  GLU 100           HB2      GLU 100  12.262  -9.985  -4.606
  761    HB3  GLU 100           HB1      GLU 100  13.840  -9.811  -3.853
  762    HG2  GLU 100           HG2      GLU 100  11.259  -9.892  -2.315
  763    HG3  GLU 100           HG1      GLU 100  12.253 -11.310  -2.648
  764    H    ASP 101           HN       ASP 101  13.939  -7.766  -1.604
  765    HA   ASP 101           HA       ASP 101  16.363  -6.829  -2.906
  766    HB2  ASP 101           HB2      ASP 101  14.516  -4.944  -1.988
  767    HB3  ASP 101           HB1      ASP 101  15.755  -5.008  -0.737
  768    H    GLN 102           HN       GLN 102  14.661  -8.055  -0.170
  769    HA   GLN 102           HA       GLN 102  16.850  -9.412   0.900
  770    HB2  GLN 102           HB2      GLN 102  17.507  -7.025   1.495
  771    HB3  GLN 102           HB1      GLN 102  16.133  -7.016   2.592
  772    HG2  GLN 102           HG2      GLN 102  18.255  -7.502   3.725
  773    HG3  GLN 102           HG1      GLN 102  17.089  -8.817   3.878
  774   HE21  GLN 102          HE21      GLN 102  20.066  -7.777   2.408
  775   HE22  GLN 102          HE22      GLN 102  20.600  -9.343   1.907
  776    H    HIS 103           HN       HIS 103  13.940  -7.645   1.840
  777    HA   HIS 103           HA       HIS 103  12.615 -10.062   2.642
  778    HB2  HIS 103           HB2      HIS 103  14.019  -9.399   4.644
  779    HB3  HIS 103           HB1      HIS 103  13.058  -7.930   4.742
  780    HD2  HIS 103           HD2      HIS 103  11.679 -11.594   4.281
  781    HE1  HIS 103           HE1      HIS 103  10.163  -9.910   7.853
  782    HE2  HIS 103           HE2      HIS 103  10.203 -11.971   6.380
  783    H    THR 104           HN       THR 104  10.697  -9.803   1.753
  784    HA   THR 104           HA       THR 104   9.437  -7.138   1.813
  785    HB   THR 104           HB       THR 104   8.179  -8.231  -0.269
  786    HG1  THR 104           HG1      THR 104  10.791  -9.332  -0.518
  787   HG21  THR 104          HG21      THR 104   9.516  -6.122  -0.227
  788   HG22  THR 104          HG22      THR 104   9.665  -7.027  -1.734
  789   HG23  THR 104          HG23      THR 104  10.961  -7.084  -0.538
  790    H    GLN 105           HN       GLN 105   7.091  -7.141   1.959
  791    HA   GLN 105           HA       GLN 105   6.080  -9.576   3.280
  792    HB2  GLN 105           HB2      GLN 105   5.839  -6.708   3.957
  793    HB3  GLN 105           HB1      GLN 105   4.396  -7.681   4.190
  794    HG2  GLN 105           HG2      GLN 105   5.405  -7.785   6.246
  795    HG3  GLN 105           HG1      GLN 105   5.965  -9.271   5.483
  796   HE21  GLN 105          HE21      GLN 105   8.109  -9.506   4.993
  797   HE22  GLN 105          HE22      GLN 105   9.324  -8.396   5.525
  798    H    ILE 106           HN       ILE 106   3.711  -9.840   3.187
  799    HA   ILE 106           HA       ILE 106   2.261  -8.576   1.048
  800    HB   ILE 106           HB       ILE 106   3.311 -10.133  -0.381
  801   HG12  ILE 106          HG12      ILE 106   0.683 -11.356   0.490
  802   HG13  ILE 106          HG11      ILE 106   0.882 -10.057  -0.679
  803   HG21  ILE 106          HG21      ILE 106   3.621 -12.474   0.066
  804   HG22  ILE 106          HG22      ILE 106   2.736 -12.337   1.586
  805   HG23  ILE 106          HG23      ILE 106   4.292 -11.531   1.397
  806   HD11  ILE 106          HD11      ILE 106   1.771 -12.916  -0.974
  807   HD12  ILE 106          HD12      ILE 106   2.155 -11.631  -2.117
  808   HD13  ILE 106          HD13      ILE 106   0.477 -12.099  -1.850
  809    H    THR 107           HN       THR 107   0.307  -8.264   1.906
  810    HA   THR 107           HA       THR 107  -0.936 -10.444   3.408
  811    HB   THR 107           HB       THR 107  -0.690  -7.616   4.463
  812    HG1  THR 107           HG1      THR 107   1.181  -8.756   4.878
  813   HG21  THR 107          HG21      THR 107  -1.886  -8.440   6.433
  814   HG22  THR 107          HG22      THR 107  -2.076 -10.017   5.669
  815   HG23  THR 107          HG23      THR 107  -2.879  -8.605   4.986
  816    H    LYS 108           HN       LYS 108  -3.013 -10.672   3.068
  817    HA   LYS 108           HA       LYS 108  -4.335  -9.042   1.098
  818    HB2  LYS 108           HB2      LYS 108  -5.475 -11.275   2.791
  819    HB3  LYS 108           HB1      LYS 108  -6.124 -10.670   1.280
  820    HG2  LYS 108           HG2      LYS 108  -4.240 -11.561   0.063
  821    HG3  LYS 108           HG1      LYS 108  -3.477 -12.067   1.572
  822    HD2  LYS 108           HD2      LYS 108  -5.670 -13.397   1.946
  823    HD3  LYS 108           HD1      LYS 108  -5.900 -13.184   0.209
  824    HE2  LYS 108           HE2      LYS 108  -4.809 -15.295   0.615
  825    HE3  LYS 108           HE1      LYS 108  -3.675 -14.192  -0.165
  826    HZ1  LYS 108           HZ1      LYS 108  -2.654 -15.413   1.665
  827    HZ2  LYS 108           HZ2      LYS 108  -3.775 -14.763   2.748
  828    HZ3  LYS 108           HZ3      LYS 108  -2.666 -13.754   1.977
  829    H    VAL 109           HN       VAL 109  -5.718  -7.331   1.554
  830    HA   VAL 109           HA       VAL 109  -6.635  -7.164   4.336
  831    HB   VAL 109           HB       VAL 109  -4.732  -5.665   4.137
  832   HG11  VAL 109          HG11      VAL 109  -4.885  -5.327   1.685
  833   HG12  VAL 109          HG12      VAL 109  -4.628  -3.839   2.597
  834   HG13  VAL 109          HG13      VAL 109  -6.230  -4.221   1.961
  835   HG21  VAL 109          HG21      VAL 109  -7.276  -4.055   4.165
  836   HG22  VAL 109          HG22      VAL 109  -5.742  -3.638   4.926
  837   HG23  VAL 109          HG23      VAL 109  -6.678  -5.009   5.521
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1   3.757  21.555   0.905
    2    H2   GLY   1           HT2      GLY   1   4.285  21.997  -0.639
    3    H3   GLY   1           HT3      GLY   1   4.856  20.573   0.074
    4    HA2  GLY   1           HA1      GLY   1   2.048  21.089  -0.705
    5    HA3  GLY   1           HA2      GLY   1   3.190  20.123  -1.625
    6    H    GLY   2           HN       GLY   2   0.600  19.487  -0.277
    7    HA2  GLY   2           HA2      GLY   2   1.573  17.090   1.115
    8    HA3  GLY   2           HA1      GLY   2   0.391  18.114   1.920
    9    H    SER   3           HN       SER   3  -1.532  18.673   0.403
   10    HA   SER   3           HA       SER   3  -2.572  16.120  -0.541
   11    HB2  SER   3           HB2      SER   3  -4.007  18.760  -0.141
   12    HB3  SER   3           HB1      SER   3  -4.763  17.202  -0.471
   13    HG   SER   3           HG       SER   3  -4.658  16.771   1.569
   14    H    MET   4           HN       MET   4  -1.814  15.775  -2.567
   15    HA   MET   4           HA       MET   4  -2.667  17.676  -4.627
   16    HB2  MET   4           HB2      MET   4  -0.320  18.186  -4.256
   17    HB3  MET   4           HB1      MET   4   0.109  16.489  -4.428
   18    HG2  MET   4           HG2      MET   4   0.619  17.842  -6.427
   19    HG3  MET   4           HG1      MET   4  -0.489  16.508  -6.746
   20    HE1  MET   4           HE1      MET   4  -1.429  17.297  -8.921
   21    HE2  MET   4           HE2      MET   4  -0.294  18.646  -8.964
   22    HE3  MET   4           HE3      MET   4  -2.009  18.924  -9.270
   23    H    ARG   5           HN       ARG   5  -1.336  14.450  -3.955
   24    HA   ARG   5           HA       ARG   5  -2.283  13.411  -6.472
   25    HB2  ARG   5           HB2      ARG   5  -0.764  12.343  -4.156
   26    HB3  ARG   5           HB1      ARG   5  -1.630  11.189  -5.156
   27    HG2  ARG   5           HG2      ARG   5   0.702  11.431  -5.842
   28    HG3  ARG   5           HG1      ARG   5  -0.411  11.929  -7.118
   29    HD2  ARG   5           HD2      ARG   5   0.085  14.180  -6.844
   30    HD3  ARG   5           HD1      ARG   5   0.686  13.950  -5.208
   31    HE   ARG   5           HE       ARG   5   2.143  13.060  -7.614
   32   HH11  ARG   5          HH11      ARG   5   2.089  14.429  -4.385
   33   HH12  ARG   5          HH12      ARG   5   3.802  14.695  -4.332
   34   HH21  ARG   5          HH21      ARG   5   4.409  13.385  -7.527
   35   HH22  ARG   5          HH22      ARG   5   5.119  14.077  -6.103
   36    HA   PRO   6           HA       PRO   6  -6.383  12.611  -4.917
   37    HB2  PRO   6           HB2      PRO   6  -7.248  11.161  -7.054
   38    HB3  PRO   6           HB1      PRO   6  -7.115  12.918  -7.069
   39    HG2  PRO   6           HG2      PRO   6  -5.229  10.859  -8.121
   40    HG3  PRO   6           HG1      PRO   6  -5.804  12.353  -8.866
   41    HD2  PRO   6           HD2      PRO   6  -3.397  12.193  -7.681
   42    HD3  PRO   6           HD1      PRO   6  -4.360  13.682  -7.634
   43    HA   PRO   7           HA       PRO   7  -5.468   8.634  -3.059
   44    HB2  PRO   7           HB2      PRO   7  -8.181   8.830  -1.958
   45    HB3  PRO   7           HB1      PRO   7  -6.636   8.719  -1.113
   46    HG2  PRO   7           HG2      PRO   7  -8.085  10.980  -1.162
   47    HG3  PRO   7           HG1      PRO   7  -6.312  10.996  -1.140
   48    HD2  PRO   7           HD2      PRO   7  -8.184  11.439  -3.429
   49    HD3  PRO   7           HD1      PRO   7  -6.652  12.253  -3.052
   50    H    ILE   8           HN       ILE   8  -6.188   6.531  -3.154
   51    HA   ILE   8           HA       ILE   8  -7.957   5.920  -5.390
   52    HB   ILE   8           HB       ILE   8  -6.163   4.095  -3.795
   53   HG12  ILE   8          HG12      ILE   8  -5.074   6.027  -5.118
   54   HG13  ILE   8          HG11      ILE   8  -4.464   4.398  -5.360
   55   HG21  ILE   8          HG21      ILE   8  -7.758   2.751  -4.842
   56   HG22  ILE   8          HG22      ILE   8  -6.361   2.700  -5.916
   57   HG23  ILE   8          HG23      ILE   8  -7.742   3.722  -6.313
   58   HD11  ILE   8          HD11      ILE   8  -5.545   4.207  -7.451
   59   HD12  ILE   8          HD12      ILE   8  -4.729   5.772  -7.427
   60   HD13  ILE   8          HD13      ILE   8  -6.474   5.681  -7.177
   61    H    ILE   9           HN       ILE   9  -9.992   6.271  -4.364
   62    HA   ILE   9           HA       ILE   9 -10.688   5.109  -1.878
   63    HB   ILE   9           HB       ILE   9 -12.352   6.240  -4.122
   64   HG12  ILE   9          HG12      ILE   9 -12.729   8.086  -2.700
   65   HG13  ILE   9          HG11      ILE   9 -12.010   7.283  -1.325
   66   HG21  ILE   9          HG21      ILE   9 -13.220   4.958  -1.565
   67   HG22  ILE   9          HG22      ILE   9 -13.843   4.716  -3.197
   68   HG23  ILE   9          HG23      ILE   9 -14.195   6.213  -2.332
   69   HD11  ILE   9          HD11      ILE   9  -9.829   7.414  -2.579
   70   HD12  ILE   9          HD12      ILE   9 -10.507   8.947  -2.033
   71   HD13  ILE   9          HD13      ILE   9 -10.659   8.468  -3.723
   72    H    ILE  10           HN       ILE  10 -10.355   2.964  -1.797
   73    HA   ILE  10           HA       ILE  10 -11.466   1.213  -3.834
   74    HB   ILE  10           HB       ILE  10  -9.895   0.489  -1.366
   75   HG12  ILE  10          HG12      ILE  10  -8.850   0.712  -4.173
   76   HG13  ILE  10          HG11      ILE  10  -8.777   2.055  -3.045
   77   HG21  ILE  10          HG21      ILE  10 -11.024  -1.426  -2.168
   78   HG22  ILE  10          HG22      ILE  10  -9.382  -1.541  -2.803
   79   HG23  ILE  10          HG23      ILE  10 -10.695  -1.007  -3.849
   80   HD11  ILE  10          HD11      ILE  10  -6.674   0.854  -3.117
   81   HD12  ILE  10          HD12      ILE  10  -7.498  -0.643  -2.679
   82   HD13  ILE  10          HD13      ILE  10  -7.428   0.692  -1.529
   83    H    HIS  11           HN       HIS  11 -13.245   0.083  -3.592
   84    HA   HIS  11           HA       HIS  11 -14.818   0.385  -1.170
   85    HB2  HIS  11           HB2      HIS  11 -15.338  -0.781  -3.903
   86    HB3  HIS  11           HB1      HIS  11 -16.495  -0.955  -2.586
   87    HD2  HIS  11           HD2      HIS  11 -15.448   2.391  -1.886
   88    HE1  HIS  11           HE1      HIS  11 -18.157   2.890  -5.091
   89    HE2  HIS  11           HE2      HIS  11 -16.786   4.085  -3.325
   90    H    ARG  12           HN       ARG  12 -15.453  -1.307   0.158
   91    HA   ARG  12           HA       ARG  12 -13.630  -3.430   0.491
   92    HB2  ARG  12           HB2      ARG  12 -15.186  -4.130   2.266
   93    HB3  ARG  12           HB1      ARG  12 -14.851  -2.412   2.335
   94    HG2  ARG  12           HG2      ARG  12 -16.964  -1.871   1.418
   95    HG3  ARG  12           HG1      ARG  12 -17.282  -3.557   1.003
   96    HD2  ARG  12           HD2      ARG  12 -17.229  -4.123   3.381
   97    HD3  ARG  12           HD1      ARG  12 -17.007  -2.428   3.778
   98    HE   ARG  12           HE       ARG  12 -19.352  -3.065   2.189
   99   HH11  ARG  12          HH11      ARG  12 -18.041  -2.465   5.387
  100   HH12  ARG  12          HH12      ARG  12 -19.591  -2.122   6.090
  101   HH21  ARG  12          HH21      ARG  12 -21.385  -2.610   3.120
  102   HH22  ARG  12          HH22      ARG  12 -21.484  -2.198   4.803
  103    H    ALA  13           HN       ALA  13 -13.796  -5.599   0.076
  104    HA   ALA  13           HA       ALA  13 -16.125  -6.512  -1.477
  105    HB1  ALA  13           HB1      ALA  13 -14.567  -7.915  -2.807
  106    HB2  ALA  13           HB2      ALA  13 -13.215  -7.100  -2.019
  107    HB3  ALA  13           HB3      ALA  13 -14.325  -6.185  -3.040
  108    H    GLY  14           HN       GLY  14 -16.887  -7.283   0.576
  109    HA2  GLY  14           HA2      GLY  14 -17.368  -9.133   1.877
  110    HA3  GLY  14           HA1      GLY  14 -16.049  -9.987   1.085
  111    H    LYS  15           HN       LYS  15 -13.871  -9.478   1.753
  112    HA   LYS  15           HA       LYS  15 -13.651  -8.271   4.409
  113    HB2  LYS  15           HB2      LYS  15 -13.296 -11.111   3.792
  114    HB3  LYS  15           HB1      LYS  15 -11.926 -10.398   4.628
  115    HG2  LYS  15           HG2      LYS  15 -13.197 -11.113   6.393
  116    HG3  LYS  15           HG1      LYS  15 -13.770  -9.459   6.208
  117    HD2  LYS  15           HD2      LYS  15 -15.573 -10.394   4.720
  118    HD3  LYS  15           HD1      LYS  15 -15.106 -11.983   5.322
  119    HE2  LYS  15           HE2      LYS  15 -16.921 -11.252   6.665
  120    HE3  LYS  15           HE1      LYS  15 -15.464 -11.087   7.643
  121    HZ1  LYS  15           HZ1      LYS  15 -16.720  -8.855   6.133
  122    HZ2  LYS  15           HZ2      LYS  15 -15.439  -8.743   7.233
  123    HZ3  LYS  15           HZ3      LYS  15 -16.986  -9.160   7.775
  124    H    LYS  16           HN       LYS  16 -12.544  -8.476   1.292
  125    HA   LYS  16           HA       LYS  16  -9.951  -7.348   2.091
  126    HB2  LYS  16           HB2      LYS  16 -10.442  -9.354  -0.110
  127    HB3  LYS  16           HB1      LYS  16  -8.979  -8.391   0.002
  128    HG2  LYS  16           HG2      LYS  16  -8.587  -9.359   2.255
  129    HG3  LYS  16           HG1      LYS  16  -9.973 -10.417   1.988
  130    HD2  LYS  16           HD2      LYS  16  -8.219 -11.765   1.338
  131    HD3  LYS  16           HD1      LYS  16  -8.717 -11.060  -0.199
  132    HE2  LYS  16           HE2      LYS  16  -6.536  -9.870   1.499
  133    HE3  LYS  16           HE1      LYS  16  -6.218 -11.114   0.295
  134    HZ1  LYS  16           HZ1      LYS  16  -5.867  -9.237  -0.923
  135    HZ2  LYS  16           HZ2      LYS  16  -7.003  -8.312  -0.080
  136    HZ3  LYS  16           HZ3      LYS  16  -7.516  -9.449  -1.230
  137    H    TYR  17           HN       TYR  17  -8.915  -6.140   0.191
  138    HA   TYR  17           HA       TYR  17 -11.017  -4.543  -1.113
  139    HB2  TYR  17           HB2      TYR  17  -8.146  -3.815  -0.522
  140    HB3  TYR  17           HB1      TYR  17  -9.343  -2.757  -1.262
  141    HD1  TYR  17           HD1      TYR  17 -11.186  -1.842   0.072
  142    HD2  TYR  17           HD2      TYR  17  -8.182  -4.288   1.810
  143    HE1  TYR  17           HE1      TYR  17 -11.913  -1.120   2.306
  144    HE2  TYR  17           HE2      TYR  17  -8.879  -3.605   4.040
  145    HH   TYR  17           HH       TYR  17 -10.103  -1.524   5.034
  146    H    GLY  18           HN       GLY  18  -8.760  -6.893  -1.781
  147    HA2  GLY  18           HA2      GLY  18  -8.598  -7.859  -3.937
  148    HA3  GLY  18           HA1      GLY  18  -9.033  -6.313  -4.616
  149    H    PHE  19           HN       PHE  19  -6.567  -6.236  -2.237
  150    HA   PHE  19           HA       PHE  19  -4.533  -6.534  -4.281
  151    HB2  PHE  19           HB2      PHE  19  -3.468  -4.449  -3.982
  152    HB3  PHE  19           HB1      PHE  19  -5.154  -4.134  -4.298
  153    HD1  PHE  19           HD1      PHE  19  -6.631  -3.365  -2.419
  154    HD2  PHE  19           HD2      PHE  19  -2.414  -3.761  -2.003
  155    HE1  PHE  19           HE1      PHE  19  -6.692  -1.911  -0.432
  156    HE2  PHE  19           HE2      PHE  19  -2.467  -2.316  -0.013
  157    HZ   PHE  19           HZ       PHE  19  -4.609  -1.389   0.774
  158    H    THR  20           HN       THR  20  -2.367  -6.233  -3.470
  159    HA   THR  20           HA       THR  20  -2.093  -7.575  -0.855
  160    HB   THR  20           HB       THR  20  -0.285  -7.680  -3.271
  161    HG1  THR  20           HG1      THR  20  -2.320  -8.909  -3.294
  162   HG21  THR  20          HG21      THR  20   1.064  -9.286  -2.078
  163   HG22  THR  20          HG22      THR  20  -0.029  -9.241  -0.695
  164   HG23  THR  20          HG23      THR  20   0.951  -7.826  -1.090
  165    H    LEU  21           HN       LEU  21  -1.223  -6.357   0.679
  166    HA   LEU  21           HA       LEU  21   0.328  -4.001  -0.088
  167    HB2  LEU  21           HB2      LEU  21  -1.547  -3.636   1.455
  168    HB3  LEU  21           HB1      LEU  21  -0.860  -4.796   2.573
  169    HG   LEU  21           HG       LEU  21   1.056  -3.331   2.953
  170   HD11  LEU  21          HD11      LEU  21   1.278  -2.263   0.825
  171   HD12  LEU  21          HD12      LEU  21   1.001  -1.018   2.042
  172   HD13  LEU  21          HD13      LEU  21  -0.313  -1.520   0.980
  173   HD21  LEU  21          HD21      LEU  21  -1.633  -2.026   3.257
  174   HD22  LEU  21          HD22      LEU  21  -0.157  -1.454   4.032
  175   HD23  LEU  21          HD23      LEU  21  -0.799  -3.049   4.425
  176    H    ARG  22           HN       ARG  22   2.473  -3.908   0.276
  177    HA   ARG  22           HA       ARG  22   3.628  -6.017   1.953
  178    HB2  ARG  22           HB2      ARG  22   4.400  -5.267  -0.849
  179    HB3  ARG  22           HB1      ARG  22   5.503  -6.104   0.222
  180    HG2  ARG  22           HG2      ARG  22   3.245  -7.644   0.393
  181    HG3  ARG  22           HG1      ARG  22   3.213  -7.092  -1.279
  182    HD2  ARG  22           HD2      ARG  22   4.529  -9.230  -0.709
  183    HD3  ARG  22           HD1      ARG  22   5.252  -8.044  -1.788
  184    HE   ARG  22           HE       ARG  22   5.873  -7.922   1.072
  185   HH11  ARG  22          HH11      ARG  22   6.920  -8.764  -2.152
  186   HH12  ARG  22          HH12      ARG  22   8.607  -8.530  -1.801
  187   HH21  ARG  22          HH21      ARG  22   8.081  -7.610   1.537
  188   HH22  ARG  22          HH22      ARG  22   9.262  -7.875   0.291
  189    H    ALA  23           HN       ALA  23   5.426  -5.498   3.074
  190    HA   ALA  23           HA       ALA  23   6.140  -2.653   3.111
  191    HB1  ALA  23           HB1      ALA  23   5.537  -3.094   5.274
  192    HB2  ALA  23           HB2      ALA  23   7.247  -3.520   5.365
  193    HB3  ALA  23           HB3      ALA  23   6.027  -4.784   5.184
  194    H    ILE  24           HN       ILE  24   7.962  -2.126   2.163
  195    HA   ILE  24           HA       ILE  24  10.054  -4.174   1.849
  196    HB   ILE  24           HB       ILE  24  10.902  -2.609   0.010
  197   HG12  ILE  24          HG12      ILE  24   8.052  -1.614  -0.003
  198   HG13  ILE  24          HG11      ILE  24   9.345  -0.723   0.796
  199   HG21  ILE  24          HG21      ILE  24   9.373  -3.570  -1.645
  200   HG22  ILE  24          HG22      ILE  24   8.260  -4.014  -0.351
  201   HG23  ILE  24          HG23      ILE  24   9.856  -4.759  -0.434
  202   HD11  ILE  24          HD11      ILE  24   8.881   0.119  -1.450
  203   HD12  ILE  24          HD12      ILE  24   9.282  -1.462  -2.121
  204   HD13  ILE  24          HD13      ILE  24  10.524  -0.507  -1.308
  205    H    ARG  25           HN       ARG  25  11.952  -3.883   2.811
  206    HA   ARG  25           HA       ARG  25  12.393  -1.417   4.301
  207    HB2  ARG  25           HB2      ARG  25  14.317  -2.720   5.304
  208    HB3  ARG  25           HB1      ARG  25  12.711  -3.352   5.635
  209    HG2  ARG  25           HG2      ARG  25  12.995  -5.152   4.154
  210    HG3  ARG  25           HG1      ARG  25  14.398  -4.403   3.386
  211    HD2  ARG  25           HD2      ARG  25  15.563  -4.596   5.616
  212    HD3  ARG  25           HD1      ARG  25  14.208  -5.596   6.146
  213    HE   ARG  25           HE       ARG  25  15.248  -6.593   3.719
  214   HH11  ARG  25          HH11      ARG  25  16.056  -6.349   7.116
  215   HH12  ARG  25          HH12      ARG  25  17.041  -7.777   7.116
  216   HH21  ARG  25          HH21      ARG  25  16.555  -8.464   3.708
  217   HH22  ARG  25          HH22      ARG  25  17.323  -8.977   5.175
  218    H    VAL  26           HN       VAL  26  12.993   0.014   2.683
  219    HA   VAL  26           HA       VAL  26  15.171  -0.659   0.895
  220    HB   VAL  26           HB       VAL  26  13.660   1.936   1.256
  221   HG11  VAL  26          HG11      VAL  26  15.639   1.114  -0.871
  222   HG12  VAL  26          HG12      VAL  26  15.878   2.354   0.362
  223   HG13  VAL  26          HG13      VAL  26  14.665   2.586  -0.897
  224   HG21  VAL  26          HG21      VAL  26  13.430  -0.225  -0.833
  225   HG22  VAL  26          HG22      VAL  26  12.570   1.314  -0.857
  226   HG23  VAL  26          HG23      VAL  26  12.250   0.144   0.425
  227    H    TYR  27           HN       TYR  27  17.213  -0.506   1.541
  228    HA   TYR  27           HA       TYR  27  17.906   0.902   3.923
  229    HB2  TYR  27           HB2      TYR  27  19.515  -0.583   1.882
  230    HB3  TYR  27           HB1      TYR  27  20.250   0.232   3.244
  231    HD1  TYR  27           HD1      TYR  27  19.645  -0.473   5.572
  232    HD2  TYR  27           HD2      TYR  27  18.494  -2.718   2.148
  233    HE1  TYR  27           HE1      TYR  27  19.199  -2.420   7.004
  234    HE2  TYR  27           HE2      TYR  27  18.045  -4.672   3.572
  235    HH   TYR  27           HH       TYR  27  18.778  -5.533   5.801
  236    H    MET  28           HN       MET  28  18.868   2.764   4.179
  237    HA   MET  28           HA       MET  28  18.922   4.596   1.955
  238    HB2  MET  28           HB2      MET  28  19.160   4.854   4.937
  239    HB3  MET  28           HB1      MET  28  19.530   6.193   3.878
  240    HG2  MET  28           HG2      MET  28  16.913   4.738   4.004
  241    HG3  MET  28           HG1      MET  28  17.256   6.286   4.756
  242    HE1  MET  28           HE1      MET  28  15.359   4.828   2.093
  243    HE2  MET  28           HE2      MET  28  16.881   4.371   1.329
  244    HE3  MET  28           HE3      MET  28  15.831   5.562   0.560
  245    H    GLY  29           HN       GLY  29  20.719   5.659   1.196
  246    HA2  GLY  29           HA2      GLY  29  23.228   4.293   1.532
  247    HA3  GLY  29           HA1      GLY  29  22.922   5.671   0.486
  248    H    ASP  30           HN       ASP  30  23.161   4.837   3.918
  249    HA   ASP  30           HA       ASP  30  24.923   7.109   4.354
  250    HB2  ASP  30           HB2      ASP  30  22.911   8.244   4.831
  251    HB3  ASP  30           HB1      ASP  30  22.197   6.834   5.606
  252    H    SER  31           HN       SER  31  23.006   4.754   6.194
  253    HA   SER  31           HA       SER  31  25.488   3.677   7.304
  254    HB2  SER  31           HB2      SER  31  23.011   4.231   8.954
  255    HB3  SER  31           HB1      SER  31  24.572   3.668   9.535
  256    HG   SER  31           HG       SER  31  23.833   6.222   8.589
  257    H    ASP  32           HN       ASP  32  23.435   2.152   9.102
  258    HA   ASP  32           HA       ASP  32  22.947   0.019   7.138
  259    HB2  ASP  32           HB2      ASP  32  24.265  -0.245   9.397
  260    HB3  ASP  32           HB1      ASP  32  22.656  -0.333  10.101
  261    H    VAL  33           HN       VAL  33  21.501   2.539   8.410
  262    HA   VAL  33           HA       VAL  33  19.009   1.694   9.358
  263    HB   VAL  33           HB       VAL  33  19.695   3.929   9.795
  264   HG11  VAL  33          HG11      VAL  33  19.949   5.595   7.960
  265   HG12  VAL  33          HG12      VAL  33  19.831   4.259   6.813
  266   HG13  VAL  33          HG13      VAL  33  21.172   4.325   7.957
  267   HG21  VAL  33          HG21      VAL  33  17.262   3.571   9.402
  268   HG22  VAL  33          HG22      VAL  33  17.491   4.175   7.757
  269   HG23  VAL  33          HG23      VAL  33  17.803   5.228   9.141
  270    H    TYR  34           HN       TYR  34  17.064   1.507   8.423
  271    HA   TYR  34           HA       TYR  34  16.966   1.379   5.488
  272    HB2  TYR  34           HB2      TYR  34  15.391  -0.490   5.633
  273    HB3  TYR  34           HB1      TYR  34  16.936  -0.904   6.346
  274    HD1  TYR  34           HD2      TYR  34  13.416  -0.123   7.043
  275    HD2  TYR  34           HD1      TYR  34  17.110  -1.440   8.701
  276    HE1  TYR  34           HE2      TYR  34  12.243  -0.824   9.084
  277    HE2  TYR  34           HE1      TYR  34  15.942  -2.150  10.744
  278    HH   TYR  34           HH       TYR  34  13.970  -1.841  11.935
  279    H    THR  35           HN       THR  35  14.778   1.501   4.676
  280    HA   THR  35           HA       THR  35  13.024   3.172   6.339
  281    HB   THR  35           HB       THR  35  13.456   3.677   3.396
  282    HG1  THR  35           HG1      THR  35  15.005   4.418   5.598
  283   HG21  THR  35          HG21      THR  35  12.772   6.021   4.272
  284   HG22  THR  35          HG22      THR  35  12.167   5.138   5.676
  285   HG23  THR  35          HG23      THR  35  11.521   4.792   4.070
  286    H    VAL  36           HN       VAL  36  11.486   1.691   6.706
  287    HA   VAL  36           HA       VAL  36  10.653  -0.187   4.711
  288    HB   VAL  36           HB       VAL  36  10.577  -0.986   6.942
  289   HG11  VAL  36          HG11      VAL  36   9.157   0.030   8.693
  290   HG12  VAL  36          HG12      VAL  36   8.843   1.384   7.609
  291   HG13  VAL  36          HG13      VAL  36  10.483   1.072   8.177
  292   HG21  VAL  36          HG21      VAL  36   8.239  -1.650   7.236
  293   HG22  VAL  36          HG22      VAL  36   8.754  -1.790   5.555
  294   HG23  VAL  36          HG23      VAL  36   7.747  -0.432   6.059
  295    H    HIS  37           HN       HIS  37   9.506   0.397   3.057
  296    HA   HIS  37           HA       HIS  37   7.517   2.531   3.338
  297    HB2  HIS  37           HB2      HIS  37   8.968   1.351   1.000
  298    HB3  HIS  37           HB1      HIS  37   7.446   2.186   0.748
  299    HD2  HIS  37           HD2      HIS  37  11.135   2.923   1.080
  300    HE1  HIS  37           HE1      HIS  37   9.087   6.602   1.498
  301    HE2  HIS  37           HE2      HIS  37  11.306   5.508   0.947
  302    H    HIS  38           HN       HIS  38   5.435   2.237   2.423
  303    HA   HIS  38           HA       HIS  38   4.527  -0.560   2.502
  304    HB2  HIS  38           HB2      HIS  38   2.915   1.946   3.065
  305    HB3  HIS  38           HB1      HIS  38   2.352   0.285   3.235
  306    HD2  HIS  38           HD2      HIS  38   4.058   3.002   5.259
  307    HE1  HIS  38           HE1      HIS  38   4.520  -0.609   7.410
  308    HE2  HIS  38           HE2      HIS  38   4.970   1.883   7.409
  309    H    MET  39           HN       MET  39   4.447  -1.232   0.471
  310    HA   MET  39           HA       MET  39   3.111   0.506  -1.490
  311    HB2  MET  39           HB2      MET  39   5.311   0.577  -2.228
  312    HB3  MET  39           HB1      MET  39   5.651  -1.066  -1.706
  313    HG2  MET  39           HG2      MET  39   3.637  -0.851  -3.825
  314    HG3  MET  39           HG1      MET  39   5.246  -0.296  -4.281
  315    HE1  MET  39           HE1      MET  39   7.364  -3.364  -4.523
  316    HE2  MET  39           HE2      MET  39   7.444  -1.861  -3.600
  317    HE3  MET  39           HE3      MET  39   6.914  -1.838  -5.287
  318    H    VAL  40           HN       VAL  40   1.637  -0.396  -2.808
  319    HA   VAL  40           HA       VAL  40   0.592  -2.972  -2.171
  320    HB   VAL  40           HB       VAL  40  -1.079  -1.533  -2.908
  321   HG11  VAL  40          HG11      VAL  40  -0.861  -0.182  -5.026
  322   HG12  VAL  40          HG12      VAL  40   0.846  -0.627  -5.029
  323   HG13  VAL  40          HG13      VAL  40   0.178   0.303  -3.686
  324   HG21  VAL  40          HG21      VAL  40  -1.593  -2.233  -5.364
  325   HG22  VAL  40          HG22      VAL  40  -1.630  -3.437  -4.074
  326   HG23  VAL  40          HG23      VAL  40  -0.224  -3.325  -5.133
  327    H    TRP  41           HN       TRP  41   1.415  -4.800  -2.851
  328    HA   TRP  41           HA       TRP  41   3.518  -4.805  -4.839
  329    HB2  TRP  41           HB2      TRP  41   3.733  -5.951  -2.668
  330    HB3  TRP  41           HB1      TRP  41   2.434  -7.047  -3.135
  331    HD1  TRP  41           HD1      TRP  41   3.064  -9.060  -4.705
  332    HE1  TRP  41           HE1      TRP  41   5.310  -9.989  -5.563
  333    HE3  TRP  41           HE3      TRP  41   6.111  -5.148  -3.437
  334    HZ2  TRP  41           HZ2      TRP  41   8.014  -9.178  -5.672
  335    HZ3  TRP  41           HZ3      TRP  41   8.515  -5.305  -3.944
  336    HH2  TRP  41           HH2      TRP  41   9.445  -7.279  -5.039
  337    H    HIS  42           HN       HIS  42   0.206  -5.858  -4.619
  338    HA   HIS  42           HA       HIS  42   0.203  -6.463  -7.439
  339    HB2  HIS  42           HB2      HIS  42   1.005  -8.595  -6.496
  340    HB3  HIS  42           HB1      HIS  42  -0.370  -8.645  -5.403
  341    HD2  HIS  42           HD2      HIS  42   0.335  -9.005  -9.253
  342    HE1  HIS  42           HE1      HIS  42  -3.335 -10.867  -8.278
  343    HE2  HIS  42           HE2      HIS  42  -1.537 -10.620 -10.042
  344    H    VAL  43           HN       VAL  43  -1.884  -6.538  -8.310
  345    HA   VAL  43           HA       VAL  43  -4.085  -5.928  -6.454
  346    HB   VAL  43           HB       VAL  43  -3.700  -4.617  -9.157
  347   HG11  VAL  43          HG11      VAL  43  -6.032  -4.885  -8.497
  348   HG12  VAL  43          HG12      VAL  43  -5.556  -3.186  -8.466
  349   HG13  VAL  43          HG13      VAL  43  -5.696  -4.092  -6.959
  350   HG21  VAL  43          HG21      VAL  43  -2.033  -3.795  -7.571
  351   HG22  VAL  43          HG22      VAL  43  -3.310  -3.429  -6.412
  352   HG23  VAL  43          HG23      VAL  43  -3.232  -2.554  -7.940
  353    H    GLU  44           HN       GLU  44  -5.854  -7.152  -6.769
  354    HA   GLU  44           HA       GLU  44  -5.882  -9.350  -8.457
  355    HB2  GLU  44           HB2      GLU  44  -8.029  -7.851  -6.967
  356    HB3  GLU  44           HB1      GLU  44  -8.339  -9.328  -7.839
  357    HG2  GLU  44           HG2      GLU  44  -6.351  -9.072  -5.611
  358    HG3  GLU  44           HG1      GLU  44  -8.003  -9.654  -5.414
  359    H    ASP  45           HN       ASP  45  -6.599  -9.685 -10.474
  360    HA   ASP  45           HA       ASP  45  -6.989  -7.504 -12.232
  361    HB2  ASP  45           HB2      ASP  45  -7.227 -10.483 -12.509
  362    HB3  ASP  45           HB1      ASP  45  -7.770  -9.429 -13.812
  363    H    GLY  46           HN       GLY  46  -8.721  -6.248 -11.992
  364    HA2  GLY  46           HA2      GLY  46 -10.968  -5.731 -12.431
  365    HA3  GLY  46           HA1      GLY  46 -11.352  -7.447 -12.354
  366    H    GLY  47           HN       GLY  47  -9.377  -6.326  -9.838
  367    HA2  GLY  47           HA2      GLY  47 -11.438  -6.834  -7.891
  368    HA3  GLY  47           HA1      GLY  47  -9.765  -6.407  -7.559
  369    HA   PRO  48           HA       PRO  48 -12.933  -2.860  -6.755
  370    HB2  PRO  48           HB2      PRO  48 -11.583  -3.213  -4.125
  371    HB3  PRO  48           HB1      PRO  48 -13.271  -2.807  -4.454
  372    HG2  PRO  48           HG2      PRO  48 -12.686  -5.222  -3.674
  373    HG3  PRO  48           HG1      PRO  48 -13.737  -5.010  -5.079
  374    HD2  PRO  48           HD2      PRO  48 -10.822  -5.644  -5.025
  375    HD3  PRO  48           HD1      PRO  48 -12.118  -6.416  -5.937
  376    H    ALA  49           HN       ALA  49  -9.763  -3.421  -5.363
  377    HA   ALA  49           HA       ALA  49  -8.946  -0.749  -5.271
  378    HB1  ALA  49           HB1      ALA  49  -7.768  -2.488  -4.043
  379    HB2  ALA  49           HB2      ALA  49  -6.650  -1.608  -5.087
  380    HB3  ALA  49           HB3      ALA  49  -7.223  -3.207  -5.560
  381    H    SER  50           HN       SER  50  -8.638  -3.124  -7.840
  382    HA   SER  50           HA       SER  50  -7.028  -1.552  -9.548
  383    HB2  SER  50           HB2      SER  50  -7.777  -4.099  -9.645
  384    HB3  SER  50           HB1      SER  50  -9.045  -3.436 -10.674
  385    HG   SER  50           HG       SER  50  -6.801  -4.112 -11.562
  386    H    GLU  51           HN       GLU  51 -10.453  -1.860  -9.004
  387    HA   GLU  51           HA       GLU  51 -11.295  -0.287 -11.223
  388    HB2  GLU  51           HB2      GLU  51 -12.735  -0.799  -8.612
  389    HB3  GLU  51           HB1      GLU  51 -13.470  -0.187 -10.089
  390    HG2  GLU  51           HG2      GLU  51 -12.684  -2.350 -11.176
  391    HG3  GLU  51           HG1      GLU  51 -12.386  -2.926  -9.539
  392    H    ALA  52           HN       ALA  52 -10.456   0.356  -7.926
  393    HA   ALA  52           HA       ALA  52 -11.195   3.098  -7.889
  394    HB1  ALA  52           HB1      ALA  52  -9.257   1.604  -6.138
  395    HB2  ALA  52           HB2      ALA  52 -10.999   1.708  -5.879
  396    HB3  ALA  52           HB3      ALA  52 -10.004   3.161  -5.782
  397    H    GLY  53           HN       GLY  53  -8.454   1.365  -9.075
  398    HA2  GLY  53           HA2      GLY  53  -7.087   2.520 -10.711
  399    HA3  GLY  53           HA1      GLY  53  -7.181   3.932  -9.681
  400    H    LEU  54           HN       LEU  54  -6.729   1.312  -7.684
  401    HA   LEU  54           HA       LEU  54  -4.074   2.099  -7.028
  402    HB2  LEU  54           HB2      LEU  54  -6.065   0.570  -5.861
  403    HB3  LEU  54           HB1      LEU  54  -4.798  -0.585  -6.173
  404    HG   LEU  54           HG       LEU  54  -4.853   1.716  -4.283
  405   HD11  LEU  54          HD11      LEU  54  -5.195  -0.643  -3.582
  406   HD12  LEU  54          HD12      LEU  54  -3.825   0.154  -2.797
  407   HD13  LEU  54          HD13      LEU  54  -3.546  -0.989  -4.111
  408   HD21  LEU  54          HD21      LEU  54  -2.976   2.432  -5.455
  409   HD22  LEU  54          HD22      LEU  54  -2.430   0.790  -5.780
  410   HD23  LEU  54          HD23      LEU  54  -2.310   1.454  -4.150
  411    H    ARG  55           HN       ARG  55  -2.234   1.439  -7.814
  412    HA   ARG  55           HA       ARG  55  -2.157  -0.952  -9.528
  413    HB2  ARG  55           HB2      ARG  55  -0.495   1.543  -9.884
  414    HB3  ARG  55           HB1      ARG  55  -0.601   0.168 -10.977
  415    HG2  ARG  55           HG2      ARG  55  -3.018   1.794 -10.300
  416    HG3  ARG  55           HG1      ARG  55  -1.899   2.291 -11.562
  417    HD2  ARG  55           HD2      ARG  55  -2.353   0.407 -12.871
  418    HD3  ARG  55           HD1      ARG  55  -3.040  -0.476 -11.512
  419    HE   ARG  55           HE       ARG  55  -4.378   1.849 -12.741
  420   HH11  ARG  55          HH11      ARG  55  -4.452  -1.421 -11.474
  421   HH12  ARG  55          HH12      ARG  55  -6.166  -1.597 -11.671
  422   HH21  ARG  55          HH21      ARG  55  -6.641   1.621 -12.988
  423   HH22  ARG  55          HH22      ARG  55  -7.409   0.135 -12.534
  424    H    GLN  56           HN       GLN  56  -0.384  -2.294  -9.304
  425    HA   GLN  56           HA       GLN  56   0.914  -2.172  -6.778
  426    HB2  GLN  56           HB2      GLN  56   2.306  -4.059  -8.278
  427    HB3  GLN  56           HB1      GLN  56   1.011  -4.355  -7.143
  428    HG2  GLN  56           HG2      GLN  56  -0.599  -4.483  -8.808
  429    HG3  GLN  56           HG1      GLN  56   0.460  -3.727  -9.970
  430   HE21  GLN  56          HE21      GLN  56   2.776  -5.305  -9.327
  431   HE22  GLN  56          HE22      GLN  56   2.486  -6.891  -9.947
  432    H    GLY  57           HN       GLY  57   3.033  -1.822  -6.264
  433    HA2  GLY  57           HA2      GLY  57   5.285  -1.330  -6.694
  434    HA3  GLY  57           HA1      GLY  57   4.884  -1.009  -8.365
  435    H    ASP  58           HN       ASP  58   2.679   0.607  -6.401
  436    HA   ASP  58           HA       ASP  58   4.063   3.127  -6.871
  437    HB2  ASP  58           HB2      ASP  58   1.358   2.605  -5.619
  438    HB3  ASP  58           HB1      ASP  58   2.012   4.191  -5.996
  439    H    LEU  59           HN       LEU  59   2.926   4.514  -4.624
  440    HA   LEU  59           HA       LEU  59   4.131   3.230  -2.336
  441    HB2  LEU  59           HB2      LEU  59   5.033   5.741  -3.614
  442    HB3  LEU  59           HB1      LEU  59   4.892   5.776  -1.866
  443    HG   LEU  59           HG       LEU  59   6.613   3.934  -3.498
  444   HD11  LEU  59          HD11      LEU  59   8.457   5.075  -2.429
  445   HD12  LEU  59          HD12      LEU  59   7.338   6.055  -1.483
  446   HD13  LEU  59          HD13      LEU  59   7.419   6.254  -3.233
  447   HD21  LEU  59          HD21      LEU  59   5.894   2.610  -1.696
  448   HD22  LEU  59          HD22      LEU  59   5.975   3.962  -0.566
  449   HD23  LEU  59          HD23      LEU  59   7.459   3.250  -1.199
  450    H    ILE  60           HN       ILE  60   2.609   3.184  -0.864
  451    HA   ILE  60           HA       ILE  60   0.426   5.049  -0.944
  452    HB   ILE  60           HB       ILE  60   1.080   2.836   1.018
  453   HG12  ILE  60          HG12      ILE  60  -1.181   2.876  -0.971
  454   HG13  ILE  60          HG11      ILE  60   0.428   2.348  -1.450
  455   HG21  ILE  60          HG21      ILE  60  -0.239   4.550   2.119
  456   HG22  ILE  60          HG22      ILE  60  -1.222   3.114   1.836
  457   HG23  ILE  60          HG23      ILE  60  -1.409   4.528   0.798
  458   HD11  ILE  60          HD11      ILE  60   0.354   0.589   0.226
  459   HD12  ILE  60          HD12      ILE  60  -1.019   0.477  -0.875
  460   HD13  ILE  60          HD13      ILE  60  -1.239   1.141   0.745
  461    H    THR  61           HN       THR  61   0.712   7.045  -0.170
  462    HA   THR  61           HA       THR  61   2.708   7.515   1.894
  463    HB   THR  61           HB       THR  61   2.851   9.043   0.077
  464    HG1  THR  61           HG1      THR  61   1.598  10.335   2.290
  465   HG21  THR  61          HG21      THR  61   1.034  10.501  -0.628
  466   HG22  THR  61          HG22      THR  61  -0.041   9.754   0.555
  467   HG23  THR  61          HG23      THR  61   0.575   8.806  -0.800
  468    H    HIS  62           HN       HIS  62  -0.783   7.621   1.494
  469    HA   HIS  62           HA       HIS  62  -1.039   7.817   4.394
  470    HB2  HIS  62           HB2      HIS  62  -2.526   9.703   2.553
  471    HB3  HIS  62           HB1      HIS  62  -2.843   9.502   4.262
  472    HD2  HIS  62           HD2      HIS  62  -1.085  10.745   5.990
  473    HE1  HIS  62           HE1      HIS  62   0.996  12.819   2.949
  474    HE2  HIS  62           HE2      HIS  62   0.726  12.521   5.451
  475    H    VAL  63           HN       VAL  63  -2.916   6.945   5.199
  476    HA   VAL  63           HA       VAL  63  -4.702   5.641   3.246
  477    HB   VAL  63           HB       VAL  63  -3.718   4.560   5.894
  478   HG11  VAL  63          HG11      VAL  63  -5.208   2.705   5.625
  479   HG12  VAL  63          HG12      VAL  63  -5.760   3.311   4.065
  480   HG13  VAL  63          HG13      VAL  63  -6.155   4.189   5.541
  481   HG21  VAL  63          HG21      VAL  63  -2.220   4.247   3.939
  482   HG22  VAL  63          HG22      VAL  63  -3.522   3.381   3.124
  483   HG23  VAL  63          HG23      VAL  63  -2.822   2.728   4.605
  484    H    ASN  64           HN       ASN  64  -6.618   6.610   3.344
  485    HA   ASN  64           HA       ASN  64  -8.503   7.608   4.121
  486    HB2  ASN  64           HB2      ASN  64  -7.645   6.390   6.760
  487    HB3  ASN  64           HB1      ASN  64  -9.189   7.188   6.494
  488   HD21  ASN  64          HD21      ASN  64  -8.381   4.399   7.174
  489   HD22  ASN  64          HD22      ASN  64  -9.198   3.414   6.019
  490    H    GLY  65           HN       GLY  65  -5.845   8.888   4.132
  491    HA2  GLY  65           HA2      GLY  65  -5.222  11.103   4.439
  492    HA3  GLY  65           HA1      GLY  65  -6.622  11.323   5.475
  493    H    GLU  66           HN       GLU  66  -4.650   8.628   6.262
  494    HA   GLU  66           HA       GLU  66  -3.627  10.124   8.577
  495    HB2  GLU  66           HB2      GLU  66  -3.744   7.137   8.321
  496    HB3  GLU  66           HB1      GLU  66  -3.612   8.092   9.788
  497    HG2  GLU  66           HG2      GLU  66  -6.042   8.265   8.060
  498    HG3  GLU  66           HG1      GLU  66  -5.848   6.956   9.215
  499    HA   PRO  67           HA       PRO  67   0.463   9.655   6.844
  500    HB2  PRO  67           HB2      PRO  67   1.433  10.091   9.587
  501    HB3  PRO  67           HB1      PRO  67   1.708  11.056   8.135
  502    HG2  PRO  67           HG2      PRO  67   0.116  11.910  10.133
  503    HG3  PRO  67           HG1      PRO  67  -0.206  12.298   8.437
  504    HD2  PRO  67           HD2      PRO  67  -1.495  10.262  10.183
  505    HD3  PRO  67           HD1      PRO  67  -2.226  11.327   8.970
  506    H    VAL  68           HN       VAL  68   1.018   7.628   6.383
  507    HA   VAL  68           HA       VAL  68   1.109   5.594   8.470
  508    HB   VAL  68           HB       VAL  68   1.422   3.991   6.679
  509   HG11  VAL  68          HG11      VAL  68  -0.770   5.973   6.088
  510   HG12  VAL  68          HG12      VAL  68  -0.849   4.633   7.232
  511   HG13  VAL  68          HG13      VAL  68  -0.715   4.311   5.505
  512   HG21  VAL  68          HG21      VAL  68   1.467   4.636   4.341
  513   HG22  VAL  68          HG22      VAL  68   2.811   5.388   5.200
  514   HG23  VAL  68          HG23      VAL  68   1.384   6.339   4.787
  515    H    HIS  69           HN       HIS  69   3.186   7.764   6.979
  516    HA   HIS  69           HA       HIS  69   5.561   6.234   6.844
  517    HB2  HIS  69           HB2      HIS  69   5.037   8.530   5.786
  518    HB3  HIS  69           HB1      HIS  69   5.465   9.203   7.352
  519    HD2  HIS  69           HD2      HIS  69   8.209   8.578   8.128
  520    HE1  HIS  69           HE1      HIS  69   9.372   8.165   4.080
  521    HE2  HIS  69           HE2      HIS  69  10.175   8.653   6.433
  522    H    GLY  70           HN       GLY  70   6.181   5.150   8.626
  523    HA2  GLY  70           HA2      GLY  70   7.644   5.702  10.602
  524    HA3  GLY  70           HA1      GLY  70   6.283   6.662  11.158
  525    H    LEU  71           HN       LEU  71   4.397   4.518  10.084
  526    HA   LEU  71           HA       LEU  71   4.357   2.992  12.529
  527    HB2  LEU  71           HB2      LEU  71   2.642   2.345  10.174
  528    HB3  LEU  71           HB1      LEU  71   2.289   2.182  11.881
  529    HG   LEU  71           HG       LEU  71   2.486   4.795  10.466
  530   HD11  LEU  71          HD11      LEU  71   0.670   3.990   9.416
  531   HD12  LEU  71          HD12      LEU  71  -0.112   4.543  10.897
  532   HD13  LEU  71          HD13      LEU  71   0.310   2.838  10.700
  533   HD21  LEU  71          HD21      LEU  71   1.317   5.666  12.414
  534   HD22  LEU  71          HD22      LEU  71   2.817   4.877  12.904
  535   HD23  LEU  71          HD23      LEU  71   1.274   4.049  13.116
  536    H    VAL  72           HN       VAL  72   3.409   0.625  11.878
  537    HA   VAL  72           HA       VAL  72   5.654  -0.746  10.583
  538    HB   VAL  72           HB       VAL  72   4.819  -2.763  11.750
  539   HG11  VAL  72          HG11      VAL  72   5.458  -2.101  14.022
  540   HG12  VAL  72          HG12      VAL  72   5.277  -0.404  13.575
  541   HG13  VAL  72          HG13      VAL  72   6.530  -1.387  12.817
  542   HG21  VAL  72          HG21      VAL  72   2.570  -0.963  12.311
  543   HG22  VAL  72          HG22      VAL  72   3.141  -1.876  13.718
  544   HG23  VAL  72          HG23      VAL  72   2.636  -2.731  12.261
  545    H    HIS  73           HN       HIS  73   4.795  -2.945   9.625
  546    HA   HIS  73           HA       HIS  73   3.246  -2.321   7.378
  547    HB2  HIS  73           HB2      HIS  73   4.893  -4.155   7.475
  548    HB3  HIS  73           HB1      HIS  73   3.832  -5.041   8.562
  549    HD1  HIS  73           HD1      HIS  73   3.175  -3.371   5.175
  550    HD2  HIS  73           HD2      HIS  73   2.701  -6.990   7.165
  551    HE1  HIS  73           HE1      HIS  73   2.014  -4.927   3.558
  552    H    THR  74           HN       THR  74   2.385  -3.944  10.406
  553    HA   THR  74           HA       THR  74  -0.281  -4.532   9.564
  554    HB   THR  74           HB       THR  74  -0.547  -4.873  12.130
  555    HG1  THR  74           HG1      THR  74   1.272  -4.770  13.276
  556   HG21  THR  74          HG21      THR  74   0.628  -7.069  11.905
  557   HG22  THR  74          HG22      THR  74   1.266  -6.507  10.359
  558   HG23  THR  74          HG23      THR  74  -0.473  -6.699  10.579
  559    H    GLU  75           HN       GLU  75   1.182  -1.748  11.158
  560    HA   GLU  75           HA       GLU  75  -1.162  -0.718  12.289
  561    HB2  GLU  75           HB2      GLU  75   1.391   0.624  11.398
  562    HB3  GLU  75           HB1      GLU  75   0.023   1.514  11.965
  563    HG2  GLU  75           HG2      GLU  75   1.088  -0.702  13.604
  564    HG3  GLU  75           HG1      GLU  75   1.795   0.915  13.680
  565    H    VAL  76           HN       VAL  76   0.326  -0.286   9.143
  566    HA   VAL  76           HA       VAL  76  -1.696   1.501   8.204
  567    HB   VAL  76           HB       VAL  76  -0.662   1.361   6.046
  568   HG11  VAL  76          HG11      VAL  76   0.479   2.681   7.725
  569   HG12  VAL  76          HG12      VAL  76   1.654   1.940   6.635
  570   HG13  VAL  76          HG13      VAL  76   1.395   1.268   8.247
  571   HG21  VAL  76          HG21      VAL  76   1.069  -0.206   5.467
  572   HG22  VAL  76          HG22      VAL  76  -0.349  -1.108   6.008
  573   HG23  VAL  76          HG23      VAL  76   1.031  -0.907   7.085
  574    H    VAL  77           HN       VAL  77  -1.164  -1.971   8.076
  575    HA   VAL  77           HA       VAL  77  -3.162  -2.689   6.255
  576    HB   VAL  77           HB       VAL  77  -1.884  -4.107   8.579
  577   HG11  VAL  77          HG11      VAL  77  -4.264  -4.835   8.459
  578   HG12  VAL  77          HG12      VAL  77  -3.092  -6.116   8.159
  579   HG13  VAL  77          HG13      VAL  77  -3.961  -5.382   6.809
  580   HG21  VAL  77          HG21      VAL  77  -1.027  -5.570   6.811
  581   HG22  VAL  77          HG22      VAL  77  -0.606  -3.881   6.521
  582   HG23  VAL  77          HG23      VAL  77  -1.915  -4.634   5.610
  583    H    GLU  78           HN       GLU  78  -3.279  -2.401   9.786
  584    HA   GLU  78           HA       GLU  78  -6.002  -2.887  10.117
  585    HB2  GLU  78           HB2      GLU  78  -4.167  -1.172  11.697
  586    HB3  GLU  78           HB1      GLU  78  -5.767  -1.631  12.226
  587    HG2  GLU  78           HG2      GLU  78  -5.006  -3.980  11.891
  588    HG3  GLU  78           HG1      GLU  78  -3.374  -3.352  11.820
  589    H    LEU  79           HN       LEU  79  -4.246   0.084   9.812
  590    HA   LEU  79           HA       LEU  79  -6.177   2.007   9.930
  591    HB2  LEU  79           HB2      LEU  79  -3.563   1.874   8.994
  592    HB3  LEU  79           HB1      LEU  79  -4.477   2.479   7.626
  593    HG   LEU  79           HG       LEU  79  -5.425   4.221   9.239
  594   HD11  LEU  79          HD11      LEU  79  -4.693   3.066  11.294
  595   HD12  LEU  79          HD12      LEU  79  -4.100   4.724  11.193
  596   HD13  LEU  79          HD13      LEU  79  -3.017   3.375  10.844
  597   HD21  LEU  79          HD21      LEU  79  -2.775   4.036   7.990
  598   HD22  LEU  79          HD22      LEU  79  -2.966   5.328   9.178
  599   HD23  LEU  79          HD23      LEU  79  -4.051   5.242   7.789
  600    H    ILE  80           HN       ILE  80  -5.199   0.358   6.903
  601    HA   ILE  80           HA       ILE  80  -7.184   1.281   5.238
  602    HB   ILE  80           HB       ILE  80  -5.855  -1.421   5.359
  603   HG12  ILE  80          HG12      ILE  80  -5.141   0.768   3.475
  604   HG13  ILE  80          HG11      ILE  80  -4.589   0.864   5.131
  605   HG21  ILE  80          HG21      ILE  80  -6.415  -1.593   2.964
  606   HG22  ILE  80          HG22      ILE  80  -7.394  -0.133   3.119
  607   HG23  ILE  80          HG23      ILE  80  -7.830  -1.588   4.020
  608   HD11  ILE  80          HD11      ILE  80  -3.415  -1.160   4.949
  609   HD12  ILE  80          HD12      ILE  80  -2.966  -0.153   3.570
  610   HD13  ILE  80          HD13      ILE  80  -4.094  -1.495   3.357
  611    H    LEU  81           HN       LEU  81  -7.170  -1.749   7.091
  612    HA   LEU  81           HA       LEU  81  -9.712  -2.662   6.524
  613    HB2  LEU  81           HB2      LEU  81  -8.022  -2.906   8.995
  614    HB3  LEU  81           HB1      LEU  81  -9.567  -3.719   8.857
  615    HG   LEU  81           HG       LEU  81  -7.304  -4.126   6.906
  616   HD11  LEU  81          HD11      LEU  81  -6.827  -6.195   8.075
  617   HD12  LEU  81          HD12      LEU  81  -8.071  -5.832   9.271
  618   HD13  LEU  81          HD13      LEU  81  -6.631  -4.822   9.163
  619   HD21  LEU  81          HD21      LEU  81  -9.414  -4.706   5.960
  620   HD22  LEU  81          HD22      LEU  81  -9.901  -5.558   7.426
  621   HD23  LEU  81          HD23      LEU  81  -8.606  -6.204   6.419
  622    H    LYS  82           HN       LYS  82  -8.798  -0.360   9.079
  623    HA   LYS  82           HA       LYS  82 -11.349  -0.193  10.252
  624    HB2  LYS  82           HB2      LYS  82  -9.046   1.723  10.377
  625    HB3  LYS  82           HB1      LYS  82 -10.451   1.739  11.443
  626    HG2  LYS  82           HG2      LYS  82  -9.869  -0.641  12.005
  627    HG3  LYS  82           HG1      LYS  82  -8.351  -0.364  11.189
  628    HD2  LYS  82           HD2      LYS  82  -9.341   1.353  13.450
  629    HD3  LYS  82           HD1      LYS  82  -8.304  -0.052  13.693
  630    HE2  LYS  82           HE2      LYS  82  -6.560   0.957  12.363
  631    HE3  LYS  82           HE1      LYS  82  -7.609   2.310  11.950
  632    HZ1  LYS  82           HZ1      LYS  82  -6.533   1.657  14.641
  633    HZ2  LYS  82           HZ2      LYS  82  -7.672   2.871  14.340
  634    HZ3  LYS  82           HZ3      LYS  82  -6.125   2.984  13.675
  635    H    SER  83           HN       SER  83 -10.424   1.009   7.270
  636    HA   SER  83           HA       SER  83 -11.482   3.538   7.082
  637    HB2  SER  83           HB2      SER  83 -11.958   2.961   4.688
  638    HB3  SER  83           HB1      SER  83 -10.331   2.542   5.218
  639    HG   SER  83           HG       SER  83 -10.777   0.474   5.042
  640    H    GLY  84           HN       GLY  84 -13.297   0.642   6.065
  641    HA2  GLY  84           HA2      GLY  84 -15.494   0.121   6.851
  642    HA3  GLY  84           HA1      GLY  84 -15.714   1.816   7.253
  643    H    ASN  85           HN       ASN  85 -16.001  -0.607   4.866
  644    HA   ASN  85           HA       ASN  85 -17.199  -0.738   2.955
  645    HB2  ASN  85           HB2      ASN  85 -19.024   0.525   3.440
  646    HB3  ASN  85           HB1      ASN  85 -18.068   1.910   3.946
  647   HD21  ASN  85          HD21      ASN  85 -19.400   0.208   1.191
  648   HD22  ASN  85          HD22      ASN  85 -19.339   1.554   0.106
  649    H    LYS  86           HN       LYS  86 -15.204   2.185   3.181
  650    HA   LYS  86           HA       LYS  86 -13.861   1.392   0.766
  651    HB2  LYS  86           HB2      LYS  86 -14.044   3.574  -0.265
  652    HB3  LYS  86           HB1      LYS  86 -15.615   2.848  -0.062
  653    HG2  LYS  86           HG2      LYS  86 -15.704   4.192   2.134
  654    HG3  LYS  86           HG1      LYS  86 -14.398   5.112   1.398
  655    HD2  LYS  86           HD2      LYS  86 -15.994   5.241  -0.644
  656    HD3  LYS  86           HD1      LYS  86 -17.236   4.835   0.542
  657    HE2  LYS  86           HE2      LYS  86 -16.730   6.784   1.837
  658    HE3  LYS  86           HE1      LYS  86 -15.316   7.135   0.845
  659    HZ1  LYS  86           HZ1      LYS  86 -18.167   7.363   0.104
  660    HZ2  LYS  86           HZ2      LYS  86 -16.942   7.331  -1.059
  661    HZ3  LYS  86           HZ3      LYS  86 -16.978   8.570   0.092
  662    H    VAL  87           HN       VAL  87 -11.942   2.470   0.456
  663    HA   VAL  87           HA       VAL  87 -10.945   3.965   2.781
  664    HB   VAL  87           HB       VAL  87 -10.286   1.691   3.171
  665   HG11  VAL  87          HG11      VAL  87 -10.493   0.831   0.912
  666   HG12  VAL  87          HG12      VAL  87  -8.906   0.435   1.579
  667   HG13  VAL  87          HG13      VAL  87  -9.067   1.749   0.415
  668   HG21  VAL  87          HG21      VAL  87  -8.640   3.328   3.799
  669   HG22  VAL  87          HG22      VAL  87  -7.995   3.372   2.160
  670   HG23  VAL  87          HG23      VAL  87  -7.806   1.920   3.141
  671    H    ALA  88           HN       ALA  88  -9.857   5.713   2.252
  672    HA   ALA  88           HA       ALA  88  -9.188   6.168  -0.550
  673    HB1  ALA  88           HB1      ALA  88 -10.375   7.944   0.585
  674    HB2  ALA  88           HB2      ALA  88  -8.755   8.475   0.127
  675    HB3  ALA  88           HB3      ALA  88  -9.104   8.042   1.804
  676    H    ILE  89           HN       ILE  89  -7.365   5.314  -1.108
  677    HA   ILE  89           HA       ILE  89  -5.083   5.407   0.731
  678    HB   ILE  89           HB       ILE  89  -5.308   3.822  -1.827
  679   HG12  ILE  89          HG12      ILE  89  -6.191   3.228   0.959
  680   HG13  ILE  89          HG11      ILE  89  -6.879   2.742  -0.575
  681   HG21  ILE  89          HG21      ILE  89  -3.406   2.618  -1.012
  682   HG22  ILE  89          HG22      ILE  89  -3.417   3.548   0.486
  683   HG23  ILE  89          HG23      ILE  89  -3.036   4.344  -1.041
  684   HD11  ILE  89          HD11      ILE  89  -6.065   0.806   0.556
  685   HD12  ILE  89          HD12      ILE  89  -4.478   1.549   0.759
  686   HD13  ILE  89          HD13      ILE  89  -5.047   1.115  -0.853
  687    H    SER  90           HN       SER  90  -3.852   7.142   0.476
  688    HA   SER  90           HA       SER  90  -3.715   8.587  -2.004
  689    HB2  SER  90           HB2      SER  90  -1.907   9.006   0.369
  690    HB3  SER  90           HB1      SER  90  -2.492  10.196  -0.793
  691    HG   SER  90           HG       SER  90  -4.056  10.548   0.548
  692    H    THR  91           HN       THR  91  -2.529   7.858  -3.645
  693    HA   THR  91           HA       THR  91  -0.124   6.293  -3.064
  694    HB   THR  91           HB       THR  91  -0.382   5.866  -5.657
  695    HG1  THR  91           HG1      THR  91  -2.682   5.854  -6.158
  696   HG21  THR  91          HG21      THR  91  -0.535   4.060  -4.115
  697   HG22  THR  91          HG22      THR  91  -1.980   3.980  -5.129
  698   HG23  THR  91          HG23      THR  91  -2.082   4.636  -3.492
  699    H    THR  92           HN       THR  92   1.716   6.565  -4.456
  700    HA   THR  92           HA       THR  92   2.064   8.930  -6.036
  701    HB   THR  92           HB       THR  92   2.411  10.039  -3.939
  702    HG1  THR  92           HG1      THR  92   4.956   9.288  -4.992
  703   HG21  THR  92          HG21      THR  92   2.657   8.051  -2.523
  704   HG22  THR  92          HG22      THR  92   3.927   9.234  -2.206
  705   HG23  THR  92          HG23      THR  92   4.282   7.797  -3.165
  706    HA   PRO  93           HA       PRO  93   4.890   6.265  -8.180
  707    HB2  PRO  93           HB2      PRO  93   6.832   8.513  -7.977
  708    HB3  PRO  93           HB1      PRO  93   6.377   7.553  -9.384
  709    HG2  PRO  93           HG2      PRO  93   5.401  10.007  -9.067
  710    HG3  PRO  93           HG1      PRO  93   4.374   8.697  -9.683
  711    HD2  PRO  93           HD2      PRO  93   4.404   9.977  -6.993
  712    HD3  PRO  93           HD1      PRO  93   3.044   9.291  -7.902
  713    H    LEU  94           HN       LEU  94   6.637   4.969  -7.885
  714    HA   LEU  94           HA       LEU  94   8.056   5.190  -5.316
  715    HB2  LEU  94           HB2      LEU  94   6.686   3.245  -5.217
  716    HB3  LEU  94           HB1      LEU  94   7.108   2.774  -6.850
  717    HG   LEU  94           HG       LEU  94   9.410   2.266  -6.094
  718   HD11  LEU  94          HD11      LEU  94   8.339   2.744  -3.319
  719   HD12  LEU  94          HD12      LEU  94   9.456   3.808  -4.173
  720   HD13  LEU  94          HD13      LEU  94   9.951   2.169  -3.746
  721   HD21  LEU  94          HD21      LEU  94   8.858   0.211  -4.929
  722   HD22  LEU  94          HD22      LEU  94   7.693   0.523  -6.216
  723   HD23  LEU  94          HD23      LEU  94   7.259   0.843  -4.537
  724    H    GLU  95           HN       GLU  95   9.617   6.502  -6.341
  725    HA   GLU  95           HA       GLU  95  11.395   5.022  -8.160
  726    HB2  GLU  95           HB2      GLU  95  11.737   7.918  -8.146
  727    HB3  GLU  95           HB1      GLU  95  11.589   6.815  -9.505
  728    HG2  GLU  95           HG2      GLU  95   9.070   6.778  -8.916
  729    HG3  GLU  95           HG1      GLU  95   9.430   8.239  -7.997
  730    H    ASN  96           HN       ASN  96  13.086   4.348  -7.091
  731    HA   ASN  96           HA       ASN  96  14.465   6.172  -5.264
  732    HB2  ASN  96           HB2      ASN  96  13.073   4.619  -3.899
  733    HB3  ASN  96           HB1      ASN  96  13.912   3.260  -4.636
  734   HD21  ASN  96          HD21      ASN  96  15.930   2.716  -3.946
  735   HD22  ASN  96          HD22      ASN  96  16.708   3.456  -2.590
  736    H2   PRO  97           HT1      PRO  97  11.722  -1.690 -11.769
  737    H3   PRO  97           HT2      PRO  97  11.129  -0.169 -11.717
  738    HA   PRO  97           HA       PRO  97   9.438  -0.686 -10.563
  739    HB2  PRO  97           HB2      PRO  97   8.551  -3.256 -11.299
  740    HB3  PRO  97           HB1      PRO  97   7.833  -1.705 -11.769
  741    HG2  PRO  97           HG2      PRO  97   9.751  -3.432 -13.247
  742    HG3  PRO  97           HG1      PRO  97   8.477  -2.371 -13.874
  743    HD2  PRO  97           HD2      PRO  97  11.048  -1.670 -14.048
  744    HD3  PRO  97           HD1      PRO  97   9.799  -0.464 -13.696
  745    H    PHE  98           HN       PHE  98   8.965  -2.035  -8.720
  746    HA   PHE  98           HA       PHE  98  11.339  -3.490  -7.828
  747    HB2  PHE  98           HB2      PHE  98   8.989  -2.244  -6.428
  748    HB3  PHE  98           HB1      PHE  98   9.977  -3.442  -5.606
  749    HD1  PHE  98           HD1      PHE  98  10.971  -0.707  -7.923
  750    HD2  PHE  98           HD2      PHE  98  11.134  -2.277  -3.971
  751    HE1  PHE  98           HE1      PHE  98  12.579   1.045  -7.295
  752    HE2  PHE  98           HE2      PHE  98  12.735  -0.525  -3.337
  753    HZ   PHE  98           HZ       PHE  98  13.418   1.166  -4.964
  754    H    ASP  99           HN       ASP  99  11.375  -5.639  -7.994
  755    HA   ASP  99           HA       ASP  99   9.079  -7.210  -7.257
  756    HB2  ASP  99           HB2      ASP  99   8.561  -8.217  -9.278
  757    HB3  ASP  99           HB1      ASP  99   8.880  -6.563  -9.781
  758    H    GLU 100           HN       GLU 100   9.660  -9.059  -6.369
  759    HA   GLU 100           HA       GLU 100  10.958 -10.646  -5.411
  760    HB2  GLU 100           HB2      GLU 100  11.391 -10.741  -8.277
  761    HB3  GLU 100           HB1      GLU 100  12.740 -11.426  -7.379
  762    HG2  GLU 100           HG2      GLU 100  11.022 -13.080  -8.020
  763    HG3  GLU 100           HG1      GLU 100  11.301 -12.988  -6.282
  764    H    ASP 101           HN       ASP 101  11.992  -7.893  -5.162
  765    HA   ASP 101           HA       ASP 101  14.867  -8.473  -4.969
  766    HB2  ASP 101           HB2      ASP 101  15.262  -6.105  -4.966
  767    HB3  ASP 101           HB1      ASP 101  14.160  -6.463  -6.292
  768    H    GLN 102           HN       GLN 102  12.061  -7.419  -3.163
  769    HA   GLN 102           HA       GLN 102  13.532  -7.930  -0.664
  770    HB2  GLN 102           HB2      GLN 102  11.613  -5.668  -1.254
  771    HB3  GLN 102           HB1      GLN 102  12.125  -6.108   0.368
  772    HG2  GLN 102           HG2      GLN 102  14.326  -5.440  -0.018
  773    HG3  GLN 102           HG1      GLN 102  14.104  -5.416  -1.766
  774   HE21  GLN 102          HE21      GLN 102  13.209  -3.640  -2.738
  775   HE22  GLN 102          HE22      GLN 102  12.902  -2.161  -1.883
  776    H    HIS 103           HN       HIS 103  12.550  -9.401   0.599
  777    HA   HIS 103           HA       HIS 103   9.665  -9.864   0.205
  778    HB2  HIS 103           HB2      HIS 103  11.851 -11.926   0.551
  779    HB3  HIS 103           HB1      HIS 103  10.137 -12.296   0.693
  780    HD2  HIS 103           HD2      HIS 103   8.673 -11.728  -1.777
  781    HE1  HIS 103           HE1      HIS 103  12.152 -12.403  -4.085
  782    HE2  HIS 103           HE2      HIS 103   9.636 -12.088  -4.168
  783    H    THR 104           HN       THR 104  10.596  -8.133   2.111
  784    HA   THR 104           HA       THR 104  11.034  -9.317   4.633
  785    HB   THR 104           HB       THR 104   9.789  -6.637   4.537
  786    HG1  THR 104           HG1      THR 104  12.344  -7.179   3.372
  787   HG21  THR 104          HG21      THR 104  11.665  -6.098   6.011
  788   HG22  THR 104          HG22      THR 104  12.370  -7.687   5.714
  789   HG23  THR 104          HG23      THR 104  10.836  -7.549   6.573
  790    H    GLN 105           HN       GLN 105   8.230  -7.200   4.039
  791    HA   GLN 105           HA       GLN 105   6.591  -9.227   5.412
  792    HB2  GLN 105           HB2      GLN 105   6.950  -6.377   5.864
  793    HB3  GLN 105           HB1      GLN 105   5.257  -6.822   5.705
  794    HG2  GLN 105           HG2      GLN 105   7.147  -8.230   7.564
  795    HG3  GLN 105           HG1      GLN 105   6.205  -6.817   8.039
  796   HE21  GLN 105          HE21      GLN 105   5.025  -7.916   9.572
  797   HE22  GLN 105          HE22      GLN 105   3.811  -9.084   9.167
  798    H    ILE 106           HN       ILE 106   4.503  -9.606   4.710
  799    HA   ILE 106           HA       ILE 106   3.472  -8.227   2.382
  800    HB   ILE 106           HB       ILE 106   4.714  -9.723   1.105
  801   HG12  ILE 106          HG12      ILE 106   2.118 -11.210   1.555
  802   HG13  ILE 106          HG11      ILE 106   2.287  -9.777   0.547
  803   HG21  ILE 106          HG21      ILE 106   5.588 -11.088   2.892
  804   HG22  ILE 106          HG22      ILE 106   4.978 -12.110   1.590
  805   HG23  ILE 106          HG23      ILE 106   4.033 -11.902   3.065
  806   HD11  ILE 106          HD11      ILE 106   3.581 -10.928  -1.040
  807   HD12  ILE 106          HD12      ILE 106   2.246 -12.007  -0.633
  808   HD13  ILE 106          HD13      ILE 106   3.848 -12.287   0.049
  809    H    THR 107           HN       THR 107   1.363  -7.973   2.711
  810    HA   THR 107           HA       THR 107  -0.203 -10.140   3.891
  811    HB   THR 107           HB       THR 107  -0.284  -7.319   4.985
  812    HG1  THR 107           HG1      THR 107   1.482  -8.160   5.916
  813   HG21  THR 107          HG21      THR 107  -2.452  -8.427   5.082
  814   HG22  THR 107          HG22      THR 107  -1.763  -8.299   6.700
  815   HG23  THR 107          HG23      THR 107  -1.719  -9.839   5.842
  816    H    LYS 108           HN       LYS 108  -1.820 -10.484   2.579
  817    HA   LYS 108           HA       LYS 108  -2.754  -8.481   0.742
  818    HB2  LYS 108           HB2      LYS 108  -3.747 -11.272   1.362
  819    HB3  LYS 108           HB1      LYS 108  -4.381 -10.258   0.073
  820    HG2  LYS 108           HG2      LYS 108  -2.251 -10.269  -1.051
  821    HG3  LYS 108           HG1      LYS 108  -1.516 -11.158   0.283
  822    HD2  LYS 108           HD2      LYS 108  -2.937 -13.071  -0.175
  823    HD3  LYS 108           HD1      LYS 108  -3.759 -12.181  -1.455
  824    HE2  LYS 108           HE2      LYS 108  -0.799 -12.742  -1.470
  825    HE3  LYS 108           HE1      LYS 108  -1.988 -13.810  -2.214
  826    HZ1  LYS 108           HZ1      LYS 108  -2.649 -12.057  -3.685
  827    HZ2  LYS 108           HZ2      LYS 108  -0.972 -12.241  -3.787
  828    HZ3  LYS 108           HZ3      LYS 108  -1.627 -10.946  -2.917
  829    H    VAL 109           HN       VAL 109  -4.451  -7.100   1.074
  830    HA   VAL 109           HA       VAL 109  -6.076  -7.558   3.469
  831    HB   VAL 109           HB       VAL 109  -4.432  -5.769   3.806
  832   HG11  VAL 109          HG11      VAL 109  -5.765  -4.386   1.486
  833   HG12  VAL 109          HG12      VAL 109  -4.154  -5.107   1.472
  834   HG13  VAL 109          HG13      VAL 109  -4.493  -3.720   2.511
  835   HG21  VAL 109          HG21      VAL 109  -5.993  -3.950   4.440
  836   HG22  VAL 109          HG22      VAL 109  -6.506  -5.544   4.988
  837   HG23  VAL 109          HG23      VAL 109  -7.278  -4.804   3.586
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1   4.384  19.440  -3.069
    2    H2   GLY   1           HT2      GLY   1   3.876  20.577  -4.210
    3    H3   GLY   1           HT3      GLY   1   3.685  18.928  -4.521
    4    HA2  GLY   1           HA1      GLY   1   2.313  20.446  -2.380
    5    HA3  GLY   1           HA2      GLY   1   1.585  19.952  -3.900
    6    H    GLY   2           HN       GLY   2   0.857  19.282  -1.138
    7    HA2  GLY   2           HA2      GLY   2   1.588  16.516  -0.763
    8    HA3  GLY   2           HA1      GLY   2   0.450  17.439   0.205
    9    H    SER   3           HN       SER   3  -1.701  17.807  -0.728
   10    HA   SER   3           HA       SER   3  -2.732  15.367  -1.820
   11    HB2  SER   3           HB2      SER   3  -4.366  17.863  -1.573
   12    HB3  SER   3           HB1      SER   3  -4.825  16.191  -1.250
   13    HG   SER   3           HG       SER   3  -3.334  16.309   0.571
   14    H    MET   4           HN       MET   4  -2.540  14.924  -3.905
   15    HA   MET   4           HA       MET   4  -3.374  16.936  -5.862
   16    HB2  MET   4           HB2      MET   4  -0.949  17.086  -5.853
   17    HB3  MET   4           HB1      MET   4  -0.809  15.341  -6.005
   18    HG2  MET   4           HG2      MET   4  -0.358  16.431  -8.119
   19    HG3  MET   4           HG1      MET   4  -1.811  15.439  -8.220
   20    HE1  MET   4           HE1      MET   4  -2.543  18.451 -10.647
   21    HE2  MET   4           HE2      MET   4  -2.464  16.696 -10.501
   22    HE3  MET   4           HE3      MET   4  -0.993  17.660 -10.362
   23    H    ARG   5           HN       ARG   5  -2.507  13.571  -5.212
   24    HA   ARG   5           HA       ARG   5  -4.071  12.658  -7.485
   25    HB2  ARG   5           HB2      ARG   5  -2.202  11.340  -5.555
   26    HB3  ARG   5           HB1      ARG   5  -3.314  10.361  -6.497
   27    HG2  ARG   5           HG2      ARG   5  -1.314  10.364  -7.713
   28    HG3  ARG   5           HG1      ARG   5  -2.359  11.513  -8.548
   29    HD2  ARG   5           HD2      ARG   5  -1.235  13.339  -7.232
   30    HD3  ARG   5           HD1      ARG   5  -0.084  12.127  -6.668
   31    HE   ARG   5           HE       ARG   5  -0.180  12.032  -9.468
   32   HH11  ARG   5          HH11      ARG   5   0.932  14.128  -6.890
   33   HH12  ARG   5          HH12      ARG   5   2.121  14.921  -7.877
   34   HH21  ARG   5          HH21      ARG   5   1.390  13.075 -10.767
   35   HH22  ARG   5          HH22      ARG   5   2.365  14.336 -10.080
   36    HA   PRO   6           HA       PRO   6  -7.699  12.221  -4.959
   37    HB2  PRO   6           HB2      PRO   6  -9.172  10.764  -6.714
   38    HB3  PRO   6           HB1      PRO   6  -8.897  12.494  -6.896
   39    HG2  PRO   6           HG2      PRO   6  -7.481  10.202  -8.184
   40    HG3  PRO   6           HG1      PRO   6  -8.119  11.684  -8.908
   41    HD2  PRO   6           HD2      PRO   6  -5.514  11.421  -8.323
   42    HD3  PRO   6           HD1      PRO   6  -6.349  12.978  -8.141
   43    HA   PRO   7           HA       PRO   7  -6.792   8.259  -3.100
   44    HB2  PRO   7           HB2      PRO   7  -9.201   8.696  -1.491
   45    HB3  PRO   7           HB1      PRO   7  -7.519   8.560  -0.974
   46    HG2  PRO   7           HG2      PRO   7  -8.866  10.888  -0.900
   47    HG3  PRO   7           HG1      PRO   7  -7.123  10.811  -1.225
   48    HD2  PRO   7           HD2      PRO   7  -9.395  11.188  -3.141
   49    HD3  PRO   7           HD1      PRO   7  -7.798  11.965  -3.113
   50    H    ILE   8           HN       ILE   8  -7.587   6.211  -3.059
   51    HA   ILE   8           HA       ILE   8  -9.842   5.633  -4.801
   52    HB   ILE   8           HB       ILE   8  -7.802   3.795  -3.549
   53   HG12  ILE   8          HG12      ILE   8  -7.029   5.589  -5.252
   54   HG13  ILE   8          HG11      ILE   8  -6.519   3.925  -5.486
   55   HG21  ILE   8          HG21      ILE   8  -8.567   2.288  -5.467
   56   HG22  ILE   8          HG22      ILE   8  -9.981   3.339  -5.548
   57   HG23  ILE   8          HG23      ILE   8  -9.627   2.450  -4.067
   58   HD11  ILE   8          HD11      ILE   8  -8.875   5.146  -6.883
   59   HD12  ILE   8          HD12      ILE   8  -8.099   3.594  -7.223
   60   HD13  ILE   8          HD13      ILE   8  -7.243   5.103  -7.549
   61    H    ILE   9           HN       ILE   9 -11.617   6.084  -3.422
   62    HA   ILE   9           HA       ILE   9 -11.795   5.100  -0.774
   63    HB   ILE   9           HB       ILE   9 -13.883   6.147  -2.674
   64   HG12  ILE   9          HG12      ILE   9 -13.906   8.090  -1.343
   65   HG13  ILE   9          HG11      ILE   9 -12.928   7.354  -0.101
   66   HG21  ILE   9          HG21      ILE   9 -15.280   6.302  -0.521
   67   HG22  ILE   9          HG22      ILE   9 -14.197   5.045   0.080
   68   HG23  ILE   9          HG23      ILE   9 -15.179   4.750  -1.355
   69   HD11  ILE   9          HD11      ILE   9 -11.007   7.425  -1.580
   70   HD12  ILE   9          HD12      ILE   9 -11.712   9.031  -1.379
   71   HD13  ILE   9          HD13      ILE   9 -12.009   8.113  -2.857
   72    H    ILE  10           HN       ILE  10 -11.499   2.951  -0.619
   73    HA   ILE  10           HA       ILE  10 -13.076   1.112  -2.234
   74    HB   ILE  10           HB       ILE  10 -10.985   0.514  -0.150
   75   HG12  ILE  10          HG12      ILE  10 -10.592   0.478  -3.128
   76   HG13  ILE  10          HG11      ILE  10 -10.275   1.918  -2.174
   77   HG21  ILE  10          HG21      ILE  10 -12.363  -1.388  -0.558
   78   HG22  ILE  10          HG22      ILE  10 -10.847  -1.637  -1.429
   79   HG23  ILE  10          HG23      ILE  10 -12.294  -1.135  -2.301
   80   HD11  ILE  10          HD11      ILE  10  -8.615   0.683  -0.880
   81   HD12  ILE  10          HD12      ILE  10  -8.242   0.669  -2.605
   82   HD13  ILE  10          HD13      ILE  10  -8.944  -0.758  -1.841
   83    H    HIS  11           HN       HIS  11 -14.711  -0.045  -1.477
   84    HA   HIS  11           HA       HIS  11 -15.771   0.575   1.131
   85    HB2  HIS  11           HB2      HIS  11 -16.711  -1.100  -1.188
   86    HB3  HIS  11           HB1      HIS  11 -17.573  -1.077   0.348
   87    HD2  HIS  11           HD2      HIS  11 -16.625   2.398   0.124
   88    HE1  HIS  11           HE1      HIS  11 -20.053   2.126  -2.339
   89    HE2  HIS  11           HE2      HIS  11 -18.598   3.686  -0.966
   90    H    ARG  12           HN       ARG  12 -16.318  -1.032   2.707
   91    HA   ARG  12           HA       ARG  12 -14.248  -2.892   3.220
   92    HB2  ARG  12           HB2      ARG  12 -15.667  -3.494   5.167
   93    HB3  ARG  12           HB1      ARG  12 -15.420  -1.765   5.013
   94    HG2  ARG  12           HG2      ARG  12 -17.612  -1.471   4.109
   95    HG3  ARG  12           HG1      ARG  12 -17.867  -3.216   4.040
   96    HD2  ARG  12           HD2      ARG  12 -17.831  -3.378   6.397
   97    HD3  ARG  12           HD1      ARG  12 -17.322  -1.711   6.581
   98    HE   ARG  12           HE       ARG  12 -19.901  -2.255   5.313
   99   HH11  ARG  12          HH11      ARG  12 -18.129  -1.095   8.120
  100   HH12  ARG  12          HH12      ARG  12 -19.499  -0.270   8.792
  101   HH21  ARG  12          HH21      ARG  12 -21.699  -1.182   6.219
  102   HH22  ARG  12          HH22      ARG  12 -21.523  -0.331   7.724
  103    H    ALA  13           HN       ALA  13 -14.784  -5.227   3.815
  104    HA   ALA  13           HA       ALA  13 -16.914  -6.476   2.345
  105    HB1  ALA  13           HB1      ALA  13 -15.535  -7.762   0.827
  106    HB2  ALA  13           HB2      ALA  13 -14.079  -6.990   1.453
  107    HB3  ALA  13           HB3      ALA  13 -15.270  -6.039   0.565
  108    H    GLY  14           HN       GLY  14 -14.841  -8.855   2.202
  109    HA2  GLY  14           HA2      GLY  14 -15.627  -9.930   4.775
  110    HA3  GLY  14           HA1      GLY  14 -14.819 -10.799   3.481
  111    H    LYS  15           HN       LYS  15 -12.697 -11.171   3.639
  112    HA   LYS  15           HA       LYS  15 -11.345 -10.278   6.039
  113    HB2  LYS  15           HB2      LYS  15 -11.039 -12.456   4.121
  114    HB3  LYS  15           HB1      LYS  15  -9.507 -11.718   4.563
  115    HG2  LYS  15           HG2      LYS  15 -11.304 -12.305   6.810
  116    HG3  LYS  15           HG1      LYS  15 -10.687 -13.711   5.943
  117    HD2  LYS  15           HD2      LYS  15  -9.137 -13.298   7.675
  118    HD3  LYS  15           HD1      LYS  15  -8.384 -12.687   6.204
  119    HE2  LYS  15           HE2      LYS  15  -8.021 -11.088   7.949
  120    HE3  LYS  15           HE1      LYS  15  -9.185 -10.409   6.814
  121    HZ1  LYS  15           HZ1      LYS  15  -9.796 -10.057   9.148
  122    HZ2  LYS  15           HZ2      LYS  15  -9.899 -11.727   9.375
  123    HZ3  LYS  15           HZ3      LYS  15 -10.960 -10.952   8.314
  124    H    LYS  16           HN       LYS  16 -11.551  -9.329   2.772
  125    HA   LYS  16           HA       LYS  16  -9.450  -7.369   3.237
  126    HB2  LYS  16           HB2      LYS  16  -8.311  -7.783   1.146
  127    HB3  LYS  16           HB1      LYS  16  -8.354  -9.255   2.070
  128    HG2  LYS  16           HG2      LYS  16 -10.487  -9.735   0.637
  129    HG3  LYS  16           HG1      LYS  16  -9.725  -8.581  -0.456
  130    HD2  LYS  16           HD2      LYS  16  -8.461 -11.095   0.620
  131    HD3  LYS  16           HD1      LYS  16  -9.103 -10.885  -1.006
  132    HE2  LYS  16           HE2      LYS  16  -7.422  -8.876  -1.075
  133    HE3  LYS  16           HE1      LYS  16  -6.625  -9.756   0.231
  134    HZ1  LYS  16           HZ1      LYS  16  -7.205 -10.793  -2.501
  135    HZ2  LYS  16           HZ2      LYS  16  -6.522 -11.699  -1.246
  136    HZ3  LYS  16           HZ3      LYS  16  -5.680 -10.375  -1.882
  137    H    TYR  17           HN       TYR  17  -9.494  -5.585   1.772
  138    HA   TYR  17           HA       TYR  17 -12.170  -4.793   1.068
  139    HB2  TYR  17           HB2      TYR  17  -9.474  -3.492   0.646
  140    HB3  TYR  17           HB1      TYR  17 -10.991  -2.757   0.164
  141    HD1  TYR  17           HD2      TYR  17  -8.919  -3.758   2.992
  142    HD2  TYR  17           HD1      TYR  17 -12.469  -1.767   1.791
  143    HE1  TYR  17           HE2      TYR  17  -9.120  -2.814   5.233
  144    HE2  TYR  17           HE1      TYR  17 -12.695  -0.792   4.037
  145    HH   TYR  17           HH       TYR  17 -10.373  -0.521   6.169
  146    H    GLY  18           HN       GLY  18 -10.191  -6.886  -0.330
  147    HA2  GLY  18           HA2      GLY  18 -10.863  -7.833  -2.451
  148    HA3  GLY  18           HA1      GLY  18 -11.204  -6.206  -3.006
  149    H    PHE  19           HN       PHE  19  -8.354  -6.403  -1.214
  150    HA   PHE  19           HA       PHE  19  -6.774  -7.051  -3.547
  151    HB2  PHE  19           HB2      PHE  19  -5.534  -5.050  -3.664
  152    HB3  PHE  19           HB1      PHE  19  -7.217  -4.620  -3.695
  153    HD1  PHE  19           HD1      PHE  19  -8.277  -3.651  -1.615
  154    HD2  PHE  19           HD2      PHE  19  -4.079  -4.228  -2.020
  155    HE1  PHE  19           HE1      PHE  19  -7.883  -2.067   0.228
  156    HE2  PHE  19           HE2      PHE  19  -3.681  -2.654  -0.172
  157    HZ   PHE  19           HZ       PHE  19  -5.583  -1.572   0.953
  158    H    THR  20           HN       THR  20  -4.595  -7.134  -3.253
  159    HA   THR  20           HA       THR  20  -3.842  -8.126  -0.581
  160    HB   THR  20           HB       THR  20  -2.771  -8.830  -3.322
  161    HG1  THR  20           HG1      THR  20  -3.789 -10.744  -2.992
  162   HG21  THR  20          HG21      THR  20  -1.260 -10.395  -2.225
  163   HG22  THR  20          HG22      THR  20  -1.841  -9.884  -0.640
  164   HG23  THR  20          HG23      THR  20  -0.930  -8.758  -1.650
  165    H    LEU  21           HN       LEU  21  -2.578  -6.799   0.510
  166    HA   LEU  21           HA       LEU  21  -1.016  -4.802  -0.922
  167    HB2  LEU  21           HB2      LEU  21  -2.390  -4.039   0.954
  168    HB3  LEU  21           HB1      LEU  21  -1.568  -5.158   2.023
  169    HG   LEU  21           HG       LEU  21   0.555  -3.904   1.611
  170   HD11  LEU  21          HD11      LEU  21  -0.161  -2.921  -0.554
  171   HD12  LEU  21          HD12      LEU  21   0.502  -1.751   0.585
  172   HD13  LEU  21          HD13      LEU  21  -1.242  -1.853   0.342
  173   HD21  LEU  21          HD21      LEU  21  -1.736  -2.298   2.726
  174   HD22  LEU  21          HD22      LEU  21  -0.023  -2.029   3.046
  175   HD23  LEU  21          HD23      LEU  21  -0.800  -3.512   3.598
  176    H    ARG  22           HN       ARG  22   1.137  -4.961  -1.159
  177    HA   ARG  22           HA       ARG  22   2.534  -6.945   0.496
  178    HB2  ARG  22           HB2      ARG  22   2.767  -6.556  -2.485
  179    HB3  ARG  22           HB1      ARG  22   3.936  -7.462  -1.545
  180    HG2  ARG  22           HG2      ARG  22   1.688  -8.719  -0.770
  181    HG3  ARG  22           HG1      ARG  22   1.196  -8.174  -2.366
  182    HD2  ARG  22           HD2      ARG  22   2.133 -10.358  -2.590
  183    HD3  ARG  22           HD1      ARG  22   3.243  -9.197  -3.313
  184    HE   ARG  22           HE       ARG  22   4.129  -9.525  -0.735
  185   HH11  ARG  22          HH11      ARG  22   3.548 -11.613  -3.485
  186   HH12  ARG  22          HH12      ARG  22   4.762 -12.765  -3.030
  187   HH21  ARG  22          HH21      ARG  22   5.751 -11.057  -0.135
  188   HH22  ARG  22          HH22      ARG  22   6.014 -12.445  -1.144
  189    H    ALA  23           HN       ALA  23   4.285  -6.230   1.431
  190    HA   ALA  23           HA       ALA  23   5.123  -3.497   0.930
  191    HB1  ALA  23           HB1      ALA  23   4.690  -4.544   3.236
  192    HB2  ALA  23           HB2      ALA  23   6.131  -3.547   3.033
  193    HB3  ALA  23           HB3      ALA  23   6.266  -5.306   3.028
  194    H    ILE  24           HN       ILE  24   6.387  -3.420  -0.843
  195    HA   ILE  24           HA       ILE  24   8.429  -5.411  -1.313
  196    HB   ILE  24           HB       ILE  24   9.045  -3.887  -3.264
  197   HG12  ILE  24          HG12      ILE  24   6.354  -2.629  -2.725
  198   HG13  ILE  24          HG11      ILE  24   7.863  -1.881  -2.211
  199   HG21  ILE  24          HG21      ILE  24   6.262  -5.029  -3.143
  200   HG22  ILE  24          HG22      ILE  24   7.737  -5.921  -3.515
  201   HG23  ILE  24          HG23      ILE  24   7.164  -4.665  -4.613
  202   HD11  ILE  24          HD11      ILE  24   7.115  -2.560  -5.044
  203   HD12  ILE  24          HD12      ILE  24   8.606  -1.775  -4.523
  204   HD13  ILE  24          HD13      ILE  24   7.057  -0.957  -4.313
  205    H    ARG  25           HN       ARG  25  10.524  -5.253  -0.820
  206    HA   ARG  25           HA       ARG  25  11.333  -2.944   0.761
  207    HB2  ARG  25           HB2      ARG  25  11.689  -5.289   1.550
  208    HB3  ARG  25           HB1      ARG  25  12.840  -5.503   0.243
  209    HG2  ARG  25           HG2      ARG  25  14.440  -4.257   1.253
  210    HG3  ARG  25           HG1      ARG  25  13.271  -3.192   2.038
  211    HD2  ARG  25           HD2      ARG  25  14.009  -6.003   2.843
  212    HD3  ARG  25           HD1      ARG  25  14.356  -4.515   3.728
  213    HE   ARG  25           HE       ARG  25  11.551  -4.925   3.269
  214   HH11  ARG  25          HH11      ARG  25  14.226  -5.756   5.376
  215   HH12  ARG  25          HH12      ARG  25  13.206  -6.087   6.740
  216   HH21  ARG  25          HH21      ARG  25  10.215  -5.367   5.054
  217   HH22  ARG  25          HH22      ARG  25  10.924  -5.878   6.554
  218    H    VAL  26           HN       VAL  26  12.277  -1.311  -0.170
  219    HA   VAL  26           HA       VAL  26  13.939  -1.744  -2.558
  220    HB   VAL  26           HB       VAL  26  12.510   0.729  -1.536
  221   HG11  VAL  26          HG11      VAL  26  13.327   1.824  -3.626
  222   HG12  VAL  26          HG12      VAL  26  14.415   0.454  -3.856
  223   HG13  VAL  26          HG13      VAL  26  14.588   1.492  -2.440
  224   HG21  VAL  26          HG21      VAL  26  12.148  -0.900  -4.043
  225   HG22  VAL  26          HG22      VAL  26  11.293   0.594  -3.662
  226   HG23  VAL  26          HG23      VAL  26  11.052  -0.837  -2.661
  227    H    TYR  27           HN       TYR  27  16.054  -0.695  -2.545
  228    HA   TYR  27           HA       TYR  27  16.910  -0.104   0.206
  229    HB2  TYR  27           HB2      TYR  27  18.115  -1.691  -1.933
  230    HB3  TYR  27           HB1      TYR  27  19.228  -0.635  -1.096
  231    HD1  TYR  27           HD2      TYR  27  16.549  -3.132  -0.368
  232    HD2  TYR  27           HD1      TYR  27  20.248  -1.403   0.834
  233    HE1  TYR  27           HE2      TYR  27  16.701  -4.754   1.476
  234    HE2  TYR  27           HE1      TYR  27  20.403  -3.014   2.681
  235    HH   TYR  27           HH       TYR  27  18.526  -5.778   2.894
  236    H    MET  28           HN       MET  28  18.261   1.552   0.605
  237    HA   MET  28           HA       MET  28  18.133   3.770  -1.224
  238    HB2  MET  28           HB2      MET  28  19.212   3.397   1.571
  239    HB3  MET  28           HB1      MET  28  19.416   4.884   0.680
  240    HG2  MET  28           HG2      MET  28  16.801   3.632   1.445
  241    HG3  MET  28           HG1      MET  28  17.557   5.013   2.221
  242    HE1  MET  28           HE1      MET  28  14.762   5.630   1.596
  243    HE2  MET  28           HE2      MET  28  14.828   7.089   0.607
  244    HE3  MET  28           HE3      MET  28  15.919   6.903   1.981
  245    H    GLY  29           HN       GLY  29  19.569   3.796  -2.855
  246    HA2  GLY  29           HA2      GLY  29  21.949   2.302  -2.948
  247    HA3  GLY  29           HA1      GLY  29  21.532   3.620  -4.028
  248    H    ASP  30           HN       ASP  30  21.324   5.321  -1.466
  249    HA   ASP  30           HA       ASP  30  24.034   6.273  -1.580
  250    HB2  ASP  30           HB2      ASP  30  23.168   8.222  -0.869
  251    HB3  ASP  30           HB1      ASP  30  21.599   7.469  -1.125
  252    H    SER  31           HN       SER  31  22.450   3.954   0.300
  253    HA   SER  31           HA       SER  31  24.727   3.758   2.060
  254    HB2  SER  31           HB2      SER  31  23.022   3.700   4.077
  255    HB3  SER  31           HB1      SER  31  23.671   5.229   3.497
  256    HG   SER  31           HG       SER  31  21.770   5.526   2.283
  257    H    ASP  32           HN       ASP  32  23.182   2.117   4.006
  258    HA   ASP  32           HA       ASP  32  22.746  -0.249   2.298
  259    HB2  ASP  32           HB2      ASP  32  24.724  -0.139   3.971
  260    HB3  ASP  32           HB1      ASP  32  23.498  -0.387   5.202
  261    H    VAL  33           HN       VAL  33  21.192   1.987   4.014
  262    HA   VAL  33           HA       VAL  33  19.352   0.393   5.521
  263    HB   VAL  33           HB       VAL  33  19.760   2.635   6.275
  264   HG11  VAL  33          HG11      VAL  33  19.128   4.600   4.985
  265   HG12  VAL  33          HG12      VAL  33  18.639   3.564   3.644
  266   HG13  VAL  33          HG13      VAL  33  20.334   3.640   4.126
  267   HG21  VAL  33          HG21      VAL  33  16.976   2.630   5.143
  268   HG22  VAL  33          HG22      VAL  33  17.547   3.443   6.604
  269   HG23  VAL  33          HG23      VAL  33  17.462   1.680   6.551
  270    H    TYR  34           HN       TYR  34  17.159   0.075   5.101
  271    HA   TYR  34           HA       TYR  34  16.543  -0.037   2.231
  272    HB2  TYR  34           HB2      TYR  34  15.024  -1.798   2.642
  273    HB3  TYR  34           HB1      TYR  34  16.464  -2.176   3.555
  274    HD1  TYR  34           HD1      TYR  34  16.425  -2.107   6.018
  275    HD2  TYR  34           HD2      TYR  34  12.936  -1.274   3.730
  276    HE1  TYR  34           HE1      TYR  34  15.039  -2.384   8.031
  277    HE2  TYR  34           HE2      TYR  34  11.547  -1.538   5.735
  278    HH   TYR  34           HH       TYR  34  12.821  -1.643   8.860
  279    H    THR  35           HN       THR  35  14.311   0.146   1.680
  280    HA   THR  35           HA       THR  35  12.788   2.088   3.260
  281    HB   THR  35           HB       THR  35  12.784   2.508   0.323
  282    HG1  THR  35           HG1      THR  35  15.044   2.977   1.962
  283   HG21  THR  35          HG21      THR  35  13.135   4.518   2.533
  284   HG22  THR  35          HG22      THR  35  11.552   3.861   2.108
  285   HG23  THR  35          HG23      THR  35  12.478   4.775   0.916
  286    H    VAL  36           HN       VAL  36  11.112   0.770   3.727
  287    HA   VAL  36           HA       VAL  36  10.147  -1.145   1.800
  288    HB   VAL  36           HB       VAL  36  10.176  -1.886   4.069
  289   HG11  VAL  36          HG11      VAL  36   8.767  -0.795   5.815
  290   HG12  VAL  36          HG12      VAL  36   8.508   0.542   4.695
  291   HG13  VAL  36          HG13      VAL  36  10.133   0.178   5.271
  292   HG21  VAL  36          HG21      VAL  36   7.828  -2.513   4.440
  293   HG22  VAL  36          HG22      VAL  36   8.319  -2.721   2.758
  294   HG23  VAL  36          HG23      VAL  36   7.337  -1.332   3.224
  295    H    HIS  37           HN       HIS  37   8.618  -0.817   0.367
  296    HA   HIS  37           HA       HIS  37   6.891   1.544   0.670
  297    HB2  HIS  37           HB2      HIS  37   7.775   0.027  -1.782
  298    HB3  HIS  37           HB1      HIS  37   6.461   1.185  -1.814
  299    HD2  HIS  37           HD2      HIS  37  10.338   1.137  -1.265
  300    HE1  HIS  37           HE1      HIS  37   9.084   5.049  -2.268
  301    HE2  HIS  37           HE2      HIS  37  11.067   3.488  -2.083
  302    H    HIS  38           HN       HIS  38   4.680   1.324   0.204
  303    HA   HIS  38           HA       HIS  38   3.687  -1.415   0.588
  304    HB2  HIS  38           HB2      HIS  38   2.321   1.194   1.297
  305    HB3  HIS  38           HB1      HIS  38   1.702  -0.425   1.621
  306    HD2  HIS  38           HD2      HIS  38   3.748   2.244   3.313
  307    HE1  HIS  38           HE1      HIS  38   4.652  -1.381   5.293
  308    HE2  HIS  38           HE2      HIS  38   5.060   1.115   5.245
  309    H    MET  39           HN       MET  39   3.226  -2.200  -1.337
  310    HA   MET  39           HA       MET  39   1.622  -0.523  -3.147
  311    HB2  MET  39           HB2      MET  39   3.651  -0.724  -4.277
  312    HB3  MET  39           HB1      MET  39   3.924  -2.367  -3.712
  313    HG2  MET  39           HG2      MET  39   1.553  -2.044  -5.404
  314    HG3  MET  39           HG1      MET  39   3.078  -1.673  -6.204
  315    HE1  MET  39           HE1      MET  39   4.750  -4.923  -6.811
  316    HE2  MET  39           HE2      MET  39   5.170  -3.358  -6.111
  317    HE3  MET  39           HE3      MET  39   4.172  -3.437  -7.569
  318    H    VAL  40           HN       VAL  40  -0.193  -1.351  -3.956
  319    HA   VAL  40           HA       VAL  40  -1.241  -3.789  -2.921
  320    HB   VAL  40           HB       VAL  40  -2.941  -2.268  -3.369
  321   HG11  VAL  40          HG11      VAL  40  -3.101  -1.010  -5.538
  322   HG12  VAL  40          HG12      VAL  40  -1.490  -1.617  -5.922
  323   HG13  VAL  40          HG13      VAL  40  -1.732  -0.584  -4.513
  324   HG21  VAL  40          HG21      VAL  40  -3.740  -4.277  -4.291
  325   HG22  VAL  40          HG22      VAL  40  -2.749  -4.105  -5.737
  326   HG23  VAL  40          HG23      VAL  40  -4.132  -3.035  -5.485
  327    H    TRP  41           HN       TRP  41  -0.723  -5.732  -3.641
  328    HA   TRP  41           HA       TRP  41   0.869  -6.003  -6.042
  329    HB2  TRP  41           HB2      TRP  41   1.529  -7.144  -3.986
  330    HB3  TRP  41           HB1      TRP  41   0.005  -8.033  -3.979
  331    HD1  TRP  41           HD1      TRP  41  -0.072 -10.254  -5.330
  332    HE1  TRP  41           HE1      TRP  41   1.618 -11.530  -6.802
  333    HE3  TRP  41           HE3      TRP  41   3.544  -6.658  -5.717
  334    HZ2  TRP  41           HZ2      TRP  41   4.144 -11.062  -7.971
  335    HZ3  TRP  41           HZ3      TRP  41   5.563  -7.151  -7.031
  336    HH2  TRP  41           HH2      TRP  41   5.855  -9.312  -8.134
  337    H    HIS  42           HN       HIS  42  -2.350  -6.901  -4.958
  338    HA   HIS  42           HA       HIS  42  -3.056  -7.530  -7.710
  339    HB2  HIS  42           HB2      HIS  42  -2.169  -9.665  -6.731
  340    HB3  HIS  42           HB1      HIS  42  -3.402  -9.576  -5.483
  341    HD2  HIS  42           HD2      HIS  42  -2.940 -10.711  -9.122
  342    HE1  HIS  42           HE1      HIS  42  -6.974 -11.364  -8.020
  343    HE2  HIS  42           HE2      HIS  42  -5.161 -11.915  -9.706
  344    H    VAL  43           HN       VAL  43  -5.307  -7.578  -8.053
  345    HA   VAL  43           HA       VAL  43  -6.975  -6.665  -5.811
  346    HB   VAL  43           HB       VAL  43  -7.126  -5.539  -8.621
  347   HG11  VAL  43          HG11      VAL  43  -9.271  -5.588  -7.473
  348   HG12  VAL  43          HG12      VAL  43  -8.688  -3.931  -7.628
  349   HG13  VAL  43          HG13      VAL  43  -8.560  -4.768  -6.081
  350   HG21  VAL  43          HG21      VAL  43  -5.100  -4.767  -7.471
  351   HG22  VAL  43          HG22      VAL  43  -6.084  -4.221  -6.114
  352   HG23  VAL  43          HG23      VAL  43  -6.261  -3.459  -7.694
  353    H    GLU  44           HN       GLU  44  -8.776  -7.875  -5.606
  354    HA   GLU  44           HA       GLU  44  -9.307 -10.105  -7.171
  355    HB2  GLU  44           HB2      GLU  44 -11.285  -8.608  -5.459
  356    HB3  GLU  44           HB1      GLU  44 -11.288 -10.301  -5.866
  357    HG2  GLU  44           HG2      GLU  44  -9.172  -8.994  -4.210
  358    HG3  GLU  44           HG1      GLU  44 -10.582  -9.817  -3.551
  359    H    ASP  45           HN       ASP  45 -10.599 -10.468  -8.896
  360    HA   ASP  45           HA       ASP  45 -11.324  -8.356 -10.602
  361    HB2  ASP  45           HB2      ASP  45 -11.943 -11.296 -10.570
  362    HB3  ASP  45           HB1      ASP  45 -12.703 -10.242 -11.756
  363    H    GLY  46           HN       GLY  46 -12.881  -6.928 -10.233
  364    HA2  GLY  46           HA2      GLY  46 -15.067  -6.181  -9.994
  365    HA3  GLY  46           HA1      GLY  46 -15.571  -7.841  -9.708
  366    H    GLY  47           HN       GLY  47 -12.938  -6.879  -7.800
  367    HA2  GLY  47           HA2      GLY  47 -14.487  -7.091  -5.399
  368    HA3  GLY  47           HA1      GLY  47 -12.769  -6.738  -5.506
  369    HA   PRO  48           HA       PRO  48 -15.447  -2.955  -4.216
  370    HB2  PRO  48           HB2      PRO  48 -13.493  -3.266  -1.968
  371    HB3  PRO  48           HB1      PRO  48 -15.180  -2.733  -1.908
  372    HG2  PRO  48           HG2      PRO  48 -14.614  -5.137  -1.121
  373    HG3  PRO  48           HG1      PRO  48 -15.938  -4.918  -2.272
  374    HD2  PRO  48           HD2      PRO  48 -13.128  -5.760  -2.835
  375    HD3  PRO  48           HD1      PRO  48 -14.640  -6.505  -3.356
  376    H    ALA  49           HN       ALA  49 -12.061  -3.666  -3.638
  377    HA   ALA  49           HA       ALA  49 -11.103  -1.051  -4.047
  378    HB1  ALA  49           HB1      ALA  49  -9.644  -3.668  -4.412
  379    HB2  ALA  49           HB2      ALA  49  -9.749  -2.729  -2.925
  380    HB3  ALA  49           HB3      ALA  49  -8.879  -2.083  -4.316
  381    H    SER  50           HN       SER  50 -11.636  -3.710  -6.253
  382    HA   SER  50           HA       SER  50 -10.402  -2.622  -8.532
  383    HB2  SER  50           HB2      SER  50 -11.527  -4.997  -7.954
  384    HB3  SER  50           HB1      SER  50 -12.861  -4.262  -8.838
  385    HG   SER  50           HG       SER  50 -11.193  -3.806 -10.497
  386    H    GLU  51           HN       GLU  51 -13.578  -2.327  -7.117
  387    HA   GLU  51           HA       GLU  51 -14.735  -0.838  -9.264
  388    HB2  GLU  51           HB2      GLU  51 -15.621  -1.175  -6.392
  389    HB3  GLU  51           HB1      GLU  51 -16.596  -0.466  -7.676
  390    HG2  GLU  51           HG2      GLU  51 -16.246  -2.702  -8.881
  391    HG3  GLU  51           HG1      GLU  51 -15.744  -3.306  -7.307
  392    H    ALA  52           HN       ALA  52 -13.023  -0.107  -6.357
  393    HA   ALA  52           HA       ALA  52 -13.671   2.676  -6.273
  394    HB1  ALA  52           HB1      ALA  52 -11.388   1.226  -4.956
  395    HB2  ALA  52           HB2      ALA  52 -13.022   1.333  -4.303
  396    HB3  ALA  52           HB3      ALA  52 -12.056   2.796  -4.504
  397    H    GLY  53           HN       GLY  53 -11.391   0.762  -7.990
  398    HA2  GLY  53           HA2      GLY  53 -10.364   1.728  -9.942
  399    HA3  GLY  53           HA1      GLY  53 -10.202   3.217  -9.034
  400    H    LEU  54           HN       LEU  54  -9.426   0.629  -7.056
  401    HA   LEU  54           HA       LEU  54  -6.679   1.381  -6.984
  402    HB2  LEU  54           HB2      LEU  54  -8.382   0.011  -5.316
  403    HB3  LEU  54           HB1      LEU  54  -7.304  -1.246  -5.870
  404    HG   LEU  54           HG       LEU  54  -6.747   1.110  -4.132
  405   HD11  LEU  54          HD11      LEU  54  -7.065  -1.175  -3.245
  406   HD12  LEU  54          HD12      LEU  54  -5.481  -0.486  -2.877
  407   HD13  LEU  54          HD13      LEU  54  -5.644  -1.688  -4.159
  408   HD21  LEU  54          HD21      LEU  54  -5.192   1.604  -5.833
  409   HD22  LEU  54          HD22      LEU  54  -4.780  -0.094  -6.056
  410   HD23  LEU  54          HD23      LEU  54  -4.290   0.749  -4.585
  411    H    ARG  55           HN       ARG  55  -5.029   0.589  -8.036
  412    HA   ARG  55           HA       ARG  55  -5.419  -1.775  -9.745
  413    HB2  ARG  55           HB2      ARG  55  -3.609   0.568 -10.336
  414    HB3  ARG  55           HB1      ARG  55  -4.031  -0.755 -11.414
  415    HG2  ARG  55           HG2      ARG  55  -6.128   1.082 -10.330
  416    HG3  ARG  55           HG1      ARG  55  -5.177   1.507 -11.748
  417    HD2  ARG  55           HD2      ARG  55  -6.031  -0.277 -12.999
  418    HD3  ARG  55           HD1      ARG  55  -6.578  -1.131 -11.557
  419    HE   ARG  55           HE       ARG  55  -7.838   1.395 -12.383
  420   HH11  ARG  55          HH11      ARG  55  -8.052  -2.022 -11.639
  421   HH12  ARG  55          HH12      ARG  55  -9.787  -2.048 -11.657
  422   HH21  ARG  55          HH21      ARG  55 -10.132   1.366 -12.398
  423   HH22  ARG  55          HH22      ARG  55 -10.973  -0.118 -12.077
  424    H    GLN  56           HN       GLN  56  -3.902  -3.339  -9.630
  425    HA   GLN  56           HA       GLN  56  -2.054  -3.231  -7.476
  426    HB2  GLN  56           HB2      GLN  56  -1.247  -5.412  -8.925
  427    HB3  GLN  56           HB1      GLN  56  -2.463  -5.418  -7.666
  428    HG2  GLN  56           HG2      GLN  56  -4.198  -5.535  -9.129
  429    HG3  GLN  56           HG1      GLN  56  -3.268  -4.825 -10.418
  430   HE21  GLN  56          HE21      GLN  56  -1.566  -6.123 -11.382
  431   HE22  GLN  56          HE22      GLN  56  -1.776  -7.838 -11.459
  432    H    GLY  57           HN       GLY  57   0.097  -2.892  -7.464
  433    HA2  GLY  57           HA2      GLY  57   2.239  -2.731  -8.467
  434    HA3  GLY  57           HA1      GLY  57   1.475  -2.479 -10.022
  435    H    ASP  58           HN       ASP  58  -0.048  -0.610  -7.675
  436    HA   ASP  58           HA       ASP  58   1.297   1.802  -8.625
  437    HB2  ASP  58           HB2      ASP  58  -1.062   1.486  -6.744
  438    HB3  ASP  58           HB1      ASP  58  -0.419   3.021  -7.299
  439    H    LEU  59           HN       LEU  59   0.923   3.398  -6.328
  440    HA   LEU  59           HA       LEU  59   2.487   2.088  -4.277
  441    HB2  LEU  59           HB2      LEU  59   3.274   4.446  -5.883
  442    HB3  LEU  59           HB1      LEU  59   3.532   4.582  -4.156
  443    HG   LEU  59           HG       LEU  59   4.678   2.475  -5.972
  444   HD11  LEU  59          HD11      LEU  59   5.713   4.696  -6.175
  445   HD12  LEU  59          HD12      LEU  59   6.812   3.520  -5.459
  446   HD13  LEU  59          HD13      LEU  59   6.006   4.708  -4.437
  447   HD21  LEU  59          HD21      LEU  59   4.296   1.416  -3.885
  448   HD22  LEU  59          HD22      LEU  59   4.850   2.829  -2.989
  449   HD23  LEU  59          HD23      LEU  59   6.002   1.863  -3.910
  450    H    ILE  60           HN       ILE  60   1.296   2.217  -2.513
  451    HA   ILE  60           HA       ILE  60  -0.693   4.275  -2.243
  452    HB   ILE  60           HB       ILE  60   0.149   2.063  -0.353
  453   HG12  ILE  60          HG12      ILE  60  -2.455   2.267  -1.855
  454   HG13  ILE  60          HG11      ILE  60  -1.028   1.570  -2.613
  455   HG21  ILE  60          HG21      ILE  60  -1.985   2.588   0.834
  456   HG22  ILE  60          HG22      ILE  60  -2.101   4.058  -0.133
  457   HG23  ILE  60          HG23      ILE  60  -0.749   3.837   0.977
  458   HD11  ILE  60          HD11      ILE  60  -0.912  -0.098  -0.825
  459   HD12  ILE  60          HD12      ILE  60  -2.442  -0.155  -1.702
  460   HD13  ILE  60          HD13      ILE  60  -2.367   0.592  -0.106
  461    H    THR  61           HN       THR  61  -0.170   6.241  -1.553
  462    HA   THR  61           HA       THR  61   2.240   6.578   0.062
  463    HB   THR  61           HB       THR  61   2.289   7.975  -1.837
  464    HG1  THR  61           HG1      THR  61   1.635   9.312   0.561
  465   HG21  THR  61          HG21      THR  61   0.530   9.467  -2.526
  466   HG22  THR  61          HG22      THR  61  -0.426   9.063  -1.102
  467   HG23  THR  61          HG23      THR  61  -0.144   7.847  -2.347
  468    H    HIS  62           HN       HIS  62  -1.244   7.035   0.257
  469    HA   HIS  62           HA       HIS  62  -0.904   7.553   3.114
  470    HB2  HIS  62           HB2      HIS  62  -2.744   9.269   1.434
  471    HB3  HIS  62           HB1      HIS  62  -2.541   9.351   3.171
  472    HD2  HIS  62           HD2      HIS  62  -0.281  10.666   4.080
  473    HE1  HIS  62           HE1      HIS  62   0.812  12.140   0.271
  474    HE2  HIS  62           HE2      HIS  62   1.159  12.381   2.767
  475    H    VAL  63           HN       VAL  63  -2.614   6.934   4.383
  476    HA   VAL  63           HA       VAL  63  -4.796   5.492   3.021
  477    HB   VAL  63           HB       VAL  63  -3.288   4.686   5.518
  478   HG11  VAL  63          HG11      VAL  63  -5.746   3.387   4.351
  479   HG12  VAL  63          HG12      VAL  63  -5.739   4.412   5.785
  480   HG13  VAL  63          HG13      VAL  63  -4.864   2.881   5.792
  481   HG21  VAL  63          HG21      VAL  63  -2.266   4.059   3.361
  482   HG22  VAL  63          HG22      VAL  63  -3.753   3.217   2.924
  483   HG23  VAL  63          HG23      VAL  63  -2.790   2.655   4.290
  484    H    ASN  64           HN       ASN  64  -6.587   6.647   3.341
  485    HA   ASN  64           HA       ASN  64  -8.258   7.809   4.353
  486    HB2  ASN  64           HB2      ASN  64  -6.935   6.806   6.886
  487    HB3  ASN  64           HB1      ASN  64  -8.459   7.685   6.860
  488   HD21  ASN  64          HD21      ASN  64  -7.639   4.900   7.620
  489   HD22  ASN  64          HD22      ASN  64  -8.735   3.881   6.763
  490    H    GLY  65           HN       GLY  65  -5.476   8.894   3.842
  491    HA2  GLY  65           HA2      GLY  65  -4.839  11.152   3.759
  492    HA3  GLY  65           HA1      GLY  65  -5.959  11.491   5.071
  493    H    GLU  66           HN       GLU  66  -4.014   8.768   5.629
  494    HA   GLU  66           HA       GLU  66  -2.417  10.322   7.541
  495    HB2  GLU  66           HB2      GLU  66  -2.705   7.327   7.437
  496    HB3  GLU  66           HB1      GLU  66  -2.135   8.303   8.781
  497    HG2  GLU  66           HG2      GLU  66  -4.931   8.565   7.754
  498    HG3  GLU  66           HG1      GLU  66  -4.487   7.286   8.876
  499    HA   PRO  67           HA       PRO  67   1.099   9.574   4.874
  500    HB2  PRO  67           HB2      PRO  67   2.762  10.356   7.147
  501    HB3  PRO  67           HB1      PRO  67   2.555  11.160   5.592
  502    HG2  PRO  67           HG2      PRO  67   1.588  12.179   7.914
  503    HG3  PRO  67           HG1      PRO  67   0.821  12.457   6.345
  504    HD2  PRO  67           HD2      PRO  67   0.039  10.590   8.524
  505    HD3  PRO  67           HD1      PRO  67  -0.982  11.547   7.437
  506    H    VAL  68           HN       VAL  68   1.373   7.425   4.639
  507    HA   VAL  68           HA       VAL  68   2.119   5.819   6.959
  508    HB   VAL  68           HB       VAL  68   1.672   3.870   5.601
  509   HG11  VAL  68          HG11      VAL  68  -0.731   4.181   5.260
  510   HG12  VAL  68          HG12      VAL  68  -0.520   5.929   5.370
  511   HG13  VAL  68          HG13      VAL  68  -0.194   4.910   6.772
  512   HG21  VAL  68          HG21      VAL  68   0.797   4.066   3.315
  513   HG22  VAL  68          HG22      VAL  68   2.442   4.691   3.439
  514   HG23  VAL  68          HG23      VAL  68   1.078   5.807   3.362
  515    H    HIS  69           HN       HIS  69   3.728   7.578   4.774
  516    HA   HIS  69           HA       HIS  69   5.718   5.807   3.815
  517    HB2  HIS  69           HB2      HIS  69   5.171   8.106   2.909
  518    HB3  HIS  69           HB1      HIS  69   6.014   8.776   4.299
  519    HD2  HIS  69           HD2      HIS  69   8.835   8.198   4.340
  520    HE1  HIS  69           HE1      HIS  69   8.917   7.396   0.186
  521    HE2  HIS  69           HE2      HIS  69  10.290   8.103   2.193
  522    H    GLY  70           HN       GLY  70   6.474   4.557   5.490
  523    HA2  GLY  70           HA2      GLY  70   8.711   4.813   6.750
  524    HA3  GLY  70           HA1      GLY  70   7.781   5.937   7.731
  525    H    LEU  71           HN       LEU  71   5.326   4.217   7.410
  526    HA   LEU  71           HA       LEU  71   5.654   2.690   9.761
  527    HB2  LEU  71           HB2      LEU  71   3.534   2.746   7.647
  528    HB3  LEU  71           HB1      LEU  71   3.442   1.705   9.042
  529    HG   LEU  71           HG       LEU  71   3.527   4.686   9.098
  530   HD11  LEU  71          HD11      LEU  71   1.480   4.030   8.222
  531   HD12  LEU  71          HD12      LEU  71   1.183   4.362   9.931
  532   HD13  LEU  71          HD13      LEU  71   1.336   2.691   9.365
  533   HD21  LEU  71          HD21      LEU  71   2.871   4.344  11.496
  534   HD22  LEU  71          HD22      LEU  71   4.533   3.909  11.104
  535   HD23  LEU  71          HD23      LEU  71   3.313   2.651  11.291
  536    H    VAL  72           HN       VAL  72   4.914   0.434   9.878
  537    HA   VAL  72           HA       VAL  72   6.470  -1.237   8.094
  538    HB   VAL  72           HB       VAL  72   5.874  -3.068   9.629
  539   HG11  VAL  72          HG11      VAL  72   6.828  -0.601  11.072
  540   HG12  VAL  72          HG12      VAL  72   7.830  -1.711  10.140
  541   HG13  VAL  72          HG13      VAL  72   7.042  -2.262  11.618
  542   HG21  VAL  72          HG21      VAL  72   3.963  -1.033  10.648
  543   HG22  VAL  72          HG22      VAL  72   4.729  -2.093  11.840
  544   HG23  VAL  72          HG23      VAL  72   3.802  -2.790  10.513
  545    H    HIS  73           HN       HIS  73   5.301  -3.387   7.522
  546    HA   HIS  73           HA       HIS  73   3.273  -2.823   5.701
  547    HB2  HIS  73           HB2      HIS  73   4.764  -4.769   5.564
  548    HB3  HIS  73           HB1      HIS  73   3.975  -5.473   6.965
  549    HD1  HIS  73           HD1      HIS  73   2.705  -4.141   3.600
  550    HD2  HIS  73           HD2      HIS  73   2.262  -7.356   6.197
  551    HE1  HIS  73           HE1      HIS  73   1.030  -5.701   2.525
  552    H    THR  74           HN       THR  74   3.037  -4.218   8.956
  553    HA   THR  74           HA       THR  74   0.222  -4.616   8.803
  554    HB   THR  74           HB       THR  74   0.471  -4.872  11.328
  555    HG1  THR  74           HG1      THR  74   2.368  -4.357  12.123
  556   HG21  THR  74          HG21      THR  74   2.091  -6.600   9.460
  557   HG22  THR  74          HG22      THR  74   0.366  -6.754   9.785
  558   HG23  THR  74          HG23      THR  74   1.537  -7.073  11.065
  559    H    GLU  75           HN       GLU  75   2.187  -1.884   9.979
  560    HA   GLU  75           HA       GLU  75   0.199  -0.651  11.498
  561    HB2  GLU  75           HB2      GLU  75   2.556   0.512  10.012
  562    HB3  GLU  75           HB1      GLU  75   1.435   1.476  10.897
  563    HG2  GLU  75           HG2      GLU  75   2.627  -0.821  12.300
  564    HG3  GLU  75           HG1      GLU  75   3.606   0.624  12.046
  565    H    VAL  76           HN       VAL  76   1.004  -0.398   8.085
  566    HA   VAL  76           HA       VAL  76  -1.071   1.498   7.559
  567    HB   VAL  76           HB       VAL  76  -0.510   1.331   5.256
  568   HG11  VAL  76          HG11      VAL  76   1.112   2.415   6.781
  569   HG12  VAL  76          HG12      VAL  76   1.849   1.793   5.303
  570   HG13  VAL  76          HG13      VAL  76   2.029   0.911   6.821
  571   HG21  VAL  76          HG21      VAL  76   0.971  -0.377   4.331
  572   HG22  VAL  76          HG22      VAL  76  -0.478  -1.107   5.024
  573   HG23  VAL  76          HG23      VAL  76   1.047  -1.173   5.904
  574    H    VAL  77           HN       VAL  77  -0.760  -2.015   7.338
  575    HA   VAL  77           HA       VAL  77  -3.119  -2.632   5.984
  576    HB   VAL  77           HB       VAL  77  -1.478  -4.099   8.030
  577   HG11  VAL  77          HG11      VAL  77  -3.868  -4.688   8.427
  578   HG12  VAL  77          HG12      VAL  77  -2.861  -6.040   7.912
  579   HG13  VAL  77          HG13      VAL  77  -3.950  -5.264   6.762
  580   HG21  VAL  77          HG21      VAL  77  -1.114  -5.638   6.152
  581   HG22  VAL  77          HG22      VAL  77  -0.648  -3.985   5.753
  582   HG23  VAL  77          HG23      VAL  77  -2.167  -4.644   5.145
  583    H    GLU  78           HN       GLU  78  -2.552  -2.348   9.471
  584    HA   GLU  78           HA       GLU  78  -5.214  -2.678  10.245
  585    HB2  GLU  78           HB2      GLU  78  -2.986  -1.244  11.570
  586    HB3  GLU  78           HB1      GLU  78  -4.513  -1.606  12.342
  587    HG2  GLU  78           HG2      GLU  78  -4.016  -3.977  11.560
  588    HG3  GLU  78           HG1      GLU  78  -2.357  -3.436  11.481
  589    H    LEU  79           HN       LEU  79  -3.303   0.158   9.701
  590    HA   LEU  79           HA       LEU  79  -5.037   2.208  10.220
  591    HB2  LEU  79           HB2      LEU  79  -2.646   1.936   8.826
  592    HB3  LEU  79           HB1      LEU  79  -3.744   2.641   7.657
  593    HG   LEU  79           HG       LEU  79  -4.274   4.348   9.541
  594   HD11  LEU  79          HD11      LEU  79  -2.483   4.743  11.095
  595   HD12  LEU  79          HD12      LEU  79  -1.553   3.404  10.421
  596   HD13  LEU  79          HD13      LEU  79  -3.057   3.086  11.285
  597   HD21  LEU  79          HD21      LEU  79  -1.929   4.168   7.730
  598   HD22  LEU  79          HD22      LEU  79  -2.010   5.515   8.869
  599   HD23  LEU  79          HD23      LEU  79  -3.307   5.274   7.695
  600    H    ILE  80           HN       ILE  80  -4.739   0.586   7.030
  601    HA   ILE  80           HA       ILE  80  -6.901   1.694   5.751
  602    HB   ILE  80           HB       ILE  80  -5.866  -1.136   5.626
  603   HG12  ILE  80          HG12      ILE  80  -5.235   1.004   3.657
  604   HG13  ILE  80          HG11      ILE  80  -4.396   0.996   5.192
  605   HG21  ILE  80          HG21      ILE  80  -8.081  -0.943   4.654
  606   HG22  ILE  80          HG22      ILE  80  -6.859  -1.248   3.418
  607   HG23  ILE  80          HG23      ILE  80  -7.524   0.373   3.618
  608   HD11  ILE  80          HD11      ILE  80  -3.479  -1.113   4.797
  609   HD12  ILE  80          HD12      ILE  80  -3.222  -0.167   3.328
  610   HD13  ILE  80          HD13      ILE  80  -4.499  -1.385   3.383
  611    H    LEU  81           HN       LEU  81  -6.835  -1.356   7.546
  612    HA   LEU  81           HA       LEU  81  -9.496  -2.043   7.468
  613    HB2  LEU  81           HB2      LEU  81  -7.456  -2.442   9.645
  614    HB3  LEU  81           HB1      LEU  81  -9.043  -3.178   9.695
  615    HG   LEU  81           HG       LEU  81  -7.064  -3.630   7.465
  616   HD11  LEU  81          HD11      LEU  81  -6.567  -5.757   8.492
  617   HD12  LEU  81          HD12      LEU  81  -7.665  -5.403   9.826
  618   HD13  LEU  81          HD13      LEU  81  -6.196  -4.450   9.617
  619   HD21  LEU  81          HD21      LEU  81  -9.589  -5.083   8.246
  620   HD22  LEU  81          HD22      LEU  81  -8.500  -5.529   6.932
  621   HD23  LEU  81          HD23      LEU  81  -9.397  -4.015   6.857
  622    H    LYS  82           HN       LYS  82  -7.948   0.178   9.780
  623    HA   LYS  82           HA       LYS  82 -10.134   0.525  11.477
  624    HB2  LYS  82           HB2      LYS  82  -7.831   2.361  10.902
  625    HB3  LYS  82           HB1      LYS  82  -8.957   2.545  12.248
  626    HG2  LYS  82           HG2      LYS  82  -8.331   0.202  12.900
  627    HG3  LYS  82           HG1      LYS  82  -7.041   0.322  11.733
  628    HD2  LYS  82           HD2      LYS  82  -7.255   2.539  13.677
  629    HD3  LYS  82           HD1      LYS  82  -6.731   0.982  14.313
  630    HE2  LYS  82           HE2      LYS  82  -5.055   0.977  12.373
  631    HE3  LYS  82           HE1      LYS  82  -5.428   2.694  12.224
  632    HZ1  LYS  82           HZ1      LYS  82  -4.483   1.410  14.729
  633    HZ2  LYS  82           HZ2      LYS  82  -4.673   3.065  14.441
  634    HZ3  LYS  82           HZ3      LYS  82  -3.468   2.202  13.631
  635    H    SER  83           HN       SER  83  -9.799   1.700   8.298
  636    HA   SER  83           HA       SER  83 -10.870   4.216   8.307
  637    HB2  SER  83           HB2      SER  83 -11.732   3.713   6.053
  638    HB3  SER  83           HB1      SER  83 -10.094   3.105   6.281
  639    HG   SER  83           HG       SER  83 -12.238   1.755   5.543
  640    H    GLY  84           HN       GLY  84 -12.866   1.278   7.857
  641    HA2  GLY  84           HA2      GLY  84 -14.900   0.856   9.011
  642    HA3  GLY  84           HA1      GLY  84 -15.002   2.566   9.398
  643    H    ASN  85           HN       ASN  85 -15.952   0.098   7.307
  644    HA   ASN  85           HA       ASN  85 -17.548  -0.014   5.707
  645    HB2  ASN  85           HB2      ASN  85 -19.013   1.549   6.599
  646    HB3  ASN  85           HB1      ASN  85 -17.858   2.869   6.459
  647   HD21  ASN  85          HD21      ASN  85 -19.749   0.638   4.444
  648   HD22  ASN  85          HD22      ASN  85 -20.068   1.788   3.194
  649    H    LYS  86           HN       LYS  86 -15.359   2.751   5.242
  650    HA   LYS  86           HA       LYS  86 -14.511   1.610   2.751
  651    HB2  LYS  86           HB2      LYS  86 -14.786   3.720   1.524
  652    HB3  LYS  86           HB1      LYS  86 -16.301   2.969   1.958
  653    HG2  LYS  86           HG2      LYS  86 -16.176   4.514   4.031
  654    HG3  LYS  86           HG1      LYS  86 -15.041   5.411   3.027
  655    HD2  LYS  86           HD2      LYS  86 -16.829   5.355   1.229
  656    HD3  LYS  86           HD1      LYS  86 -17.920   4.800   2.499
  657    HE2  LYS  86           HE2      LYS  86 -17.519   6.819   3.771
  658    HE3  LYS  86           HE1      LYS  86 -16.339   7.365   2.579
  659    HZ1  LYS  86           HZ1      LYS  86 -19.224   6.915   2.051
  660    HZ2  LYS  86           HZ2      LYS  86 -18.087   7.488   0.937
  661    HZ3  LYS  86           HZ3      LYS  86 -18.497   8.424   2.281
  662    H    VAL  87           HN       VAL  87 -12.655   2.623   1.934
  663    HA   VAL  87           HA       VAL  87 -11.215   4.273   3.897
  664    HB   VAL  87           HB       VAL  87 -10.526   2.031   4.365
  665   HG11  VAL  87          HG11      VAL  87 -11.227   1.052   2.215
  666   HG12  VAL  87          HG12      VAL  87  -9.618   0.524   2.718
  667   HG13  VAL  87          HG13      VAL  87  -9.787   1.746   1.457
  668   HG21  VAL  87          HG21      VAL  87  -8.774   3.758   4.391
  669   HG22  VAL  87          HG22      VAL  87  -8.380   3.372   2.716
  670   HG23  VAL  87          HG23      VAL  87  -8.129   2.170   3.980
  671    H    ALA  88           HN       ALA  88 -10.059   5.877   3.045
  672    HA   ALA  88           HA       ALA  88 -10.009   6.103   0.133
  673    HB1  ALA  88           HB1      ALA  88 -10.859   8.016   1.355
  674    HB2  ALA  88           HB2      ALA  88  -9.369   8.420   0.502
  675    HB3  ALA  88           HB3      ALA  88  -9.341   8.140   2.245
  676    H    ILE  89           HN       ILE  89  -8.374   5.087  -0.704
  677    HA   ILE  89           HA       ILE  89  -5.759   5.179   0.620
  678    HB   ILE  89           HB       ILE  89  -6.631   3.416  -1.672
  679   HG12  ILE  89          HG12      ILE  89  -6.844   3.106   1.287
  680   HG13  ILE  89          HG11      ILE  89  -7.913   2.557   0.014
  681   HG21  ILE  89          HG21      ILE  89  -4.651   2.099  -1.008
  682   HG22  ILE  89          HG22      ILE  89  -4.209   3.398   0.100
  683   HG23  ILE  89          HG23      ILE  89  -4.265   3.701  -1.636
  684   HD11  ILE  89          HD11      ILE  89  -6.934   0.667   1.104
  685   HD12  ILE  89          HD12      ILE  89  -5.312   1.301   0.819
  686   HD13  ILE  89          HD13      ILE  89  -6.307   0.780  -0.540
  687    H    SER  90           HN       SER  90  -4.478   6.755  -0.044
  688    HA   SER  90           HA       SER  90  -4.812   8.015  -2.607
  689    HB2  SER  90           HB2      SER  90  -2.540   8.450  -0.669
  690    HB3  SER  90           HB1      SER  90  -3.201   9.582  -1.846
  691    HG   SER  90           HG       SER  90  -4.284  10.258  -0.158
  692    H    THR  91           HN       THR  91  -4.057   7.090  -4.393
  693    HA   THR  91           HA       THR  91  -1.679   5.394  -4.223
  694    HB   THR  91           HB       THR  91  -2.450   4.696  -6.579
  695    HG1  THR  91           HG1      THR  91  -4.588   5.148  -7.074
  696   HG21  THR  91          HG21      THR  91  -2.677   3.178  -4.744
  697   HG22  THR  91          HG22      THR  91  -4.211   3.178  -5.622
  698   HG23  THR  91          HG23      THR  91  -4.057   4.071  -4.106
  699    H    THR  92           HN       THR  92  -0.382   5.376  -6.290
  700    HA   THR  92           HA       THR  92  -0.196   7.603  -7.994
  701    HB   THR  92           HB       THR  92   0.547   8.813  -6.002
  702    HG1  THR  92           HG1      THR  92   2.950   8.997  -6.770
  703   HG21  THR  92          HG21      THR  92   1.282   6.860  -4.694
  704   HG22  THR  92          HG22      THR  92   2.481   8.154  -4.707
  705   HG23  THR  92          HG23      THR  92   2.711   6.728  -5.722
  706    HA   PRO  93           HA       PRO  93   2.117   4.647 -10.383
  707    HB2  PRO  93           HB2      PRO  93   4.181   6.790 -10.600
  708    HB3  PRO  93           HB1      PRO  93   3.515   5.762 -11.865
  709    HG2  PRO  93           HG2      PRO  93   2.670   8.263 -11.621
  710    HG3  PRO  93           HG1      PRO  93   1.510   6.963 -11.963
  711    HD2  PRO  93           HD2      PRO  93   2.004   8.445  -9.422
  712    HD3  PRO  93           HD1      PRO  93   0.495   7.760 -10.056
  713    H    LEU  94           HN       LEU  94   3.806   3.257 -10.261
  714    HA   LEU  94           HA       LEU  94   5.499   3.485  -7.872
  715    HB2  LEU  94           HB2      LEU  94   4.268   1.504  -7.631
  716    HB3  LEU  94           HB1      LEU  94   4.367   1.122  -9.339
  717    HG   LEU  94           HG       LEU  94   6.832   0.674  -8.994
  718   HD11  LEU  94          HD11      LEU  94   6.038   0.775  -6.090
  719   HD12  LEU  94          HD12      LEU  94   7.141   1.882  -6.910
  720   HD13  LEU  94          HD13      LEU  94   7.574   0.184  -6.724
  721   HD21  LEU  94          HD21      LEU  94   6.427  -1.539  -7.944
  722   HD22  LEU  94          HD22      LEU  94   5.301  -1.145  -9.243
  723   HD23  LEU  94          HD23      LEU  94   4.788  -1.008  -7.560
  724    H    GLU  95           HN       GLU  95   6.914   4.877  -8.976
  725    HA   GLU  95           HA       GLU  95   8.454   3.658 -11.154
  726    HB2  GLU  95           HB2      GLU  95   8.648   6.498 -10.220
  727    HB3  GLU  95           HB1      GLU  95   9.173   5.835 -11.752
  728    HG2  GLU  95           HG2      GLU  95   6.279   5.622 -11.148
  729    HG3  GLU  95           HG1      GLU  95   6.914   7.235 -11.474
  730    H    ASN  96           HN       ASN  96  10.319   2.826 -10.685
  731    HA   ASN  96           HA       ASN  96  12.171   3.929  -8.823
  732    HB2  ASN  96           HB2      ASN  96  10.679   2.817  -7.219
  733    HB3  ASN  96           HB1      ASN  96  10.826   1.308  -8.112
  734   HD21  ASN  96          HD21      ASN  96  12.612   0.052  -7.854
  735   HD22  ASN  96          HD22      ASN  96  13.842   0.362  -6.673
  736    H2   PRO  97           HT1      PRO  97  11.975  -9.785  -7.613
  737    H3   PRO  97           HT2      PRO  97  10.480 -10.351  -7.964
  738    HA   PRO  97           HA       PRO  97   9.451  -8.724  -7.057
  739    HB2  PRO  97           HB2      PRO  97  11.059  -7.737  -4.939
  740    HB3  PRO  97           HB1      PRO  97   9.547  -8.647  -4.811
  741    HG2  PRO  97           HG2      PRO  97  12.348  -9.614  -4.687
  742    HG3  PRO  97           HG1      PRO  97  10.896 -10.260  -3.901
  743    HD2  PRO  97           HD2      PRO  97  11.990 -11.526  -5.979
  744    HD3  PRO  97           HD1      PRO  97  10.229 -11.420  -5.816
  745    H    PHE  98           HN       PHE  98  10.196  -6.255  -6.311
  746    HA   PHE  98           HA       PHE  98  11.990  -5.482  -8.489
  747    HB2  PHE  98           HB2      PHE  98  10.126  -3.723  -6.880
  748    HB3  PHE  98           HB1      PHE  98  10.994  -3.275  -8.342
  749    HD1  PHE  98           HD1      PHE  98  10.526  -5.416 -10.188
  750    HD2  PHE  98           HD2      PHE  98   7.877  -3.740  -7.308
  751    HE1  PHE  98           HE1      PHE  98   8.603  -6.137 -11.542
  752    HE2  PHE  98           HE2      PHE  98   5.952  -4.462  -8.655
  753    HZ   PHE  98           HZ       PHE  98   6.312  -5.661 -10.776
  754    H    ASP  99           HN       ASP  99  13.602  -3.923  -8.170
  755    HA   ASP  99           HA       ASP  99  15.386  -2.978  -7.163
  756    HB2  ASP  99           HB2      ASP  99  13.336  -1.927  -5.851
  757    HB3  ASP  99           HB1      ASP  99  14.027  -2.839  -4.512
  758    H    GLU 100           HN       GLU 100  15.902  -3.268  -4.198
  759    HA   GLU 100           HA       GLU 100  17.234  -5.872  -4.418
  760    HB2  GLU 100           HB2      GLU 100  17.742  -3.914  -2.208
  761    HB3  GLU 100           HB1      GLU 100  18.843  -5.067  -2.944
  762    HG2  GLU 100           HG2      GLU 100  17.811  -2.593  -4.304
  763    HG3  GLU 100           HG1      GLU 100  19.361  -2.709  -3.474
  764    H    ASP 101           HN       ASP 101  14.548  -6.118  -3.934
  765    HA   ASP 101           HA       ASP 101  13.882  -6.186  -1.187
  766    HB2  ASP 101           HB2      ASP 101  12.156  -6.102  -2.928
  767    HB3  ASP 101           HB1      ASP 101  12.626  -7.709  -3.477
  768    H    GLN 102           HN       GLN 102  13.998  -7.727   0.308
  769    HA   GLN 102           HA       GLN 102  14.966 -10.393  -0.422
  770    HB2  GLN 102           HB2      GLN 102  16.441 -10.276   1.668
  771    HB3  GLN 102           HB1      GLN 102  16.993  -9.382   0.262
  772    HG2  GLN 102           HG2      GLN 102  16.486  -7.329   1.201
  773    HG3  GLN 102           HG1      GLN 102  15.372  -8.031   2.372
  774   HE21  GLN 102          HE21      GLN 102  18.750  -7.621   1.534
  775   HE22  GLN 102          HE22      GLN 102  19.370  -7.906   3.124
  776    H    HIS 103           HN       HIS 103  12.505  -8.842   0.657
  777    HA   HIS 103           HA       HIS 103  11.419 -10.904   2.224
  778    HB2  HIS 103           HB2      HIS 103  13.086  -9.545   3.802
  779    HB3  HIS 103           HB1      HIS 103  11.708  -8.459   3.921
  780    HD2  HIS 103           HD2      HIS 103  10.678 -12.135   3.740
  781    HE1  HIS 103           HE1      HIS 103  10.677 -11.000   7.816
  782    HE2  HIS 103           HE2      HIS 103  10.205 -12.877   6.178
  783    H    THR 104           HN       THR 104   9.928 -10.466   0.498
  784    HA   THR 104           HA       THR 104   8.505  -7.946   0.491
  785    HB   THR 104           HB       THR 104   7.322 -10.156  -1.026
  786    HG1  THR 104           HG1      THR 104  10.055  -9.416  -1.389
  787   HG21  THR 104          HG21      THR 104   6.780  -7.770  -1.343
  788   HG22  THR 104          HG22      THR 104   7.376  -8.528  -2.820
  789   HG23  THR 104          HG23      THR 104   8.438  -7.485  -1.874
  790    H    GLN 105           HN       GLN 105   7.135  -7.633   2.146
  791    HA   GLN 105           HA       GLN 105   5.800  -9.789   3.467
  792    HB2  GLN 105           HB2      GLN 105   5.151  -6.845   3.664
  793    HB3  GLN 105           HB1      GLN 105   4.751  -8.101   4.826
  794    HG2  GLN 105           HG2      GLN 105   7.514  -7.127   4.139
  795    HG3  GLN 105           HG1      GLN 105   6.611  -6.774   5.613
  796   HE21  GLN 105          HE21      GLN 105   6.365  -8.376   7.158
  797   HE22  GLN 105          HE22      GLN 105   7.341  -9.801   7.168
  798    H    ILE 106           HN       ILE 106   3.487 -10.108   3.580
  799    HA   ILE 106           HA       ILE 106   1.851  -8.903   1.514
  800    HB   ILE 106           HB       ILE 106   2.729 -10.602   0.153
  801   HG12  ILE 106          HG12      ILE 106   0.155 -11.685   1.327
  802   HG13  ILE 106          HG11      ILE 106   0.277 -10.464   0.064
  803   HG21  ILE 106          HG21      ILE 106   2.851 -12.980   0.833
  804   HG22  ILE 106          HG22      ILE 106   2.359 -12.508   2.459
  805   HG23  ILE 106          HG23      ILE 106   3.884 -11.921   1.794
  806   HD11  ILE 106          HD11      ILE 106   1.258 -13.299  -0.175
  807   HD12  ILE 106          HD12      ILE 106   1.237 -12.076  -1.446
  808   HD13  ILE 106          HD13      ILE 106  -0.279 -12.695  -0.795
  809    H    THR 107           HN       THR 107  -0.189  -8.710   2.166
  810    HA   THR 107           HA       THR 107  -1.438 -10.620   3.914
  811    HB   THR 107           HB       THR 107  -0.672  -7.882   4.925
  812    HG1  THR 107           HG1      THR 107   0.507 -10.020   5.299
  813   HG21  THR 107          HG21      THR 107  -3.090  -8.140   5.307
  814   HG22  THR 107          HG22      THR 107  -2.184  -8.189   6.819
  815   HG23  THR 107          HG23      THR 107  -2.794  -9.683   6.106
  816    H    LYS 108           HN       LYS 108  -3.557 -10.664   3.655
  817    HA   LYS 108           HA       LYS 108  -4.772  -9.012   1.650
  818    HB2  LYS 108           HB2      LYS 108  -6.003 -11.021   3.557
  819    HB3  LYS 108           HB1      LYS 108  -6.793 -10.338   2.148
  820    HG2  LYS 108           HG2      LYS 108  -5.223 -11.434   0.679
  821    HG3  LYS 108           HG1      LYS 108  -4.313 -12.036   2.063
  822    HD2  LYS 108           HD2      LYS 108  -7.196 -12.711   1.495
  823    HD3  LYS 108           HD1      LYS 108  -5.828 -13.727   1.043
  824    HE2  LYS 108           HE2      LYS 108  -5.187 -13.862   3.423
  825    HE3  LYS 108           HE1      LYS 108  -6.618 -12.922   3.841
  826    HZ1  LYS 108           HZ1      LYS 108  -7.958 -14.703   2.793
  827    HZ2  LYS 108           HZ2      LYS 108  -7.102 -15.213   4.157
  828    HZ3  LYS 108           HZ3      LYS 108  -6.549 -15.619   2.613
  829    H    VAL 109           HN       VAL 109  -5.820  -7.091   2.022
  830    HA   VAL 109           HA       VAL 109  -6.571  -6.568   4.813
  831    HB   VAL 109           HB       VAL 109  -4.569  -5.327   4.483
  832   HG11  VAL 109          HG11      VAL 109  -4.527  -5.383   2.033
  833   HG12  VAL 109          HG12      VAL 109  -4.211  -3.767   2.666
  834   HG13  VAL 109          HG13      VAL 109  -5.793  -4.157   1.992
  835   HG21  VAL 109          HG21      VAL 109  -6.250  -4.133   5.708
  836   HG22  VAL 109          HG22      VAL 109  -6.971  -3.533   4.216
  837   HG23  VAL 109          HG23      VAL 109  -5.363  -2.992   4.697
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1   5.806  20.181  -2.342
    2    H2   GLY   1           HT2      GLY   1   6.347  20.404  -3.928
    3    H3   GLY   1           HT3      GLY   1   6.381  18.863  -3.232
    4    HA2  GLY   1           HA1      GLY   1   3.886  20.384  -3.659
    5    HA3  GLY   1           HA2      GLY   1   4.534  19.261  -4.845
    6    H    GLY   2           HN       GLY   2   2.702  19.611  -1.989
    7    HA2  GLY   2           HA2      GLY   2   2.938  16.899  -1.068
    8    HA3  GLY   2           HA1      GLY   2   1.749  18.082  -0.536
    9    H    SER   3           HN       SER   3  -0.124  18.427  -1.873
   10    HA   SER   3           HA       SER   3  -1.254  15.997  -2.807
   11    HB2  SER   3           HB2      SER   3  -2.371  18.736  -3.393
   12    HB3  SER   3           HB1      SER   3  -3.243  17.229  -3.111
   13    HG   SER   3           HG       SER   3  -2.592  17.318  -0.936
   14    H    MET   4           HN       MET   4  -0.660  15.075  -4.654
   15    HA   MET   4           HA       MET   4  -0.710  16.598  -7.118
   16    HB2  MET   4           HB2      MET   4   1.580  16.960  -6.405
   17    HB3  MET   4           HB1      MET   4   1.801  15.239  -6.132
   18    HG2  MET   4           HG2      MET   4   2.885  15.777  -8.159
   19    HG3  MET   4           HG1      MET   4   1.421  14.885  -8.572
   20    HE1  MET   4           HE1      MET   4   1.745  15.742 -11.100
   21    HE2  MET   4           HE2      MET   4   3.178  16.637 -10.597
   22    HE3  MET   4           HE3      MET   4   1.915  17.443 -11.529
   23    H    ARG   5           HN       ARG   5  -0.148  13.529  -5.481
   24    HA   ARG   5           HA       ARG   5  -0.904  12.079  -7.898
   25    HB2  ARG   5           HB2      ARG   5   0.460  11.303  -5.354
   26    HB3  ARG   5           HB1      ARG   5  -0.310  10.071  -6.340
   27    HG2  ARG   5           HG2      ARG   5   1.930  10.066  -7.003
   28    HG3  ARG   5           HG1      ARG   5   1.088  10.957  -8.269
   29    HD2  ARG   5           HD2      ARG   5   1.742  13.070  -7.077
   30    HD3  ARG   5           HD1      ARG   5   2.761  12.081  -6.030
   31    HE   ARG   5           HE       ARG   5   3.294  11.625  -8.801
   32   HH11  ARG   5          HH11      ARG   5   3.982  13.782  -6.125
   33   HH12  ARG   5          HH12      ARG   5   5.476  14.344  -6.809
   34   HH21  ARG   5          HH21      ARG   5   5.250  12.354  -9.685
   35   HH22  ARG   5          HH22      ARG   5   6.198  13.527  -8.825
   36    HA   PRO   6           HA       PRO   6  -5.064  11.916  -6.201
   37    HB2  PRO   6           HB2      PRO   6  -6.072  10.377  -8.227
   38    HB3  PRO   6           HB1      PRO   6  -5.852  12.121  -8.336
   39    HG2  PRO   6           HG2      PRO   6  -4.094   9.918  -9.321
   40    HG3  PRO   6           HG1      PRO   6  -4.613  11.402 -10.132
   41    HD2  PRO   6           HD2      PRO   6  -2.192  11.215  -9.014
   42    HD3  PRO   6           HD1      PRO   6  -3.110  12.731  -8.949
   43    HA   PRO   7           HA       PRO   7  -4.510   8.022  -4.073
   44    HB2  PRO   7           HB2      PRO   7  -7.166   8.566  -2.955
   45    HB3  PRO   7           HB1      PRO   7  -5.619   8.379  -2.128
   46    HG2  PRO   7           HG2      PRO   7  -6.849  10.759  -2.341
   47    HG3  PRO   7           HG1      PRO   7  -5.083  10.603  -2.342
   48    HD2  PRO   7           HD2      PRO   7  -6.945  11.042  -4.645
   49    HD3  PRO   7           HD1      PRO   7  -5.336  11.732  -4.346
   50    H    ILE   8           HN       ILE   8  -5.346   5.997  -4.105
   51    HA   ILE   8           HA       ILE   8  -7.235   5.401  -6.239
   52    HB   ILE   8           HB       ILE   8  -5.539   3.554  -4.564
   53   HG12  ILE   8          HG12      ILE   8  -4.318   5.250  -6.036
   54   HG13  ILE   8          HG11      ILE   8  -3.910   3.557  -6.256
   55   HG21  ILE   8          HG21      ILE   8  -7.343   2.326  -5.468
   56   HG22  ILE   8          HG22      ILE   8  -5.936   1.976  -6.471
   57   HG23  ILE   8          HG23      ILE   8  -7.169   3.099  -7.042
   58   HD11  ILE   8          HD11      ILE   8  -5.461   3.508  -8.205
   59   HD12  ILE   8          HD12      ILE   8  -4.058   4.558  -8.400
   60   HD13  ILE   8          HD13      ILE   8  -5.635   5.257  -8.030
   61    H    ILE   9           HN       ILE   9  -9.217   5.966  -5.204
   62    HA   ILE   9           HA       ILE   9  -9.937   5.047  -2.635
   63    HB   ILE   9           HB       ILE   9 -11.560   6.094  -4.943
   64   HG12  ILE   9          HG12      ILE   9 -11.824   8.049  -3.654
   65   HG13  ILE   9          HG11      ILE   9 -11.151   7.305  -2.226
   66   HG21  ILE   9          HG21      ILE   9 -13.407   6.284  -3.194
   67   HG22  ILE   9          HG22      ILE   9 -12.496   5.071  -2.292
   68   HG23  ILE   9          HG23      ILE   9 -13.110   4.696  -3.903
   69   HD11  ILE   9          HD11      ILE   9  -8.954   7.301  -3.293
   70   HD12  ILE   9          HD12      ILE   9  -9.632   8.927  -3.197
   71   HD13  ILE   9          HD13      ILE   9  -9.658   8.049  -4.728
   72    H    ILE  10           HN       ILE  10  -9.720   2.907  -2.364
   73    HA   ILE  10           HA       ILE  10 -11.009   1.037  -4.183
   74    HB   ILE  10           HB       ILE  10  -9.346   0.483  -1.726
   75   HG12  ILE  10          HG12      ILE  10  -8.461   0.315  -4.594
   76   HG13  ILE  10          HG11      ILE  10  -8.253   1.779  -3.644
   77   HG21  ILE  10          HG21      ILE  10 -10.689  -1.411  -2.294
   78   HG22  ILE  10          HG22      ILE  10  -9.050  -1.732  -2.865
   79   HG23  ILE  10          HG23      ILE  10 -10.299  -1.239  -4.005
   80   HD11  ILE  10          HD11      ILE  10  -6.888   0.520  -2.050
   81   HD12  ILE  10          HD12      ILE  10  -6.223   0.476  -3.685
   82   HD13  ILE  10          HD13      ILE  10  -7.086  -0.923  -3.043
   83    H    HIS  11           HN       HIS  11 -12.831   0.045  -3.758
   84    HA   HIS  11           HA       HIS  11 -14.344   0.747  -1.402
   85    HB2  HIS  11           HB2      HIS  11 -14.913  -0.931  -3.845
   86    HB3  HIS  11           HB1      HIS  11 -16.086  -0.695  -2.551
   87    HD2  HIS  11           HD2      HIS  11 -14.826   2.647  -2.617
   88    HE1  HIS  11           HE1      HIS  11 -17.346   2.544  -6.007
   89    HE2  HIS  11           HE2      HIS  11 -16.256   4.035  -4.274
   90    H    ARG  12           HN       ARG  12 -15.257  -0.790   0.058
   91    HA   ARG  12           HA       ARG  12 -13.480  -2.903   0.782
   92    HB2  ARG  12           HB2      ARG  12 -15.095  -3.247   2.624
   93    HB3  ARG  12           HB1      ARG  12 -14.636  -1.564   2.464
   94    HG2  ARG  12           HG2      ARG  12 -16.707  -0.997   1.490
   95    HG3  ARG  12           HG1      ARG  12 -17.142  -2.694   1.259
   96    HD2  ARG  12           HD2      ARG  12 -17.183  -3.007   3.660
   97    HD3  ARG  12           HD1      ARG  12 -16.746  -1.326   3.912
   98    HE   ARG  12           HE       ARG  12 -19.132  -1.662   2.351
   99   HH11  ARG  12          HH11      ARG  12 -17.866  -1.475   5.620
  100   HH12  ARG  12          HH12      ARG  12 -19.384  -0.996   6.312
  101   HH21  ARG  12          HH21      ARG  12 -21.113  -1.014   3.258
  102   HH22  ARG  12          HH22      ARG  12 -21.228  -0.731   4.968
  103    H    ALA  13           HN       ALA  13 -13.836  -5.116   0.665
  104    HA   ALA  13           HA       ALA  13 -16.100  -5.963  -1.016
  105    HB1  ALA  13           HB1      ALA  13 -14.594  -7.748  -1.897
  106    HB2  ALA  13           HB2      ALA  13 -13.256  -6.959  -1.058
  107    HB3  ALA  13           HB3      ALA  13 -14.118  -6.110  -2.341
  108    H    GLY  14           HN       GLY  14 -14.614  -8.724  -0.463
  109    HA2  GLY  14           HA2      GLY  14 -16.268  -9.281   1.895
  110    HA3  GLY  14           HA1      GLY  14 -15.661 -10.475   0.758
  111    H    LYS  15           HN       LYS  15 -13.179 -10.583   0.703
  112    HA   LYS  15           HA       LYS  15 -12.311 -10.840   3.485
  113    HB2  LYS  15           HB2      LYS  15 -11.994 -12.456   1.188
  114    HB3  LYS  15           HB1      LYS  15 -10.403 -11.878   1.646
  115    HG2  LYS  15           HG2      LYS  15 -12.193 -13.024   3.724
  116    HG3  LYS  15           HG1      LYS  15 -11.316 -14.096   2.635
  117    HD2  LYS  15           HD2      LYS  15  -9.646 -13.934   4.124
  118    HD3  LYS  15           HD1      LYS  15  -9.365 -12.344   3.418
  119    HE2  LYS  15           HE2      LYS  15 -10.751 -11.310   5.118
  120    HE3  LYS  15           HE1      LYS  15 -11.143 -12.890   5.791
  121    HZ1  LYS  15           HZ1      LYS  15  -8.810 -13.195   6.344
  122    HZ2  LYS  15           HZ2      LYS  15  -9.417 -11.794   7.069
  123    HZ3  LYS  15           HZ3      LYS  15  -8.434 -11.676   5.699
  124    H    LYS  16           HN       LYS  16 -11.105  -9.592   0.385
  125    HA   LYS  16           HA       LYS  16  -9.425  -7.727   1.921
  126    HB2  LYS  16           HB2      LYS  16  -7.917  -7.902  -0.255
  127    HB3  LYS  16           HB1      LYS  16  -7.701  -8.993   1.096
  128    HG2  LYS  16           HG2      LYS  16  -8.588 -10.789  -0.032
  129    HG3  LYS  16           HG1      LYS  16  -9.536  -9.771  -1.116
  130    HD2  LYS  16           HD2      LYS  16  -7.748 -10.748  -2.379
  131    HD3  LYS  16           HD1      LYS  16  -7.412  -9.028  -2.185
  132    HE2  LYS  16           HE2      LYS  16  -5.704  -9.431  -0.613
  133    HE3  LYS  16           HE1      LYS  16  -6.242 -11.084  -0.321
  134    HZ1  LYS  16           HZ1      LYS  16  -5.312 -10.292  -3.000
  135    HZ2  LYS  16           HZ2      LYS  16  -5.318 -11.826  -2.286
  136    HZ3  LYS  16           HZ3      LYS  16  -4.182 -10.667  -1.799
  137    H    TYR  17           HN       TYR  17  -8.734  -5.835   0.568
  138    HA   TYR  17           HA       TYR  17 -11.010  -4.669  -0.724
  139    HB2  TYR  17           HB2      TYR  17  -8.149  -3.761  -0.386
  140    HB3  TYR  17           HB1      TYR  17  -9.354  -2.807  -1.237
  141    HD1  TYR  17           HD1      TYR  17 -11.159  -1.709  -0.010
  142    HD2  TYR  17           HD2      TYR  17  -8.218  -4.021   2.002
  143    HE1  TYR  17           HE1      TYR  17 -11.837  -0.698   2.126
  144    HE2  TYR  17           HE2      TYR  17  -8.879  -3.037   4.138
  145    HH   TYR  17           HH       TYR  17 -10.007  -0.854   4.896
  146    H    GLY  18           HN       GLY  18  -9.010  -6.972  -1.755
  147    HA2  GLY  18           HA2      GLY  18  -9.281  -7.787  -4.008
  148    HA3  GLY  18           HA1      GLY  18  -9.314  -6.117  -4.549
  149    H    PHE  19           HN       PHE  19  -6.949  -6.211  -2.281
  150    HA   PHE  19           HA       PHE  19  -4.961  -7.206  -4.161
  151    HB2  PHE  19           HB2      PHE  19  -3.593  -5.290  -4.112
  152    HB3  PHE  19           HB1      PHE  19  -5.205  -4.749  -4.487
  153    HD1  PHE  19           HD1      PHE  19  -6.536  -3.530  -2.742
  154    HD2  PHE  19           HD2      PHE  19  -2.436  -4.542  -2.204
  155    HE1  PHE  19           HE1      PHE  19  -6.352  -1.843  -0.954
  156    HE2  PHE  19           HE2      PHE  19  -2.251  -2.874  -0.411
  157    HZ   PHE  19           HZ       PHE  19  -4.209  -1.520   0.214
  158    H    THR  20           HN       THR  20  -2.817  -7.164  -3.335
  159    HA   THR  20           HA       THR  20  -2.729  -8.108  -0.538
  160    HB   THR  20           HB       THR  20  -1.057  -8.908  -2.924
  161    HG1  THR  20           HG1      THR  20  -2.026 -10.942  -2.567
  162   HG21  THR  20          HG21      THR  20   0.111 -10.469  -1.440
  163   HG22  THR  20          HG22      THR  20  -0.793  -9.852  -0.060
  164   HG23  THR  20          HG23      THR  20   0.359  -8.807  -0.895
  165    H    LEU  21           HN       LEU  21  -1.619  -6.838   0.791
  166    HA   LEU  21           HA       LEU  21   0.215  -4.871  -0.342
  167    HB2  LEU  21           HB2      LEU  21  -1.500  -4.099   1.248
  168    HB3  LEU  21           HB1      LEU  21  -0.855  -5.174   2.471
  169    HG   LEU  21           HG       LEU  21   1.278  -3.904   2.413
  170   HD11  LEU  21          HD11      LEU  21  -0.264  -2.075   0.584
  171   HD12  LEU  21          HD12      LEU  21   1.172  -3.010   0.173
  172   HD13  LEU  21          HD13      LEU  21   1.283  -1.691   1.339
  173   HD21  LEU  21          HD21      LEU  21  -1.219  -2.331   3.001
  174   HD22  LEU  21          HD22      LEU  21   0.398  -1.919   3.569
  175   HD23  LEU  21          HD23      LEU  21  -0.367  -3.415   4.103
  176    H    ARG  22           HN       ARG  22   2.386  -4.974  -0.033
  177    HA   ARG  22           HA       ARG  22   3.378  -7.042   1.792
  178    HB2  ARG  22           HB2      ARG  22   4.101  -6.675  -1.101
  179    HB3  ARG  22           HB1      ARG  22   5.158  -7.511   0.017
  180    HG2  ARG  22           HG2      ARG  22   2.826  -8.816   0.463
  181    HG3  ARG  22           HG1      ARG  22   2.652  -8.372  -1.230
  182    HD2  ARG  22           HD2      ARG  22   3.787 -10.588  -0.739
  183    HD3  ARG  22           HD1      ARG  22   4.593  -9.508  -1.869
  184    HE   ARG  22           HE       ARG  22   5.380  -9.723   0.970
  185   HH11  ARG  22          HH11      ARG  22   6.199  -9.620  -2.431
  186   HH12  ARG  22          HH12      ARG  22   7.916  -9.585  -2.156
  187   HH21  ARG  22          HH21      ARG  22   7.624  -9.687   1.344
  188   HH22  ARG  22          HH22      ARG  22   8.725  -9.615   0.001
  189    H    ALA  23           HN       ALA  23   5.194  -6.531   2.875
  190    HA   ALA  23           HA       ALA  23   6.180  -3.795   2.521
  191    HB1  ALA  23           HB1      ALA  23   5.291  -4.832   4.776
  192    HB2  ALA  23           HB2      ALA  23   6.671  -3.733   4.765
  193    HB3  ALA  23           HB3      ALA  23   6.933  -5.473   4.869
  194    H    ILE  24           HN       ILE  24   8.014  -3.548   1.460
  195    HA   ILE  24           HA       ILE  24   9.830  -5.834   1.234
  196    HB   ILE  24           HB       ILE  24  10.937  -4.378  -0.563
  197   HG12  ILE  24          HG12      ILE  24   8.252  -3.001  -0.582
  198   HG13  ILE  24          HG11      ILE  24   9.669  -2.297   0.191
  199   HG21  ILE  24          HG21      ILE  24   8.134  -5.403  -0.994
  200   HG22  ILE  24          HG22      ILE  24   9.614  -6.360  -1.060
  201   HG23  ILE  24          HG23      ILE  24   9.323  -5.098  -2.259
  202   HD11  ILE  24          HD11      ILE  24  10.838  -2.388  -1.985
  203   HD12  ILE  24          HD12      ILE  24   9.404  -1.362  -2.000
  204   HD13  ILE  24          HD13      ILE  24   9.346  -2.969  -2.723
  205    H    ARG  25           HN       ARG  25  11.982  -5.687   1.713
  206    HA   ARG  25           HA       ARG  25  12.703  -3.489   3.526
  207    HB2  ARG  25           HB2      ARG  25  12.570  -5.823   4.419
  208    HB3  ARG  25           HB1      ARG  25  13.893  -6.257   3.355
  209    HG2  ARG  25           HG2      ARG  25  15.438  -5.008   4.559
  210    HG3  ARG  25           HG1      ARG  25  14.185  -4.041   5.343
  211    HD2  ARG  25           HD2      ARG  25  13.589  -5.766   6.791
  212    HD3  ARG  25           HD1      ARG  25  14.321  -7.001   5.776
  213    HE   ARG  25           HE       ARG  25  16.510  -6.054   6.487
  214   HH11  ARG  25          HH11      ARG  25  13.670  -5.548   8.477
  215   HH12  ARG  25          HH12      ARG  25  14.574  -5.430   9.952
  216   HH21  ARG  25          HH21      ARG  25  17.697  -5.913   8.407
  217   HH22  ARG  25          HH22      ARG  25  16.872  -5.639   9.913
  218    H    VAL  26           HN       VAL  26  13.566  -2.047   2.095
  219    HA   VAL  26           HA       VAL  26  15.758  -2.968   0.362
  220    HB   VAL  26           HB       VAL  26  14.181  -0.386   0.263
  221   HG11  VAL  26          HG11      VAL  26  15.382   0.033  -1.847
  222   HG12  VAL  26          HG12      VAL  26  16.371  -1.397  -1.551
  223   HG13  VAL  26          HG13      VAL  26  16.471  -0.016  -0.460
  224   HG21  VAL  26          HG21      VAL  26  14.200  -2.766  -1.582
  225   HG22  VAL  26          HG22      VAL  26  13.298  -1.273  -1.840
  226   HG23  VAL  26          HG23      VAL  26  12.901  -2.320  -0.477
  227    H    TYR  27           HN       TYR  27  17.729  -2.666   1.168
  228    HA   TYR  27           HA       TYR  27  18.109  -0.953   3.428
  229    HB2  TYR  27           HB2      TYR  27  19.952  -2.691   1.838
  230    HB3  TYR  27           HB1      TYR  27  20.536  -1.649   3.113
  231    HD1  TYR  27           HD2      TYR  27  18.134  -4.405   2.460
  232    HD2  TYR  27           HD1      TYR  27  20.512  -2.363   5.338
  233    HE1  TYR  27           HE2      TYR  27  17.592  -6.132   4.122
  234    HE2  TYR  27           HE1      TYR  27  19.982  -4.091   7.003
  235    HH   TYR  27           HH       TYR  27  18.628  -7.055   6.210
  236    H    MET  28           HN       MET  28  19.164   0.905   3.570
  237    HA   MET  28           HA       MET  28  19.326   2.575   1.267
  238    HB2  MET  28           HB2      MET  28  20.000   2.906   4.183
  239    HB3  MET  28           HB1      MET  28  20.352   4.155   3.016
  240    HG2  MET  28           HG2      MET  28  17.627   3.029   3.555
  241    HG3  MET  28           HG1      MET  28  18.262   4.521   4.236
  242    HE1  MET  28           HE1      MET  28  15.547   4.821   2.870
  243    HE2  MET  28           HE2      MET  28  15.843   6.215   1.832
  244    HE3  MET  28           HE3      MET  28  16.539   6.157   3.451
  245    H    GLY  29           HN       GLY  29  21.027   2.774  -0.052
  246    HA2  GLY  29           HA2      GLY  29  23.432   1.310   0.387
  247    HA3  GLY  29           HA1      GLY  29  23.119   2.419  -0.939
  248    H    ASP  30           HN       ASP  30  23.914   2.335   2.500
  249    HA   ASP  30           HA       ASP  30  26.076   4.157   2.214
  250    HB2  ASP  30           HB2      ASP  30  24.269   5.812   2.068
  251    HB3  ASP  30           HB1      ASP  30  23.578   5.205   3.569
  252    H    SER  31           HN       SER  31  23.606   3.098   4.529
  253    HA   SER  31           HA       SER  31  25.785   2.316   6.336
  254    HB2  SER  31           HB2      SER  31  23.060   3.310   7.187
  255    HB3  SER  31           HB1      SER  31  24.442   2.968   8.222
  256    HG   SER  31           HG       SER  31  24.869   4.802   6.175
  257    H    ASP  32           HN       ASP  32  23.754   1.235   8.218
  258    HA   ASP  32           HA       ASP  32  23.351  -1.338   6.864
  259    HB2  ASP  32           HB2      ASP  32  24.644  -1.321   8.949
  260    HB3  ASP  32           HB1      ASP  32  23.290  -0.594   9.795
  261    H    VAL  33           HN       VAL  33  21.760   1.380   8.008
  262    HA   VAL  33           HA       VAL  33  19.284   0.506   8.837
  263    HB   VAL  33           HB       VAL  33  19.974   2.817   9.025
  264   HG11  VAL  33          HG11      VAL  33  21.076   2.852   6.745
  265   HG12  VAL  33          HG12      VAL  33  20.197   4.305   7.217
  266   HG13  VAL  33          HG13      VAL  33  19.469   3.161   6.090
  267   HG21  VAL  33          HG21      VAL  33  17.511   2.663   7.312
  268   HG22  VAL  33          HG22      VAL  33  17.907   3.903   8.503
  269   HG23  VAL  33          HG23      VAL  33  17.567   2.255   9.028
  270    H    TYR  34           HN       TYR  34  17.332   0.230   7.879
  271    HA   TYR  34           HA       TYR  34  17.371  -0.409   5.007
  272    HB2  TYR  34           HB2      TYR  34  15.635  -2.103   5.461
  273    HB3  TYR  34           HB1      TYR  34  17.142  -2.454   6.287
  274    HD1  TYR  34           HD1      TYR  34  17.302  -2.144   8.755
  275    HD2  TYR  34           HD2      TYR  34  13.631  -1.638   6.662
  276    HE1  TYR  34           HE1      TYR  34  16.076  -2.283  10.881
  277    HE2  TYR  34           HE2      TYR  34  12.397  -1.777   8.781
  278    HH   TYR  34           HH       TYR  34  13.913  -1.573  11.811
  279    H    THR  35           HN       THR  35  15.285  -0.324   4.002
  280    HA   THR  35           HA       THR  35  13.588   1.806   5.115
  281    HB   THR  35           HB       THR  35  13.790   1.563   2.166
  282    HG1  THR  35           HG1      THR  35  15.966   1.448   2.655
  283   HG21  THR  35          HG21      THR  35  13.872   3.965   3.996
  284   HG22  THR  35          HG22      THR  35  12.383   3.245   3.378
  285   HG23  THR  35          HG23      THR  35  13.547   3.958   2.262
  286    H    VAL  36           HN       VAL  36  11.848   0.689   5.743
  287    HA   VAL  36           HA       VAL  36  10.856  -1.527   4.188
  288    HB   VAL  36           HB       VAL  36  10.686  -1.857   6.530
  289   HG11  VAL  36          HG11      VAL  36   9.428  -0.336   8.019
  290   HG12  VAL  36          HG12      VAL  36   9.272   0.799   6.679
  291   HG13  VAL  36          HG13      VAL  36  10.867   0.408   7.322
  292   HG21  VAL  36          HG21      VAL  36   8.738  -2.591   5.186
  293   HG22  VAL  36          HG22      VAL  36   7.917  -1.093   5.627
  294   HG23  VAL  36          HG23      VAL  36   8.344  -2.264   6.873
  295    H    HIS  37           HN       HIS  37   9.855  -1.048   2.367
  296    HA   HIS  37           HA       HIS  37   8.113   1.305   2.281
  297    HB2  HIS  37           HB2      HIS  37   9.249  -0.404   0.077
  298    HB3  HIS  37           HB1      HIS  37   8.084   0.874  -0.195
  299    HD2  HIS  37           HD2      HIS  37  11.840   0.373   0.156
  300    HE1  HIS  37           HE1      HIS  37  11.089   4.533   0.210
  301    HE2  HIS  37           HE2      HIS  37  12.851   2.744  -0.128
  302    H    HIS  38           HN       HIS  38   6.012   1.182   1.625
  303    HA   HIS  38           HA       HIS  38   4.769  -1.455   1.941
  304    HB2  HIS  38           HB2      HIS  38   3.538   1.303   2.168
  305    HB3  HIS  38           HB1      HIS  38   2.703  -0.220   2.465
  306    HD2  HIS  38           HD2      HIS  38   4.831   2.353   4.303
  307    HE1  HIS  38           HE1      HIS  38   4.608  -1.072   6.775
  308    HE2  HIS  38           HE2      HIS  38   5.506   1.285   6.570
  309    H    MET  39           HN       MET  39   4.732  -2.346  -0.019
  310    HA   MET  39           HA       MET  39   3.591  -0.737  -2.204
  311    HB2  MET  39           HB2      MET  39   5.859  -1.130  -2.771
  312    HB3  MET  39           HB1      MET  39   5.784  -2.805  -2.239
  313    HG2  MET  39           HG2      MET  39   3.871  -2.265  -4.339
  314    HG3  MET  39           HG1      MET  39   5.513  -1.859  -4.832
  315    HE1  MET  39           HE1      MET  39   7.378  -5.134  -4.958
  316    HE2  MET  39           HE2      MET  39   7.538  -3.601  -4.096
  317    HE3  MET  39           HE3      MET  39   7.107  -3.613  -5.811
  318    H    VAL  40           HN       VAL  40   1.932  -1.541  -3.315
  319    HA   VAL  40           HA       VAL  40   0.582  -3.871  -2.380
  320    HB   VAL  40           HB       VAL  40  -0.936  -2.339  -3.229
  321   HG11  VAL  40          HG11      VAL  40  -0.600  -1.197  -5.457
  322   HG12  VAL  40          HG12      VAL  40   1.048  -1.824  -5.424
  323   HG13  VAL  40          HG13      VAL  40   0.495  -0.724  -4.160
  324   HG21  VAL  40          HG21      VAL  40  -1.624  -3.156  -5.586
  325   HG22  VAL  40          HG22      VAL  40  -1.688  -4.290  -4.232
  326   HG23  VAL  40          HG23      VAL  40  -0.339  -4.350  -5.365
  327    H    TRP  41           HN       TRP  41   1.082  -5.893  -2.928
  328    HA   TRP  41           HA       TRP  41   3.138  -6.339  -4.902
  329    HB2  TRP  41           HB2      TRP  41   3.231  -7.461  -2.745
  330    HB3  TRP  41           HB1      TRP  41   1.708  -8.282  -3.089
  331    HD1  TRP  41           HD1      TRP  41   1.943 -10.612  -4.186
  332    HE1  TRP  41           HE1      TRP  41   3.837 -11.898  -5.369
  333    HE3  TRP  41           HE3      TRP  41   5.478  -6.925  -4.286
  334    HZ2  TRP  41           HZ2      TRP  41   6.482 -11.403  -6.231
  335    HZ3  TRP  41           HZ3      TRP  41   7.662  -7.406  -5.310
  336    HH2  TRP  41           HH2      TRP  41   8.151  -9.601  -6.260
  337    H    HIS  42           HN       HIS  42  -0.282  -7.145  -4.546
  338    HA   HIS  42           HA       HIS  42  -0.386  -7.702  -7.397
  339    HB2  HIS  42           HB2      HIS  42   0.235  -9.866  -6.174
  340    HB3  HIS  42           HB1      HIS  42  -1.363  -9.804  -5.444
  341    HD2  HIS  42           HD2      HIS  42   0.324 -10.607  -8.843
  342    HE1  HIS  42           HE1      HIS  42  -3.806 -11.478  -9.113
  343    HE2  HIS  42           HE2      HIS  42  -1.525 -11.864 -10.155
  344    H    VAL  43           HN       VAL  43  -2.431  -7.568  -8.255
  345    HA   VAL  43           HA       VAL  43  -4.592  -6.747  -6.429
  346    HB   VAL  43           HB       VAL  43  -4.025  -5.545  -9.151
  347   HG11  VAL  43          HG11      VAL  43  -5.803  -3.955  -8.548
  348   HG12  VAL  43          HG12      VAL  43  -6.097  -4.868  -7.069
  349   HG13  VAL  43          HG13      VAL  43  -6.393  -5.614  -8.638
  350   HG21  VAL  43          HG21      VAL  43  -3.770  -4.204  -6.465
  351   HG22  VAL  43          HG22      VAL  43  -3.335  -3.545  -8.044
  352   HG23  VAL  43          HG23      VAL  43  -2.408  -4.878  -7.355
  353    H    GLU  44           HN       GLU  44  -6.349  -8.006  -6.650
  354    HA   GLU  44           HA       GLU  44  -6.542 -10.091  -8.477
  355    HB2  GLU  44           HB2      GLU  44  -8.607  -8.685  -6.786
  356    HB3  GLU  44           HB1      GLU  44  -8.898 -10.164  -7.659
  357    HG2  GLU  44           HG2      GLU  44  -6.975  -9.758  -5.404
  358    HG3  GLU  44           HG1      GLU  44  -8.464 -10.698  -5.377
  359    H    ASP  45           HN       ASP  45  -7.295 -10.196 -10.519
  360    HA   ASP  45           HA       ASP  45  -7.903  -7.836 -11.958
  361    HB2  ASP  45           HB2      ASP  45  -7.768 -10.724 -12.585
  362    HB3  ASP  45           HB1      ASP  45  -8.789  -9.753 -13.638
  363    H    GLY  46           HN       GLY  46  -9.684  -6.717 -11.669
  364    HA2  GLY  46           HA2      GLY  46 -12.004  -6.420 -12.079
  365    HA3  GLY  46           HA1      GLY  46 -12.250  -8.134 -11.771
  366    H    GLY  47           HN       GLY  47 -10.172  -7.013  -9.472
  367    HA2  GLY  47           HA2      GLY  47 -12.203  -7.092  -7.432
  368    HA3  GLY  47           HA1      GLY  47 -10.477  -6.863  -7.183
  369    HA   PRO  48           HA       PRO  48 -13.099  -2.869  -6.521
  370    HB2  PRO  48           HB2      PRO  48 -11.562  -3.170  -3.976
  371    HB3  PRO  48           HB1      PRO  48 -13.204  -2.555  -4.213
  372    HG2  PRO  48           HG2      PRO  48 -12.891  -4.946  -3.249
  373    HG3  PRO  48           HG1      PRO  48 -14.012  -4.715  -4.597
  374    HD2  PRO  48           HD2      PRO  48 -11.208  -5.738  -4.680
  375    HD3  PRO  48           HD1      PRO  48 -12.660  -6.408  -5.418
  376    H    ALA  49           HN       ALA  49  -9.898  -3.697  -5.350
  377    HA   ALA  49           HA       ALA  49  -8.769  -1.141  -5.656
  378    HB1  ALA  49           HB1      ALA  49  -7.387  -3.824  -5.689
  379    HB2  ALA  49           HB2      ALA  49  -7.706  -2.825  -4.273
  380    HB3  ALA  49           HB3      ALA  49  -6.579  -2.266  -5.509
  381    H    SER  50           HN       SER  50  -9.065  -3.818  -7.888
  382    HA   SER  50           HA       SER  50  -7.385  -2.809  -9.929
  383    HB2  SER  50           HB2      SER  50  -8.457  -5.168  -9.638
  384    HB3  SER  50           HB1      SER  50  -9.838  -4.463 -10.461
  385    HG   SER  50           HG       SER  50  -7.302  -5.076 -11.442
  386    H    GLU  51           HN       GLU  51 -10.723  -2.426  -9.071
  387    HA   GLU  51           HA       GLU  51 -11.473  -0.941 -11.394
  388    HB2  GLU  51           HB2      GLU  51 -12.852  -1.133  -8.709
  389    HB3  GLU  51           HB1      GLU  51 -13.573  -0.522 -10.195
  390    HG2  GLU  51           HG2      GLU  51 -13.052  -2.836 -11.164
  391    HG3  GLU  51           HG1      GLU  51 -12.815  -3.330  -9.489
  392    H    ALA  52           HN       ALA  52 -10.327  -0.208  -8.217
  393    HA   ALA  52           HA       ALA  52 -10.815   2.584  -8.273
  394    HB1  ALA  52           HB1      ALA  52  -8.808   1.072  -6.624
  395    HB2  ALA  52           HB2      ALA  52 -10.515   1.241  -6.218
  396    HB3  ALA  52           HB3      ALA  52  -9.477   2.667  -6.287
  397    H    GLY  53           HN       GLY  53  -8.298   0.546  -9.510
  398    HA2  GLY  53           HA2      GLY  53  -6.940   1.384 -11.308
  399    HA3  GLY  53           HA1      GLY  53  -6.960   2.942 -10.516
  400    H    LEU  54           HN       LEU  54  -6.478   0.447  -8.293
  401    HA   LEU  54           HA       LEU  54  -3.854   1.330  -7.663
  402    HB2  LEU  54           HB2      LEU  54  -5.774  -0.222  -6.433
  403    HB3  LEU  54           HB1      LEU  54  -4.505  -1.371  -6.772
  404    HG   LEU  54           HG       LEU  54  -4.474   1.004  -4.951
  405   HD11  LEU  54          HD11      LEU  54  -4.989  -1.238  -4.086
  406   HD12  LEU  54          HD12      LEU  54  -3.499  -0.570  -3.404
  407   HD13  LEU  54          HD13      LEU  54  -3.419  -1.802  -4.666
  408   HD21  LEU  54          HD21      LEU  54  -2.558   1.448  -6.284
  409   HD22  LEU  54          HD22      LEU  54  -2.076  -0.243  -6.269
  410   HD23  LEU  54          HD23      LEU  54  -1.990   0.709  -4.787
  411    H    ARG  55           HN       ARG  55  -1.905   0.516  -8.189
  412    HA   ARG  55           HA       ARG  55  -1.824  -1.730 -10.087
  413    HB2  ARG  55           HB2      ARG  55   0.075   0.618 -10.061
  414    HB3  ARG  55           HB1      ARG  55  -0.075  -0.626 -11.296
  415    HG2  ARG  55           HG2      ARG  55  -2.368   1.174 -10.637
  416    HG3  ARG  55           HG1      ARG  55  -1.094   1.682 -11.741
  417    HD2  ARG  55           HD2      ARG  55  -1.562  -0.118 -13.231
  418    HD3  ARG  55           HD1      ARG  55  -2.631  -0.885 -12.057
  419    HE   ARG  55           HE       ARG  55  -3.250   1.694 -13.352
  420   HH11  ARG  55          HH11      ARG  55  -4.212  -1.478 -12.216
  421   HH12  ARG  55          HH12      ARG  55  -5.860  -1.299 -12.721
  422   HH21  ARG  55          HH21      ARG  55  -5.434   1.944 -13.982
  423   HH22  ARG  55          HH22      ARG  55  -6.565   0.661 -13.692
  424    H    GLN  56           HN       GLN  56  -0.516  -3.363  -9.539
  425    HA   GLN  56           HA       GLN  56   0.826  -3.282  -7.022
  426    HB2  GLN  56           HB2      GLN  56   1.752  -5.573  -8.287
  427    HB3  GLN  56           HB1      GLN  56   0.427  -5.458  -7.154
  428    HG2  GLN  56           HG2      GLN  56  -1.174  -5.534  -8.784
  429    HG3  GLN  56           HG1      GLN  56  -0.060  -4.988 -10.008
  430   HE21  GLN  56          HE21      GLN  56   2.053  -6.757  -9.490
  431   HE22  GLN  56          HE22      GLN  56   1.546  -8.343  -9.956
  432    H    GLY  57           HN       GLY  57   2.912  -3.063  -6.553
  433    HA2  GLY  57           HA2      GLY  57   5.233  -3.108  -7.061
  434    HA3  GLY  57           HA1      GLY  57   4.845  -2.878  -8.755
  435    H    ASP  58           HN       ASP  58   2.950  -0.835  -6.905
  436    HA   ASP  58           HA       ASP  58   4.622   1.449  -7.585
  437    HB2  ASP  58           HB2      ASP  58   1.871   1.314  -6.339
  438    HB3  ASP  58           HB1      ASP  58   2.699   2.800  -6.759
  439    H    LEU  59           HN       LEU  59   3.666   3.139  -5.492
  440    HA   LEU  59           HA       LEU  59   4.780   1.943  -3.105
  441    HB2  LEU  59           HB2      LEU  59   5.803   4.298  -4.588
  442    HB3  LEU  59           HB1      LEU  59   5.715   4.459  -2.845
  443    HG   LEU  59           HG       LEU  59   7.281   2.391  -4.375
  444   HD11  LEU  59          HD11      LEU  59   8.124   4.738  -2.681
  445   HD12  LEU  59          HD12      LEU  59   8.288   4.593  -4.431
  446   HD13  LEU  59          HD13      LEU  59   9.214   3.534  -3.368
  447   HD21  LEU  59          HD21      LEU  59   6.524   1.321  -2.403
  448   HD22  LEU  59          HD22      LEU  59   6.815   2.760  -1.425
  449   HD23  LEU  59          HD23      LEU  59   8.175   1.846  -2.079
  450    H    ILE  60           HN       ILE  60   3.206   2.074  -1.663
  451    HA   ILE  60           HA       ILE  60   1.220   4.154  -1.874
  452    HB   ILE  60           HB       ILE  60   1.563   1.948   0.175
  453   HG12  ILE  60          HG12      ILE  60  -0.629   2.154  -1.885
  454   HG13  ILE  60          HG11      ILE  60   0.923   1.426  -2.290
  455   HG21  ILE  60          HG21      ILE  60   0.405   3.635   1.309
  456   HG22  ILE  60          HG22      ILE  60  -0.857   2.553   0.717
  457   HG23  ILE  60          HG23      ILE  60  -0.533   4.077  -0.117
  458   HD11  ILE  60          HD11      ILE  60   0.608  -0.214  -0.513
  459   HD12  ILE  60          HD12      ILE  60  -0.713  -0.250  -1.681
  460   HD13  ILE  60          HD13      ILE  60  -0.945   0.519  -0.110
  461    H    THR  61           HN       THR  61   1.747   6.112  -1.178
  462    HA   THR  61           HA       THR  61   3.659   6.406   0.999
  463    HB   THR  61           HB       THR  61   4.225   7.779  -0.819
  464    HG1  THR  61           HG1      THR  61   2.830   9.426   1.049
  465   HG21  THR  61          HG21      THR  61   2.697   9.357  -1.900
  466   HG22  THR  61          HG22      THR  61   1.386   8.808  -0.858
  467   HG23  THR  61          HG23      THR  61   2.100   7.700  -2.031
  468    H    HIS  62           HN       HIS  62   0.249   7.030   0.315
  469    HA   HIS  62           HA       HIS  62  -0.068   7.656   3.164
  470    HB2  HIS  62           HB2      HIS  62  -1.602   9.217   1.083
  471    HB3  HIS  62           HB1      HIS  62  -1.553   9.485   2.812
  472    HD2  HIS  62           HD2      HIS  62   0.820  10.701   3.770
  473    HE1  HIS  62           HE1      HIS  62   1.948  12.059  -0.072
  474    HE2  HIS  62           HE2      HIS  62   2.238  12.402   2.422
  475    H    VAL  63           HN       VAL  63  -1.945   6.991   4.083
  476    HA   VAL  63           HA       VAL  63  -3.834   5.523   2.365
  477    HB   VAL  63           HB       VAL  63  -2.832   4.731   5.112
  478   HG11  VAL  63          HG11      VAL  63  -4.912   3.320   3.446
  479   HG12  VAL  63          HG12      VAL  63  -5.295   4.409   4.778
  480   HG13  VAL  63          HG13      VAL  63  -4.394   2.925   5.085
  481   HG21  VAL  63          HG21      VAL  63  -2.648   3.332   2.443
  482   HG22  VAL  63          HG22      VAL  63  -2.091   2.683   3.985
  483   HG23  VAL  63          HG23      VAL  63  -1.320   4.114   3.302
  484    H    ASN  64           HN       ASN  64  -5.682   6.622   2.384
  485    HA   ASN  64           HA       ASN  64  -7.516   7.765   3.084
  486    HB2  ASN  64           HB2      ASN  64  -6.626   6.826   5.827
  487    HB3  ASN  64           HB1      ASN  64  -8.143   7.659   5.516
  488   HD21  ASN  64          HD21      ASN  64  -7.436   4.942   6.502
  489   HD22  ASN  64          HD22      ASN  64  -8.329   3.864   5.492
  490    H    GLY  65           HN       GLY  65  -4.800   8.937   2.901
  491    HA2  GLY  65           HA2      GLY  65  -4.177  11.185   2.923
  492    HA3  GLY  65           HA1      GLY  65  -5.464  11.509   4.076
  493    H    GLU  66           HN       GLU  66  -3.624   8.827   4.983
  494    HA   GLU  66           HA       GLU  66  -2.207  10.472   6.966
  495    HB2  GLU  66           HB2      GLU  66  -2.622   7.498   7.076
  496    HB3  GLU  66           HB1      GLU  66  -2.239   8.584   8.400
  497    HG2  GLU  66           HG2      GLU  66  -4.829   8.689   6.894
  498    HG3  GLU  66           HG1      GLU  66  -4.586   7.688   8.318
  499    HA   PRO  67           HA       PRO  67   1.565   9.258   4.878
  500    HB2  PRO  67           HB2      PRO  67   3.302  10.301   6.708
  501    HB3  PRO  67           HB1      PRO  67   2.478  11.277   5.488
  502    HG2  PRO  67           HG2      PRO  67   1.903  10.983   8.386
  503    HG3  PRO  67           HG1      PRO  67   1.694  12.391   7.335
  504    HD2  PRO  67           HD2      PRO  67  -0.336  10.710   8.175
  505    HD3  PRO  67           HD1      PRO  67  -0.418  11.772   6.759
  506    H    VAL  68           HN       VAL  68   1.885   7.129   4.981
  507    HA   VAL  68           HA       VAL  68   2.152   5.808   7.565
  508    HB   VAL  68           HB       VAL  68   2.010   3.713   6.344
  509   HG11  VAL  68          HG11      VAL  68  -0.279   3.902   5.595
  510   HG12  VAL  68          HG12      VAL  68  -0.112   5.650   5.432
  511   HG13  VAL  68          HG13      VAL  68  -0.040   4.901   7.027
  512   HG21  VAL  68          HG21      VAL  68   1.685   3.612   3.960
  513   HG22  VAL  68          HG22      VAL  68   3.183   4.482   4.291
  514   HG23  VAL  68          HG23      VAL  68   1.728   5.370   3.839
  515    H    HIS  69           HN       HIS  69   4.231   7.301   5.546
  516    HA   HIS  69           HA       HIS  69   6.333   5.446   5.271
  517    HB2  HIS  69           HB2      HIS  69   6.187   7.568   3.993
  518    HB3  HIS  69           HB1      HIS  69   6.513   8.463   5.470
  519    HD2  HIS  69           HD2      HIS  69   9.171   8.171   6.467
  520    HE1  HIS  69           HE1      HIS  69  10.638   6.592   2.829
  521    HE2  HIS  69           HE2      HIS  69  11.250   7.316   5.176
  522    H    GLY  70           HN       GLY  70   6.920   4.359   7.061
  523    HA2  GLY  70           HA2      GLY  70   8.762   4.765   8.773
  524    HA3  GLY  70           HA1      GLY  70   7.635   5.931   9.446
  525    H    LEU  71           HN       LEU  71   5.350   4.058   8.712
  526    HA   LEU  71           HA       LEU  71   5.290   2.692  11.230
  527    HB2  LEU  71           HB2      LEU  71   3.462   2.562   8.849
  528    HB3  LEU  71           HB1      LEU  71   3.155   1.783  10.379
  529    HG   LEU  71           HG       LEU  71   3.398   4.728  10.002
  530   HD11  LEU  71          HD11      LEU  71   1.507   4.101   8.828
  531   HD12  LEU  71          HD12      LEU  71   0.909   4.618  10.408
  532   HD13  LEU  71          HD13      LEU  71   1.058   2.893  10.035
  533   HD21  LEU  71          HD21      LEU  71   2.383   4.842  12.239
  534   HD22  LEU  71          HD22      LEU  71   3.958   4.049  12.259
  535   HD23  LEU  71          HD23      LEU  71   2.484   3.084  12.347
  536    H    VAL  72           HN       VAL  72   4.399   0.433  11.249
  537    HA   VAL  72           HA       VAL  72   6.189  -1.327   9.804
  538    HB   VAL  72           HB       VAL  72   5.080  -3.115  11.161
  539   HG11  VAL  72          HG11      VAL  72   7.107  -2.180  12.008
  540   HG12  VAL  72          HG12      VAL  72   5.988  -2.354  13.360
  541   HG13  VAL  72          HG13      VAL  72   6.256  -0.771  12.635
  542   HG21  VAL  72          HG21      VAL  72   3.224  -0.943  11.679
  543   HG22  VAL  72          HG22      VAL  72   3.832  -1.659  13.178
  544   HG23  VAL  72          HG23      VAL  72   3.051  -2.680  11.974
  545    H    HIS  73           HN       HIS  73   4.997  -3.457   9.067
  546    HA   HIS  73           HA       HIS  73   3.420  -2.786   6.852
  547    HB2  HIS  73           HB2      HIS  73   4.812  -4.812   6.996
  548    HB3  HIS  73           HB1      HIS  73   3.727  -5.467   8.216
  549    HD1  HIS  73           HD1      HIS  73   3.280  -4.133   4.650
  550    HD2  HIS  73           HD2      HIS  73   2.010  -7.198   7.153
  551    HE1  HIS  73           HE1      HIS  73   1.763  -5.602   3.265
  552    H    THR  74           HN       THR  74   2.517  -4.109  10.010
  553    HA   THR  74           HA       THR  74  -0.231  -4.452   9.362
  554    HB   THR  74           HB       THR  74  -0.397  -4.532  11.951
  555    HG1  THR  74           HG1      THR  74   1.606  -4.877  12.948
  556   HG21  THR  74          HG21      THR  74   0.535  -6.843  11.904
  557   HG22  THR  74          HG22      THR  74   1.189  -6.494  10.303
  558   HG23  THR  74          HG23      THR  74  -0.556  -6.496  10.564
  559    H    GLU  75           HN       GLU  75   1.519  -1.740  10.874
  560    HA   GLU  75           HA       GLU  75  -0.693  -0.429  11.924
  561    HB2  GLU  75           HB2      GLU  75   1.926   0.659  10.892
  562    HB3  GLU  75           HB1      GLU  75   0.687   1.654  11.562
  563    HG2  GLU  75           HG2      GLU  75   1.570  -0.673  13.131
  564    HG3  GLU  75           HG1      GLU  75   2.578   0.772  13.089
  565    H    VAL  76           HN       VAL  76   0.763  -0.269   8.734
  566    HA   VAL  76           HA       VAL  76  -1.125   1.649   7.760
  567    HB   VAL  76           HB       VAL  76  -0.057   1.524   5.688
  568   HG11  VAL  76          HG11      VAL  76   1.373   2.279   7.590
  569   HG12  VAL  76          HG12      VAL  76   2.270   1.702   6.182
  570   HG13  VAL  76          HG13      VAL  76   2.100   0.673   7.605
  571   HG21  VAL  76          HG21      VAL  76   1.346  -0.321   4.928
  572   HG22  VAL  76          HG22      VAL  76  -0.288  -0.878   5.292
  573   HG23  VAL  76          HG23      VAL  76   1.024  -1.194   6.426
  574    H    VAL  77           HN       VAL  77  -0.868  -1.863   7.769
  575    HA   VAL  77           HA       VAL  77  -2.931  -2.505   5.988
  576    HB   VAL  77           HB       VAL  77  -1.753  -3.924   8.359
  577   HG11  VAL  77          HG11      VAL  77  -4.161  -4.482   8.334
  578   HG12  VAL  77          HG12      VAL  77  -3.123  -5.863   7.985
  579   HG13  VAL  77          HG13      VAL  77  -3.981  -5.053   6.673
  580   HG21  VAL  77          HG21      VAL  77  -1.041  -5.527   6.648
  581   HG22  VAL  77          HG22      VAL  77  -0.488  -3.892   6.282
  582   HG23  VAL  77          HG23      VAL  77  -1.867  -4.572   5.417
  583    H    GLU  78           HN       GLU  78  -3.004  -2.061   9.499
  584    HA   GLU  78           HA       GLU  78  -5.749  -2.341   9.851
  585    HB2  GLU  78           HB2      GLU  78  -3.806  -0.687  11.356
  586    HB3  GLU  78           HB1      GLU  78  -5.428  -1.041  11.904
  587    HG2  GLU  78           HG2      GLU  78  -4.721  -3.457  11.526
  588    HG3  GLU  78           HG1      GLU  78  -3.093  -2.830  11.644
  589    H    LEU  79           HN       LEU  79  -3.783   0.479   9.407
  590    HA   LEU  79           HA       LEU  79  -5.591   2.527   9.458
  591    HB2  LEU  79           HB2      LEU  79  -2.988   2.186   8.521
  592    HB3  LEU  79           HB1      LEU  79  -3.872   2.818   7.146
  593    HG   LEU  79           HG       LEU  79  -4.691   4.651   8.744
  594   HD11  LEU  79          HD11      LEU  79  -3.957   3.492  10.808
  595   HD12  LEU  79          HD12      LEU  79  -3.290   5.117  10.652
  596   HD13  LEU  79          HD13      LEU  79  -2.284   3.712  10.299
  597   HD21  LEU  79          HD21      LEU  79  -3.277   5.417   7.124
  598   HD22  LEU  79          HD22      LEU  79  -1.992   4.287   7.563
  599   HD23  LEU  79          HD23      LEU  79  -2.289   5.717   8.557
  600    H    ILE  80           HN       ILE  80  -4.702   0.707   6.507
  601    HA   ILE  80           HA       ILE  80  -6.600   1.640   4.763
  602    HB   ILE  80           HB       ILE  80  -5.496  -1.148   5.094
  603   HG12  ILE  80          HG12      ILE  80  -4.596   0.825   3.059
  604   HG13  ILE  80          HG11      ILE  80  -4.048   1.000   4.710
  605   HG21  ILE  80          HG21      ILE  80  -7.466  -1.268   3.747
  606   HG22  ILE  80          HG22      ILE  80  -6.048  -1.450   2.710
  607   HG23  ILE  80          HG23      ILE  80  -6.921   0.082   2.749
  608   HD11  ILE  80          HD11      ILE  80  -2.972  -1.045   4.696
  609   HD12  ILE  80          HD12      ILE  80  -2.549  -0.286   3.159
  610   HD13  ILE  80          HD13      ILE  80  -3.766  -1.565   3.209
  611    H    LEU  81           HN       LEU  81  -6.839  -1.241   6.811
  612    HA   LEU  81           HA       LEU  81  -9.439  -1.995   6.286
  613    HB2  LEU  81           HB2      LEU  81  -7.867  -2.178   8.851
  614    HB3  LEU  81           HB1      LEU  81  -9.384  -3.006   8.587
  615    HG   LEU  81           HG       LEU  81  -6.920  -3.440   6.902
  616   HD11  LEU  81          HD11      LEU  81  -6.511  -4.145   9.195
  617   HD12  LEU  81          HD12      LEU  81  -6.675  -5.542   8.132
  618   HD13  LEU  81          HD13      LEU  81  -8.008  -5.073   9.188
  619   HD21  LEU  81          HD21      LEU  81  -8.073  -5.308   5.992
  620   HD22  LEU  81          HD22      LEU  81  -9.177  -3.936   5.895
  621   HD23  LEU  81          HD23      LEU  81  -9.385  -5.147   7.156
  622    H    LYS  82           HN       LYS  82  -8.351   0.366   8.709
  623    HA   LYS  82           HA       LYS  82 -10.912   0.798   9.815
  624    HB2  LYS  82           HB2      LYS  82  -8.454   2.509   9.976
  625    HB3  LYS  82           HB1      LYS  82  -9.857   2.600  11.042
  626    HG2  LYS  82           HG2      LYS  82  -9.455   0.230  11.645
  627    HG3  LYS  82           HG1      LYS  82  -7.978   0.295  10.718
  628    HD2  LYS  82           HD2      LYS  82  -8.544   2.191  12.981
  629    HD3  LYS  82           HD1      LYS  82  -7.754   0.635  13.226
  630    HE2  LYS  82           HE2      LYS  82  -6.113   1.414  11.409
  631    HE3  LYS  82           HE1      LYS  82  -6.771   3.024  11.700
  632    HZ1  LYS  82           HZ1      LYS  82  -6.234   2.535  14.134
  633    HZ2  LYS  82           HZ2      LYS  82  -4.946   2.900  13.108
  634    HZ3  LYS  82           HZ3      LYS  82  -5.245   1.295  13.551
  635    H    SER  83           HN       SER  83  -9.851   1.749   6.830
  636    HA   SER  83           HA       SER  83 -10.547   4.375   6.472
  637    HB2  SER  83           HB2      SER  83 -11.190   3.699   4.134
  638    HB3  SER  83           HB1      SER  83  -9.607   3.129   4.656
  639    HG   SER  83           HG       SER  83 -10.292   1.126   4.616
  640    H    GLY  84           HN       GLY  84 -12.781   1.700   5.735
  641    HA2  GLY  84           HA2      GLY  84 -15.012   1.590   6.631
  642    HA3  GLY  84           HA1      GLY  84 -15.002   3.342   6.760
  643    H    ASN  85           HN       ASN  85 -15.704   0.643   4.811
  644    HA   ASN  85           HA       ASN  85 -16.898   0.361   2.918
  645    HB2  ASN  85           HB2      ASN  85 -18.568   1.870   3.216
  646    HB3  ASN  85           HB1      ASN  85 -17.463   3.195   3.548
  647   HD21  ASN  85          HD21      ASN  85 -18.891   1.263   0.962
  648   HD22  ASN  85          HD22      ASN  85 -18.744   2.479  -0.259
  649    H    LYS  86           HN       LYS  86 -14.552   3.006   2.717
  650    HA   LYS  86           HA       LYS  86 -13.327   1.721   0.478
  651    HB2  LYS  86           HB2      LYS  86 -13.292   3.738  -0.907
  652    HB3  LYS  86           HB1      LYS  86 -14.892   3.072  -0.711
  653    HG2  LYS  86           HG2      LYS  86 -15.051   4.771   1.248
  654    HG3  LYS  86           HG1      LYS  86 -13.738   5.550   0.374
  655    HD2  LYS  86           HD2      LYS  86 -15.215   5.395  -1.681
  656    HD3  LYS  86           HD1      LYS  86 -16.516   4.967  -0.569
  657    HE2  LYS  86           HE2      LYS  86 -16.161   7.074   0.634
  658    HE3  LYS  86           HE1      LYS  86 -14.896   7.507  -0.511
  659    HZ1  LYS  86           HZ1      LYS  86 -16.511   7.505  -2.278
  660    HZ2  LYS  86           HZ2      LYS  86 -17.019   8.545  -1.044
  661    HZ3  LYS  86           HZ3      LYS  86 -17.735   7.024  -1.214
  662    H    VAL  87           HN       VAL  87 -11.322   2.629  -0.025
  663    HA   VAL  87           HA       VAL  87 -10.210   4.309   2.119
  664    HB   VAL  87           HB       VAL  87  -9.677   2.073   2.754
  665   HG11  VAL  87          HG11      VAL  87 -10.053   1.000   0.595
  666   HG12  VAL  87          HG12      VAL  87  -8.507   0.510   1.298
  667   HG13  VAL  87          HG13      VAL  87  -8.544   1.691  -0.011
  668   HG21  VAL  87          HG21      VAL  87  -7.192   2.088   2.628
  669   HG22  VAL  87          HG22      VAL  87  -7.878   3.637   3.117
  670   HG23  VAL  87          HG23      VAL  87  -7.295   3.412   1.469
  671    H    ALA  88           HN       ALA  88  -8.952   5.892   1.438
  672    HA   ALA  88           HA       ALA  88  -8.351   6.064  -1.406
  673    HB1  ALA  88           HB1      ALA  88  -9.326   8.023  -0.318
  674    HB2  ALA  88           HB2      ALA  88  -7.712   8.366  -0.946
  675    HB3  ALA  88           HB3      ALA  88  -7.948   8.097   0.784
  676    H    ILE  89           HN       ILE  89  -6.534   5.230  -2.080
  677    HA   ILE  89           HA       ILE  89  -4.247   5.151  -0.234
  678    HB   ILE  89           HB       ILE  89  -4.684   3.420  -2.663
  679   HG12  ILE  89          HG12      ILE  89  -5.740   3.231   0.066
  680   HG13  ILE  89          HG11      ILE  89  -6.247   2.421  -1.402
  681   HG21  ILE  89          HG21      ILE  89  -2.960   2.024  -1.412
  682   HG22  ILE  89          HG22      ILE  89  -2.640   3.494  -0.487
  683   HG23  ILE  89          HG23      ILE  89  -2.407   3.481  -2.235
  684   HD11  ILE  89          HD11      ILE  89  -5.583   0.815   0.263
  685   HD12  ILE  89          HD12      ILE  89  -3.994   1.573   0.389
  686   HD13  ILE  89          HD13      ILE  89  -4.472   0.768  -1.106
  687    H    SER  90           HN       SER  90  -2.866   6.754  -0.632
  688    HA   SER  90           HA       SER  90  -2.636   7.968  -3.230
  689    HB2  SER  90           HB2      SER  90  -0.973   8.368  -0.729
  690    HB3  SER  90           HB1      SER  90  -0.969   9.408  -2.151
  691    HG   SER  90           HG       SER  90  -2.533  10.421  -1.207
  692    H    THR  91           HN       THR  91  -1.610   6.914  -4.792
  693    HA   THR  91           HA       THR  91   0.691   5.248  -4.098
  694    HB   THR  91           HB       THR  91   0.336   4.448  -6.546
  695    HG1  THR  91           HG1      THR  91  -1.929   4.660  -7.137
  696   HG21  THR  91          HG21      THR  91  -1.557   2.932  -5.787
  697   HG22  THR  91          HG22      THR  91  -1.525   3.826  -4.265
  698   HG23  THR  91          HG23      THR  91  -0.099   2.930  -4.786
  699    H    THR  92           HN       THR  92   2.371   5.113  -5.796
  700    HA   THR  92           HA       THR  92   2.859   7.237  -7.595
  701    HB   THR  92           HB       THR  92   3.334   8.559  -5.623
  702    HG1  THR  92           HG1      THR  92   5.967   7.964  -6.185
  703   HG21  THR  92          HG21      THR  92   3.657   6.646  -4.068
  704   HG22  THR  92          HG22      THR  92   4.879   7.911  -3.895
  705   HG23  THR  92          HG23      THR  92   5.270   6.418  -4.748
  706    HA   PRO  93           HA       PRO  93   5.364   4.035  -9.379
  707    HB2  PRO  93           HB2      PRO  93   7.444   6.112  -9.766
  708    HB3  PRO  93           HB1      PRO  93   6.761   4.989 -10.938
  709    HG2  PRO  93           HG2      PRO  93   6.034   7.555 -10.930
  710    HG3  PRO  93           HG1      PRO  93   4.850   6.276 -11.256
  711    HD2  PRO  93           HD2      PRO  93   5.239   7.925  -8.806
  712    HD3  PRO  93           HD1      PRO  93   3.747   7.254  -9.493
  713    H    LEU  94           HN       LEU  94   6.970   2.670  -8.889
  714    HA   LEU  94           HA       LEU  94   8.569   3.291  -6.504
  715    HB2  LEU  94           HB2      LEU  94   7.211   1.402  -6.041
  716    HB3  LEU  94           HB1      LEU  94   7.535   0.688  -7.609
  717    HG   LEU  94           HG       LEU  94   9.873   0.249  -6.916
  718   HD11  LEU  94          HD11      LEU  94   8.986   1.160  -4.183
  719   HD12  LEU  94          HD12      LEU  94  10.048   2.074  -5.256
  720   HD13  LEU  94          HD13      LEU  94  10.564   0.510  -4.626
  721   HD21  LEU  94          HD21      LEU  94   9.365  -1.578  -5.398
  722   HD22  LEU  94          HD22      LEU  94   8.133  -1.454  -6.654
  723   HD23  LEU  94          HD23      LEU  94   7.799  -0.856  -5.029
  724    H    GLU  95           HN       GLU  95  10.031   4.442  -7.821
  725    HA   GLU  95           HA       GLU  95  11.699   2.769  -9.565
  726    HB2  GLU  95           HB2      GLU  95  11.789   5.758  -9.389
  727    HB3  GLU  95           HB1      GLU  95  12.401   4.735 -10.669
  728    HG2  GLU  95           HG2      GLU  95   9.481   4.645 -10.139
  729    HG3  GLU  95           HG1      GLU  95  10.137   6.090 -10.909
  730    H    ASN  96           HN       ASN  96  13.504   2.112  -8.736
  731    HA   ASN  96           HA       ASN  96  14.867   3.732  -6.698
  732    HB2  ASN  96           HB2      ASN  96  13.672   1.750  -5.709
  733    HB3  ASN  96           HB1      ASN  96  14.711   0.712  -6.681
  734   HD21  ASN  96          HD21      ASN  96  16.007  -0.244  -5.287
  735   HD22  ASN  96          HD22      ASN  96  16.983   0.570  -4.101
  736    H2   PRO  97           HT1      PRO  97   5.567  -1.149 -11.506
  737    H3   PRO  97           HT2      PRO  97   5.147  -2.260 -12.620
  738    HA   PRO  97           HA       PRO  97   7.073  -3.058 -12.628
  739    HB2  PRO  97           HB2      PRO  97   8.640  -0.619 -13.109
  740    HB3  PRO  97           HB1      PRO  97   8.522  -2.097 -14.076
  741    HG2  PRO  97           HG2      PRO  97   7.349   0.197 -14.848
  742    HG3  PRO  97           HG1      PRO  97   6.628  -1.390 -15.176
  743    HD2  PRO  97           HD2      PRO  97   5.935   0.600 -13.038
  744    HD3  PRO  97           HD1      PRO  97   4.857  -0.365 -14.060
  745    H    PHE  98           HN       PHE  98   8.614  -3.575 -11.118
  746    HA   PHE  98           HA       PHE  98   8.941  -1.674  -8.897
  747    HB2  PHE  98           HB2      PHE  98   8.876  -3.456  -7.313
  748    HB3  PHE  98           HB1      PHE  98   7.490  -3.681  -8.371
  749    HD1  PHE  98           HD1      PHE  98   7.787  -5.344 -10.321
  750    HD2  PHE  98           HD2      PHE  98  10.333  -5.213  -6.916
  751    HE1  PHE  98           HE1      PHE  98   8.512  -7.649 -10.784
  752    HE2  PHE  98           HE2      PHE  98  11.062  -7.520  -7.368
  753    HZ   PHE  98           HZ       PHE  98  10.129  -8.756  -9.257
  754    H    ASP  99           HN       ASP  99  10.938  -2.337  -7.519
  755    HA   ASP  99           HA       ASP  99  13.166  -2.580  -9.388
  756    HB2  ASP  99           HB2      ASP  99  13.269  -0.699  -7.864
  757    HB3  ASP  99           HB1      ASP  99  13.072  -1.763  -6.476
  758    H    GLU 100           HN       GLU 100  12.962  -3.679  -6.013
  759    HA   GLU 100           HA       GLU 100  13.619  -6.385  -6.925
  760    HB2  GLU 100           HB2      GLU 100  15.161  -6.554  -4.921
  761    HB3  GLU 100           HB1      GLU 100  15.730  -5.553  -6.249
  762    HG2  GLU 100           HG2      GLU 100  15.173  -3.553  -5.068
  763    HG3  GLU 100           HG1      GLU 100  14.379  -4.473  -3.789
  764    H    ASP 101           HN       ASP 101  13.184  -8.047  -5.334
  765    HA   ASP 101           HA       ASP 101  11.101  -7.283  -3.400
  766    HB2  ASP 101           HB2      ASP 101   9.777  -8.278  -5.009
  767    HB3  ASP 101           HB1      ASP 101  11.059  -9.349  -5.555
  768    H    GLN 102           HN       GLN 102  11.519  -7.923  -1.404
  769    HA   GLN 102           HA       GLN 102  13.361 -10.189  -0.994
  770    HB2  GLN 102           HB2      GLN 102  13.093  -8.017   1.051
  771    HB3  GLN 102           HB1      GLN 102  14.434  -9.112   0.768
  772    HG2  GLN 102           HG2      GLN 102  15.276  -7.090   0.063
  773    HG3  GLN 102           HG1      GLN 102  14.722  -7.811  -1.447
  774   HE21  GLN 102          HE21      GLN 102  14.934  -5.385  -1.894
  775   HE22  GLN 102          HE22      GLN 102  13.471  -4.473  -1.703
  776    H    HIS 103           HN       HIS 103  13.074 -11.103   1.309
  777    HA   HIS 103           HA       HIS 103  10.208 -11.526   1.674
  778    HB2  HIS 103           HB2      HIS 103  12.019 -13.397   1.520
  779    HB3  HIS 103           HB1      HIS 103  12.336 -12.993   3.205
  780    HD2  HIS 103           HD2      HIS 103   9.748 -14.832   1.025
  781    HE1  HIS 103           HE1      HIS 103   8.486 -15.053   5.056
  782    HE2  HIS 103           HE2      HIS 103   8.230 -16.047   2.739
  783    H    THR 104           HN       THR 104   9.279 -10.098   2.951
  784    HA   THR 104           HA       THR 104  10.462  -9.622   5.583
  785    HB   THR 104           HB       THR 104   8.999  -7.334   4.401
  786    HG1  THR 104           HG1      THR 104  10.282  -7.225   2.728
  787   HG21  THR 104          HG21      THR 104   9.923  -7.239   6.658
  788   HG22  THR 104          HG22      THR 104  10.707  -6.061   5.607
  789   HG23  THR 104          HG23      THR 104  11.537  -7.560   6.020
  790    H    GLN 105           HN       GLN 105   7.565  -8.225   4.061
  791    HA   GLN 105           HA       GLN 105   5.914  -9.967   5.746
  792    HB2  GLN 105           HB2      GLN 105   5.978  -6.981   5.789
  793    HB3  GLN 105           HB1      GLN 105   4.451  -7.804   6.062
  794    HG2  GLN 105           HG2      GLN 105   5.081  -7.769   8.201
  795    HG3  GLN 105           HG1      GLN 105   6.058  -9.163   7.752
  796   HE21  GLN 105          HE21      GLN 105   7.586  -8.755   9.323
  797   HE22  GLN 105          HE22      GLN 105   8.705  -7.438   9.208
  798    H    ILE 106           HN       ILE 106   3.763 -10.213   5.077
  799    HA   ILE 106           HA       ILE 106   2.832  -9.062   2.601
  800    HB   ILE 106           HB       ILE 106   3.991 -10.765   1.490
  801   HG12  ILE 106          HG12      ILE 106   1.258 -11.897   2.122
  802   HG13  ILE 106          HG11      ILE 106   1.640 -10.757   0.836
  803   HG21  ILE 106          HG21      ILE 106   4.772 -11.971   3.453
  804   HG22  ILE 106          HG22      ILE 106   4.143 -13.083   2.237
  805   HG23  ILE 106          HG23      ILE 106   3.175 -12.692   3.658
  806   HD11  ILE 106          HD11      ILE 106   3.034 -12.474  -0.230
  807   HD12  ILE 106          HD12      ILE 106   1.353 -12.972  -0.058
  808   HD13  ILE 106          HD13      ILE 106   2.577 -13.610   1.039
  809    H    THR 107           HN       THR 107   0.715  -8.707   2.908
  810    HA   THR 107           HA       THR 107  -0.927 -10.682   4.243
  811    HB   THR 107           HB       THR 107  -0.472  -7.942   5.455
  812    HG1  THR 107           HG1      THR 107   0.706 -10.215   5.906
  813   HG21  THR 107          HG21      THR 107  -2.523 -10.029   6.228
  814   HG22  THR 107          HG22      THR 107  -2.868  -8.458   5.504
  815   HG23  THR 107          HG23      THR 107  -2.175  -8.550   7.123
  816    H    LYS 108           HN       LYS 108  -2.976 -10.640   3.635
  817    HA   LYS 108           HA       LYS 108  -3.747  -8.993   1.432
  818    HB2  LYS 108           HB2      LYS 108  -5.471 -10.790   3.153
  819    HB3  LYS 108           HB1      LYS 108  -5.848 -10.212   1.536
  820    HG2  LYS 108           HG2      LYS 108  -4.123 -11.546   0.576
  821    HG3  LYS 108           HG1      LYS 108  -3.499 -11.980   2.169
  822    HD2  LYS 108           HD2      LYS 108  -5.561 -13.181   2.663
  823    HD3  LYS 108           HD1      LYS 108  -6.220 -12.718   1.092
  824    HE2  LYS 108           HE2      LYS 108  -4.162 -13.861   0.099
  825    HE3  LYS 108           HE1      LYS 108  -3.931 -14.570   1.694
  826    HZ1  LYS 108           HZ1      LYS 108  -6.064 -15.619   1.540
  827    HZ2  LYS 108           HZ2      LYS 108  -5.187 -15.998   0.144
  828    HZ3  LYS 108           HZ3      LYS 108  -6.410 -14.838   0.083
  829    H    VAL 109           HN       VAL 109  -5.180  -7.241   1.437
  830    HA   VAL 109           HA       VAL 109  -5.421  -5.966   4.030
  831    HB   VAL 109           HB       VAL 109  -6.325  -4.034   2.662
  832   HG11  VAL 109          HG11      VAL 109  -3.968  -4.261   3.383
  833   HG12  VAL 109          HG12      VAL 109  -4.131  -3.411   1.846
  834   HG13  VAL 109          HG13      VAL 109  -3.611  -5.099   1.870
  835   HG21  VAL 109          HG21      VAL 109  -6.032  -4.086   0.266
  836   HG22  VAL 109          HG22      VAL 109  -7.082  -5.420   0.741
  837   HG23  VAL 109          HG23      VAL 109  -5.393  -5.727   0.344
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1   3.627  20.170  -1.216
    2    H2   GLY   1           HT2      GLY   1   3.215  21.113  -2.560
    3    H3   GLY   1           HT3      GLY   1   3.154  19.428  -2.660
    4    HA2  GLY   1           HA1      GLY   1   1.442  21.093  -0.903
    5    HA3  GLY   1           HA2      GLY   1   0.942  20.411  -2.443
    6    H    GLY   2           HN       GLY   2  -0.170  19.947   0.215
    7    HA2  GLY   2           HA2      GLY   2   0.617  17.212   0.847
    8    HA3  GLY   2           HA1      GLY   2  -0.536  18.197   1.733
    9    H    SER   3           HN       SER   3  -2.670  18.415   0.923
   10    HA   SER   3           HA       SER   3  -3.675  16.012  -0.234
   11    HB2  SER   3           HB2      SER   3  -5.244  18.565   0.086
   12    HB3  SER   3           HB1      SER   3  -5.822  16.900   0.185
   13    HG   SER   3           HG       SER   3  -4.137  16.907   2.050
   14    H    MET   4           HN       MET   4  -3.167  15.657  -2.328
   15    HA   MET   4           HA       MET   4  -3.970  17.730  -4.256
   16    HB2  MET   4           HB2      MET   4  -1.475  17.575  -4.007
   17    HB3  MET   4           HB1      MET   4  -1.575  15.919  -4.589
   18    HG2  MET   4           HG2      MET   4  -0.915  17.434  -6.362
   19    HG3  MET   4           HG1      MET   4  -2.479  16.700  -6.704
   20    HE1  MET   4           HE1      MET   4  -2.416  18.569  -8.590
   21    HE2  MET   4           HE2      MET   4  -1.139  19.629  -7.988
   22    HE3  MET   4           HE3      MET   4  -2.751  20.275  -8.294
   23    H    ARG   5           HN       ARG   5  -3.112  14.285  -3.944
   24    HA   ARG   5           HA       ARG   5  -4.838  13.638  -6.191
   25    HB2  ARG   5           HB2      ARG   5  -2.866  12.104  -4.550
   26    HB3  ARG   5           HB1      ARG   5  -4.046  11.243  -5.522
   27    HG2  ARG   5           HG2      ARG   5  -2.088  11.385  -6.820
   28    HG3  ARG   5           HG1      ARG   5  -3.206  12.570  -7.495
   29    HD2  ARG   5           HD2      ARG   5  -2.043  14.374  -6.528
   30    HD3  ARG   5           HD1      ARG   5  -1.142  13.312  -5.445
   31    HE   ARG   5           HE       ARG   5  -0.667  12.852  -8.256
   32   HH11  ARG   5          HH11      ARG   5   0.323  14.580  -5.383
   33   HH12  ARG   5          HH12      ARG   5   1.927  14.887  -5.960
   34   HH21  ARG   5          HH21      ARG   5   1.445  13.234  -9.024
   35   HH22  ARG   5          HH22      ARG   5   2.565  14.130  -8.046
   36    HA   PRO   6           HA       PRO   6  -8.302  12.818  -3.525
   37    HB2  PRO   6           HB2      PRO   6  -9.833  11.508  -5.358
   38    HB3  PRO   6           HB1      PRO   6  -9.641  13.259  -5.337
   39    HG2  PRO   6           HG2      PRO   6  -8.231  11.218  -6.994
   40    HG3  PRO   6           HG1      PRO   6  -8.956  12.756  -7.470
   41    HD2  PRO   6           HD2      PRO   6  -6.313  12.511  -7.081
   42    HD3  PRO   6           HD1      PRO   6  -7.176  14.001  -6.650
   43    HA   PRO   7           HA       PRO   7  -7.183   8.725  -2.157
   44    HB2  PRO   7           HB2      PRO   7  -9.636   8.812  -0.550
   45    HB3  PRO   7           HB1      PRO   7  -7.956   8.686  -0.023
   46    HG2  PRO   7           HG2      PRO   7  -9.408  10.917   0.335
   47    HG3  PRO   7           HG1      PRO   7  -7.663  10.969   0.016
   48    HD2  PRO   7           HD2      PRO   7  -9.950  11.485  -1.847
   49    HD3  PRO   7           HD1      PRO   7  -8.389  12.321  -1.714
   50    H    ILE   8           HN       ILE   8  -7.861   6.627  -2.296
   51    HA   ILE   8           HA       ILE   8 -10.014   6.093  -4.178
   52    HB   ILE   8           HB       ILE   8  -7.951   4.216  -3.029
   53   HG12  ILE   8          HG12      ILE   8  -7.137   6.203  -4.474
   54   HG13  ILE   8          HG11      ILE   8  -6.578   4.588  -4.874
   55   HG21  ILE   8          HG21      ILE   8  -9.389   3.750  -5.593
   56   HG22  ILE   8          HG22      ILE   8 -10.205   3.407  -4.068
   57   HG23  ILE   8          HG23      ILE   8  -8.692   2.589  -4.458
   58   HD11  ILE   8          HD11      ILE   8  -8.169   4.439  -6.674
   59   HD12  ILE   8          HD12      ILE   8  -7.184   5.893  -6.850
   60   HD13  ILE   8          HD13      ILE   8  -8.836   6.014  -6.242
   61    H    ILE   9           HN       ILE   9 -11.854   6.307  -2.844
   62    HA   ILE   9           HA       ILE   9 -12.049   5.075  -0.297
   63    HB   ILE   9           HB       ILE   9 -14.126   6.206  -2.160
   64   HG12  ILE   9          HG12      ILE   9 -14.277   8.005  -0.698
   65   HG13  ILE   9          HG11      ILE   9 -13.450   7.169   0.593
   66   HG21  ILE   9          HG21      ILE   9 -14.485   4.720   0.392
   67   HG22  ILE   9          HG22      ILE   9 -15.443   4.660  -1.088
   68   HG23  ILE   9          HG23      ILE   9 -15.577   6.049  -0.006
   69   HD11  ILE   9          HD11      ILE   9 -11.355   7.402  -0.608
   70   HD12  ILE   9          HD12      ILE   9 -12.119   8.972  -0.364
   71   HD13  ILE   9          HD13      ILE   9 -12.199   8.187  -1.942
   72    H    ILE  10           HN       ILE  10 -11.598   2.930  -0.380
   73    HA   ILE  10           HA       ILE  10 -13.058   1.198  -2.202
   74    HB   ILE  10           HB       ILE  10 -11.006   0.462  -0.116
   75   HG12  ILE  10          HG12      ILE  10 -10.521   0.719  -3.068
   76   HG13  ILE  10          HG11      ILE  10 -10.297   2.082  -1.984
   77   HG21  ILE  10          HG21      ILE  10 -12.326  -1.422  -0.758
   78   HG22  ILE  10          HG22      ILE  10 -10.762  -1.555  -1.568
   79   HG23  ILE  10          HG23      ILE  10 -12.180  -1.008  -2.467
   80   HD11  ILE  10          HD11      ILE  10  -8.646   0.788  -0.728
   81   HD12  ILE  10          HD12      ILE  10  -8.201   0.969  -2.427
   82   HD13  ILE  10          HD13      ILE  10  -8.865  -0.558  -1.848
   83    H    HIS  11           HN       HIS  11 -14.731   0.015  -1.622
   84    HA   HIS  11           HA       HIS  11 -15.737   0.236   1.090
   85    HB2  HIS  11           HB2      HIS  11 -16.853  -0.821  -1.503
   86    HB3  HIS  11           HB1      HIS  11 -17.683  -1.055   0.033
   87    HD2  HIS  11           HD2      HIS  11 -16.301   2.319   0.332
   88    HE1  HIS  11           HE1      HIS  11 -19.990   2.840  -1.670
   89    HE2  HIS  11           HE2      HIS  11 -18.196   3.982  -0.286
   90    H    ARG  12           HN       ARG  12 -16.328  -1.630   2.340
   91    HA   ARG  12           HA       ARG  12 -14.405  -3.710   2.257
   92    HB2  ARG  12           HB2      ARG  12 -15.694  -4.615   4.159
   93    HB3  ARG  12           HB1      ARG  12 -15.338  -2.907   4.347
   94    HG2  ARG  12           HG2      ARG  12 -17.555  -2.282   3.846
   95    HG3  ARG  12           HG1      ARG  12 -17.949  -3.895   3.248
   96    HD2  ARG  12           HD2      ARG  12 -17.520  -4.759   5.526
   97    HD3  ARG  12           HD1      ARG  12 -17.339  -3.106   6.084
   98    HE   ARG  12           HE       ARG  12 -19.812  -3.402   4.750
   99   HH11  ARG  12          HH11      ARG  12 -18.190  -4.250   7.738
  100   HH12  ARG  12          HH12      ARG  12 -19.659  -4.362   8.656
  101   HH21  ARG  12          HH21      ARG  12 -21.755  -3.549   5.955
  102   HH22  ARG  12          HH22      ARG  12 -21.694  -3.965   7.639
  103    H    ALA  13           HN       ALA  13 -14.758  -5.935   1.907
  104    HA   ALA  13           HA       ALA  13 -17.150  -6.583   0.312
  105    HB1  ALA  13           HB1      ALA  13 -15.549  -8.293  -0.795
  106    HB2  ALA  13           HB2      ALA  13 -14.268  -7.261  -0.158
  107    HB3  ALA  13           HB3      ALA  13 -15.458  -6.602  -1.281
  108    H    GLY  14           HN       GLY  14 -14.621  -7.816   2.452
  109    HA2  GLY  14           HA2      GLY  14 -16.021  -9.152   4.283
  110    HA3  GLY  14           HA1      GLY  14 -16.105 -10.271   2.928
  111    H    LYS  15           HN       LYS  15 -13.970 -10.844   1.932
  112    HA   LYS  15           HA       LYS  15 -12.139 -11.551   4.066
  113    HB2  LYS  15           HB2      LYS  15 -12.419 -12.348   1.183
  114    HB3  LYS  15           HB1      LYS  15 -10.940 -12.697   2.061
  115    HG2  LYS  15           HG2      LYS  15 -13.543 -13.506   3.243
  116    HG3  LYS  15           HG1      LYS  15 -12.852 -14.456   1.930
  117    HD2  LYS  15           HD2      LYS  15 -10.843 -14.832   3.182
  118    HD3  LYS  15           HD1      LYS  15 -11.392 -13.759   4.469
  119    HE2  LYS  15           HE2      LYS  15 -13.118 -15.263   5.096
  120    HE3  LYS  15           HE1      LYS  15 -12.886 -16.235   3.645
  121    HZ1  LYS  15           HZ1      LYS  15 -10.876 -15.935   5.812
  122    HZ2  LYS  15           HZ2      LYS  15 -10.762 -16.952   4.467
  123    HZ3  LYS  15           HZ3      LYS  15 -11.933 -17.247   5.653
  124    H    LYS  16           HN       LYS  16 -12.177  -9.586   1.154
  125    HA   LYS  16           HA       LYS  16  -9.824  -8.146   2.121
  126    HB2  LYS  16           HB2      LYS  16 -10.118  -9.384  -0.622
  127    HB3  LYS  16           HB1      LYS  16  -8.981  -8.087  -0.287
  128    HG2  LYS  16           HG2      LYS  16  -7.731  -9.465   1.200
  129    HG3  LYS  16           HG1      LYS  16  -8.967 -10.723   1.160
  130    HD2  LYS  16           HD2      LYS  16  -7.385 -11.562  -0.305
  131    HD3  LYS  16           HD1      LYS  16  -8.499 -10.745  -1.397
  132    HE2  LYS  16           HE2      LYS  16  -7.007  -8.778  -1.404
  133    HE3  LYS  16           HE1      LYS  16  -5.877  -9.647  -0.359
  134    HZ1  LYS  16           HZ1      LYS  16  -5.068  -9.919  -2.524
  135    HZ2  LYS  16           HZ2      LYS  16  -6.597 -10.247  -3.178
  136    HZ3  LYS  16           HZ3      LYS  16  -5.840 -11.385  -2.182
  137    H    TYR  17           HN       TYR  17  -9.540  -6.076   0.975
  138    HA   TYR  17           HA       TYR  17 -12.104  -4.813   0.430
  139    HB2  TYR  17           HB2      TYR  17  -9.265  -3.768   0.553
  140    HB3  TYR  17           HB1      TYR  17 -10.614  -2.765   0.042
  141    HD1  TYR  17           HD1      TYR  17 -12.285  -2.006   1.662
  142    HD2  TYR  17           HD2      TYR  17  -8.990  -4.411   2.841
  143    HE1  TYR  17           HE1      TYR  17 -12.701  -1.411   4.014
  144    HE2  TYR  17           HE2      TYR  17  -9.385  -3.852   5.181
  145    HH   TYR  17           HH       TYR  17 -10.510  -1.847   6.434
  146    H    GLY  18           HN       GLY  18 -10.006  -6.646  -1.220
  147    HA2  GLY  18           HA2      GLY  18 -10.505  -7.128  -3.534
  148    HA3  GLY  18           HA1      GLY  18 -10.757  -5.409  -3.768
  149    H    PHE  19           HN       PHE  19  -8.101  -5.948  -1.782
  150    HA   PHE  19           HA       PHE  19  -6.289  -6.258  -4.018
  151    HB2  PHE  19           HB2      PHE  19  -5.112  -4.240  -3.786
  152    HB3  PHE  19           HB1      PHE  19  -6.801  -3.826  -3.863
  153    HD1  PHE  19           HD1      PHE  19  -7.996  -3.153  -1.748
  154    HD2  PHE  19           HD2      PHE  19  -3.773  -3.652  -1.953
  155    HE1  PHE  19           HE1      PHE  19  -7.737  -1.812   0.303
  156    HE2  PHE  19           HE2      PHE  19  -3.509  -2.321   0.099
  157    HZ   PHE  19           HZ       PHE  19  -5.493  -1.400   1.227
  158    H    THR  20           HN       THR  20  -4.087  -6.185  -3.477
  159    HA   THR  20           HA       THR  20  -3.523  -7.480  -0.882
  160    HB   THR  20           HB       THR  20  -2.245  -7.887  -3.591
  161    HG1  THR  20           HG1      THR  20  -3.014 -10.034  -3.280
  162   HG21  THR  20          HG21      THR  20  -1.436  -9.189  -0.980
  163   HG22  THR  20          HG22      THR  20  -0.532  -7.896  -1.771
  164   HG23  THR  20          HG23      THR  20  -0.714  -9.459  -2.568
  165    H    LEU  21           HN       LEU  21  -2.209  -6.375   0.411
  166    HA   LEU  21           HA       LEU  21  -0.701  -4.151  -0.737
  167    HB2  LEU  21           HB2      LEU  21  -2.233  -3.735   1.177
  168    HB3  LEU  21           HB1      LEU  21  -1.260  -4.813   2.155
  169    HG   LEU  21           HG       LEU  21   0.624  -3.304   2.053
  170   HD11  LEU  21          HD11      LEU  21   0.440  -2.449  -0.180
  171   HD12  LEU  21          HD12      LEU  21   0.376  -1.089   0.941
  172   HD13  LEU  21          HD13      LEU  21  -1.106  -1.683   0.193
  173   HD21  LEU  21          HD21      LEU  21  -1.965  -1.902   2.687
  174   HD22  LEU  21          HD22      LEU  21  -0.367  -1.340   3.174
  175   HD23  LEU  21          HD23      LEU  21  -0.988  -2.871   3.791
  176    H    ARG  22           HN       ARG  22   1.415  -4.351  -1.059
  177    HA   ARG  22           HA       ARG  22   2.837  -6.409   0.485
  178    HB2  ARG  22           HB2      ARG  22   3.122  -5.749  -2.441
  179    HB3  ARG  22           HB1      ARG  22   4.299  -6.694  -1.556
  180    HG2  ARG  22           HG2      ARG  22   2.175  -8.141  -0.942
  181    HG3  ARG  22           HG1      ARG  22   1.551  -7.399  -2.407
  182    HD2  ARG  22           HD2      ARG  22   2.623  -9.558  -2.865
  183    HD3  ARG  22           HD1      ARG  22   3.417  -8.227  -3.696
  184    HE   ARG  22           HE       ARG  22   4.483  -9.428  -1.222
  185   HH11  ARG  22          HH11      ARG  22   4.951  -8.149  -4.450
  186   HH12  ARG  22          HH12      ARG  22   6.661  -8.466  -4.474
  187   HH21  ARG  22          HH21      ARG  22   6.709  -9.902  -1.268
  188   HH22  ARG  22          HH22      ARG  22   7.655  -9.506  -2.672
  189    H    ALA  23           HN       ALA  23   4.385  -5.625   1.671
  190    HA   ALA  23           HA       ALA  23   5.256  -2.887   1.373
  191    HB1  ALA  23           HB1      ALA  23   4.814  -3.910   3.593
  192    HB2  ALA  23           HB2      ALA  23   6.445  -3.250   3.448
  193    HB3  ALA  23           HB3      ALA  23   6.183  -4.991   3.331
  194    H    ILE  24           HN       ILE  24   6.604  -2.576  -0.299
  195    HA   ILE  24           HA       ILE  24   8.624  -4.556  -0.934
  196    HB   ILE  24           HB       ILE  24   9.220  -2.997  -2.813
  197   HG12  ILE  24          HG12      ILE  24   6.628  -1.582  -2.223
  198   HG13  ILE  24          HG11      ILE  24   8.156  -0.974  -1.584
  199   HG21  ILE  24          HG21      ILE  24   7.619  -4.936  -2.940
  200   HG22  ILE  24          HG22      ILE  24   7.406  -3.691  -4.170
  201   HG23  ILE  24          HG23      ILE  24   6.310  -3.761  -2.790
  202   HD11  ILE  24          HD11      ILE  24   7.511  -1.405  -4.493
  203   HD12  ILE  24          HD12      ILE  24   9.015  -0.746  -3.846
  204   HD13  ILE  24          HD13      ILE  24   7.505   0.146  -3.654
  205    H    ARG  25           HN       ARG  25  10.656  -4.480  -0.341
  206    HA   ARG  25           HA       ARG  25  11.576  -2.147   1.173
  207    HB2  ARG  25           HB2      ARG  25  11.581  -4.266   2.367
  208    HB3  ARG  25           HB1      ARG  25  12.562  -5.001   1.112
  209    HG2  ARG  25           HG2      ARG  25  14.409  -3.490   1.688
  210    HG3  ARG  25           HG1      ARG  25  13.418  -2.796   2.977
  211    HD2  ARG  25           HD2      ARG  25  13.252  -5.002   4.029
  212    HD3  ARG  25           HD1      ARG  25  14.244  -5.692   2.748
  213    HE   ARG  25           HE       ARG  25  16.109  -4.417   3.588
  214   HH11  ARG  25          HH11      ARG  25  13.287  -4.509   5.680
  215   HH12  ARG  25          HH12      ARG  25  14.184  -4.120   7.112
  216   HH21  ARG  25          HH21      ARG  25  17.284  -3.902   5.479
  217   HH22  ARG  25          HH22      ARG  25  16.451  -3.771   6.998
  218    H    VAL  26           HN       VAL  26  12.676  -0.762  -0.011
  219    HA   VAL  26           HA       VAL  26  14.537  -1.757  -2.072
  220    HB   VAL  26           HB       VAL  26  13.466   1.066  -1.796
  221   HG11  VAL  26          HG11      VAL  26  14.717  -0.363  -4.134
  222   HG12  VAL  26          HG12      VAL  26  15.501   0.848  -3.120
  223   HG13  VAL  26          HG13      VAL  26  14.127   1.298  -4.130
  224   HG21  VAL  26          HG21      VAL  26  11.867   0.539  -3.581
  225   HG22  VAL  26          HG22      VAL  26  11.564  -0.408  -2.122
  226   HG23  VAL  26          HG23      VAL  26  12.360  -1.153  -3.510
  227    H    TYR  27           HN       TYR  27  16.597  -0.314  -2.178
  228    HA   TYR  27           HA       TYR  27  17.250   0.569   0.535
  229    HB2  TYR  27           HB2      TYR  27  18.827  -1.022  -1.427
  230    HB3  TYR  27           HB1      TYR  27  19.653  -0.022  -0.255
  231    HD1  TYR  27           HD1      TYR  27  19.285  -0.428   2.191
  232    HD2  TYR  27           HD2      TYR  27  17.840  -3.088  -0.798
  233    HE1  TYR  27           HE1      TYR  27  18.982  -2.171   3.899
  234    HE2  TYR  27           HE2      TYR  27  17.536  -4.840   0.899
  235    HH   TYR  27           HH       TYR  27  18.818  -5.199   3.434
  236    H    MET  28           HN       MET  28  18.477   2.363   0.800
  237    HA   MET  28           HA       MET  28  18.210   4.342  -1.248
  238    HB2  MET  28           HB2      MET  28  19.337   4.361   1.547
  239    HB3  MET  28           HB1      MET  28  19.327   5.770   0.515
  240    HG2  MET  28           HG2      MET  28  16.887   4.248   1.367
  241    HG3  MET  28           HG1      MET  28  17.483   5.722   2.123
  242    HE1  MET  28           HE1      MET  28  18.197   7.783   0.329
  243    HE2  MET  28           HE2      MET  28  16.795   8.102   1.348
  244    HE3  MET  28           HE3      MET  28  16.744   8.496  -0.370
  245    H    GLY  29           HN       GLY  29  19.632   4.520  -2.840
  246    HA2  GLY  29           HA2      GLY  29  22.204   3.297  -2.783
  247    HA3  GLY  29           HA1      GLY  29  21.582   4.346  -4.046
  248    H    ASP  30           HN       ASP  30  22.898   4.410  -0.774
  249    HA   ASP  30           HA       ASP  30  24.925   6.252  -1.304
  250    HB2  ASP  30           HB2      ASP  30  24.166   8.327  -0.605
  251    HB3  ASP  30           HB1      ASP  30  22.737   7.715  -1.428
  252    H    SER  31           HN       SER  31  22.663   4.867   0.961
  253    HA   SER  31           HA       SER  31  24.849   4.529   2.885
  254    HB2  SER  31           HB2      SER  31  21.994   5.303   3.546
  255    HB3  SER  31           HB1      SER  31  23.250   4.939   4.723
  256    HG   SER  31           HG       SER  31  23.175   7.104   2.877
  257    H    ASP  32           HN       ASP  32  23.466   3.022   4.760
  258    HA   ASP  32           HA       ASP  32  23.022   0.550   3.248
  259    HB2  ASP  32           HB2      ASP  32  23.267  -0.562   5.426
  260    HB3  ASP  32           HB1      ASP  32  24.656   0.460   5.078
  261    H    VAL  33           HN       VAL  33  21.365   2.987   4.739
  262    HA   VAL  33           HA       VAL  33  19.196   1.739   5.957
  263    HB   VAL  33           HB       VAL  33  19.709   4.086   6.291
  264   HG11  VAL  33          HG11      VAL  33  20.251   4.391   3.775
  265   HG12  VAL  33          HG12      VAL  33  19.585   5.742   4.690
  266   HG13  VAL  33          HG13      VAL  33  18.540   4.787   3.639
  267   HG21  VAL  33          HG21      VAL  33  17.414   3.257   6.677
  268   HG22  VAL  33          HG22      VAL  33  16.982   3.825   5.066
  269   HG23  VAL  33          HG23      VAL  33  17.494   4.976   6.300
  270    H    TYR  34           HN       TYR  34  17.104   1.412   5.294
  271    HA   TYR  34           HA       TYR  34  16.817   0.798   2.432
  272    HB2  TYR  34           HB2      TYR  34  15.063  -0.792   3.119
  273    HB3  TYR  34           HB1      TYR  34  16.619  -1.165   3.841
  274    HD1  TYR  34           HD1      TYR  34  17.012  -0.563   6.269
  275    HD2  TYR  34           HD2      TYR  34  13.166  -0.343   4.459
  276    HE1  TYR  34           HE1      TYR  34  15.967  -0.546   8.495
  277    HE2  TYR  34           HE2      TYR  34  12.117  -0.320   6.681
  278    HH   TYR  34           HH       TYR  34  13.696   0.359   9.453
  279    H    THR  35           HN       THR  35  14.631   0.875   1.634
  280    HA   THR  35           HA       THR  35  13.035   3.062   2.777
  281    HB   THR  35           HB       THR  35  13.068   2.766  -0.180
  282    HG1  THR  35           HG1      THR  35  15.042   4.465   0.608
  283   HG21  THR  35          HG21      THR  35  11.708   4.442   1.112
  284   HG22  THR  35          HG22      THR  35  12.750   5.136  -0.130
  285   HG23  THR  35          HG23      THR  35  13.224   5.221   1.567
  286    H    VAL  36           HN       VAL  36  11.382   1.853   3.555
  287    HA   VAL  36           HA       VAL  36  10.289  -0.303   1.939
  288    HB   VAL  36           HB       VAL  36  10.537  -0.837   4.266
  289   HG11  VAL  36          HG11      VAL  36   9.146   0.432   5.980
  290   HG12  VAL  36          HG12      VAL  36   9.024   1.706   4.766
  291   HG13  VAL  36          HG13      VAL  36  10.605   1.221   5.380
  292   HG21  VAL  36          HG21      VAL  36   8.211  -1.393   4.895
  293   HG22  VAL  36          HG22      VAL  36   8.599  -1.813   3.227
  294   HG23  VAL  36          HG23      VAL  36   7.640  -0.372   3.575
  295    H    HIS  37           HN       HIS  37   8.712   0.031   0.554
  296    HA   HIS  37           HA       HIS  37   6.987   2.385   0.929
  297    HB2  HIS  37           HB2      HIS  37   7.634   0.870  -1.603
  298    HB3  HIS  37           HB1      HIS  37   6.552   2.239  -1.494
  299    HD2  HIS  37           HD2      HIS  37  10.377   1.469  -1.327
  300    HE1  HIS  37           HE1      HIS  37   9.789   5.614  -1.918
  301    HE2  HIS  37           HE2      HIS  37  11.467   3.724  -2.009
  302    H    HIS  38           HN       HIS  38   4.793   2.162   0.739
  303    HA   HIS  38           HA       HIS  38   3.782  -0.583   0.982
  304    HB2  HIS  38           HB2      HIS  38   2.478   2.030   1.796
  305    HB3  HIS  38           HB1      HIS  38   1.790   0.427   2.036
  306    HD2  HIS  38           HD2      HIS  38   3.858   2.940   3.891
  307    HE1  HIS  38           HE1      HIS  38   4.638  -0.796   5.709
  308    HE2  HIS  38           HE2      HIS  38   5.059   1.696   5.822
  309    H    MET  39           HN       MET  39   3.453  -1.218  -1.061
  310    HA   MET  39           HA       MET  39   1.760   0.509  -2.738
  311    HB2  MET  39           HB2      MET  39   3.809   0.465  -3.856
  312    HB3  MET  39           HB1      MET  39   4.119  -1.212  -3.432
  313    HG2  MET  39           HG2      MET  39   1.741  -0.876  -5.074
  314    HG3  MET  39           HG1      MET  39   3.206  -0.286  -5.855
  315    HE1  MET  39           HE1      MET  39   5.257  -3.318  -6.627
  316    HE2  MET  39           HE2      MET  39   5.496  -1.828  -5.710
  317    HE3  MET  39           HE3      MET  39   4.641  -1.789  -7.258
  318    H    VAL  40           HN       VAL  40  -0.001  -0.333  -3.650
  319    HA   VAL  40           HA       VAL  40  -0.994  -2.858  -2.786
  320    HB   VAL  40           HB       VAL  40  -2.741  -1.388  -3.210
  321   HG11  VAL  40          HG11      VAL  40  -2.882   0.022  -5.272
  322   HG12  VAL  40          HG12      VAL  40  -1.245  -0.505  -5.664
  323   HG13  VAL  40          HG13      VAL  40  -1.547   0.415  -4.190
  324   HG21  VAL  40          HG21      VAL  40  -3.494  -3.298  -4.290
  325   HG22  VAL  40          HG22      VAL  40  -2.362  -3.109  -5.627
  326   HG23  VAL  40          HG23      VAL  40  -3.757  -2.029  -5.494
  327    H    TRP  41           HN       TRP  41  -0.363  -4.742  -3.600
  328    HA   TRP  41           HA       TRP  41   1.352  -4.815  -5.909
  329    HB2  TRP  41           HB2      TRP  41   1.826  -6.146  -3.899
  330    HB3  TRP  41           HB1      TRP  41   0.341  -7.061  -4.164
  331    HD1  TRP  41           HD1      TRP  41   0.551  -9.171  -5.628
  332    HE1  TRP  41           HE1      TRP  41   2.395 -10.184  -7.121
  333    HE3  TRP  41           HE3      TRP  41   3.883  -5.302  -5.533
  334    HZ2  TRP  41           HZ2      TRP  41   4.925  -9.429  -8.121
  335    HZ3  TRP  41           HZ3      TRP  41   5.986  -5.525  -6.781
  336    HH2  TRP  41           HH2      TRP  41   6.497  -7.545  -8.050
  337    H    HIS  42           HN       HIS  42  -1.886  -5.977  -5.123
  338    HA   HIS  42           HA       HIS  42  -2.410  -6.270  -7.976
  339    HB2  HIS  42           HB2      HIS  42  -1.517  -8.482  -7.083
  340    HB3  HIS  42           HB1      HIS  42  -2.937  -8.560  -6.053
  341    HD2  HIS  42           HD2      HIS  42  -1.924  -9.044  -9.759
  342    HE1  HIS  42           HE1      HIS  42  -5.974 -10.163  -9.282
  343    HE2  HIS  42           HE2      HIS  42  -3.935 -10.323 -10.774
  344    H    VAL  43           HN       VAL  43  -4.550  -6.123  -8.498
  345    HA   VAL  43           HA       VAL  43  -6.421  -5.541  -6.300
  346    HB   VAL  43           HB       VAL  43  -6.598  -4.359  -9.077
  347   HG11  VAL  43          HG11      VAL  43  -8.689  -4.472  -7.817
  348   HG12  VAL  43          HG12      VAL  43  -8.160  -2.803  -8.026
  349   HG13  VAL  43          HG13      VAL  43  -7.935  -3.611  -6.475
  350   HG21  VAL  43          HG21      VAL  43  -5.293  -3.229  -6.610
  351   HG22  VAL  43          HG22      VAL  43  -5.847  -2.223  -7.950
  352   HG23  VAL  43          HG23      VAL  43  -4.596  -3.438  -8.218
  353    H    GLU  44           HN       GLU  44  -7.967  -7.018  -6.175
  354    HA   GLU  44           HA       GLU  44  -8.332  -9.136  -7.899
  355    HB2  GLU  44           HB2      GLU  44 -10.324  -7.899  -5.999
  356    HB3  GLU  44           HB1      GLU  44 -10.331  -9.531  -6.598
  357    HG2  GLU  44           HG2      GLU  44  -8.216  -8.359  -4.833
  358    HG3  GLU  44           HG1      GLU  44  -9.532  -9.399  -4.297
  359    H    ASP  45           HN       ASP  45  -9.261  -9.247  -9.843
  360    HA   ASP  45           HA       ASP  45 -10.468  -7.041 -11.098
  361    HB2  ASP  45           HB2      ASP  45 -10.031  -9.887 -11.768
  362    HB3  ASP  45           HB1      ASP  45 -11.392  -9.122 -12.582
  363    H    GLY  46           HN       GLY  46 -12.400  -6.206 -10.796
  364    HA2  GLY  46           HA2      GLY  46 -14.718  -6.171 -10.565
  365    HA3  GLY  46           HA1      GLY  46 -14.694  -7.915 -10.336
  366    H    GLY  47           HN       GLY  47 -12.428  -6.246  -8.440
  367    HA2  GLY  47           HA2      GLY  47 -13.994  -6.827  -6.052
  368    HA3  GLY  47           HA1      GLY  47 -12.287  -6.409  -6.107
  369    HA   PRO  48           HA       PRO  48 -15.157  -2.767  -4.794
  370    HB2  PRO  48           HB2      PRO  48 -13.319  -3.071  -2.472
  371    HB3  PRO  48           HB1      PRO  48 -15.032  -2.637  -2.481
  372    HG2  PRO  48           HG2      PRO  48 -14.355  -5.028  -1.738
  373    HG3  PRO  48           HG1      PRO  48 -15.642  -4.846  -2.937
  374    HD2  PRO  48           HD2      PRO  48 -12.769  -5.513  -3.402
  375    HD3  PRO  48           HD1      PRO  48 -14.214  -6.321  -4.011
  376    H    ALA  49           HN       ALA  49 -11.769  -3.349  -4.080
  377    HA   ALA  49           HA       ALA  49 -10.905  -0.695  -4.204
  378    HB1  ALA  49           HB1      ALA  49  -9.331  -3.196  -4.841
  379    HB2  ALA  49           HB2      ALA  49  -9.502  -2.443  -3.256
  380    HB3  ALA  49           HB3      ALA  49  -8.633  -1.604  -4.540
  381    H    SER  50           HN       SER  50 -11.289  -3.065  -6.768
  382    HA   SER  50           HA       SER  50 -10.047  -1.566  -8.820
  383    HB2  SER  50           HB2      SER  50 -10.979  -4.082  -8.678
  384    HB3  SER  50           HB1      SER  50 -12.358  -3.323  -9.472
  385    HG   SER  50           HG       SER  50 -11.027  -3.929 -11.108
  386    H    GLU  51           HN       GLU  51 -13.264  -1.729  -7.484
  387    HA   GLU  51           HA       GLU  51 -14.487  -0.039  -9.443
  388    HB2  GLU  51           HB2      GLU  51 -15.460  -0.712  -6.663
  389    HB3  GLU  51           HB1      GLU  51 -16.435  -0.092  -7.992
  390    HG2  GLU  51           HG2      GLU  51 -15.849  -2.187  -9.248
  391    HG3  GLU  51           HG1      GLU  51 -15.142  -2.793  -7.753
  392    H    ALA  52           HN       ALA  52 -12.821   0.409  -6.471
  393    HA   ALA  52           HA       ALA  52 -13.660   3.114  -6.038
  394    HB1  ALA  52           HB1      ALA  52 -11.248   1.789  -4.845
  395    HB2  ALA  52           HB2      ALA  52 -12.886   1.450  -4.289
  396    HB3  ALA  52           HB3      ALA  52 -12.237   3.086  -4.171
  397    H    GLY  53           HN       GLY  53 -11.184   1.525  -7.853
  398    HA2  GLY  53           HA2      GLY  53 -10.181   2.764  -9.668
  399    HA3  GLY  53           HA1      GLY  53 -10.146   4.155  -8.609
  400    H    LEU  54           HN       LEU  54  -9.226   1.441  -6.881
  401    HA   LEU  54           HA       LEU  54  -6.544   2.368  -6.623
  402    HB2  LEU  54           HB2      LEU  54  -8.204   0.651  -5.225
  403    HB3  LEU  54           HB1      LEU  54  -6.969  -0.408  -5.848
  404    HG   LEU  54           HG       LEU  54  -6.768   1.761  -3.817
  405   HD11  LEU  54          HD11      LEU  54  -6.919  -0.642  -3.226
  406   HD12  LEU  54          HD12      LEU  54  -5.435   0.134  -2.658
  407   HD13  LEU  54          HD13      LEU  54  -5.398  -0.909  -4.081
  408   HD21  LEU  54          HD21      LEU  54  -5.141   2.632  -5.237
  409   HD22  LEU  54          HD22      LEU  54  -4.625   1.037  -5.782
  410   HD23  LEU  54          HD23      LEU  54  -4.229   1.586  -4.153
  411    H    ARG  55           HN       ARG  55  -4.787   1.800  -7.683
  412    HA   ARG  55           HA       ARG  55  -4.987  -0.349  -9.672
  413    HB2  ARG  55           HB2      ARG  55  -3.214   2.082  -9.872
  414    HB3  ARG  55           HB1      ARG  55  -3.584   0.911 -11.136
  415    HG2  ARG  55           HG2      ARG  55  -5.650   2.676  -9.854
  416    HG3  ARG  55           HG1      ARG  55  -4.771   3.108 -11.315
  417    HD2  ARG  55           HD2      ARG  55  -5.699   1.260 -12.508
  418    HD3  ARG  55           HD1      ARG  55  -6.361   0.567 -11.031
  419    HE   ARG  55           HE       ARG  55  -7.332   3.189 -11.888
  420   HH11  ARG  55          HH11      ARG  55  -7.914  -0.245 -11.513
  421   HH12  ARG  55          HH12      ARG  55  -9.634  -0.103 -11.700
  422   HH21  ARG  55          HH21      ARG  55  -9.607   3.378 -12.116
  423   HH22  ARG  55          HH22      ARG  55 -10.590   1.948 -12.070
  424    H    GLN  56           HN       GLN  56  -3.558  -1.928  -9.563
  425    HA   GLN  56           HA       GLN  56  -1.770  -2.048  -7.358
  426    HB2  GLN  56           HB2      GLN  56  -1.060  -4.240  -8.553
  427    HB3  GLN  56           HB1      GLN  56  -2.657  -4.117  -7.842
  428    HG2  GLN  56           HG2      GLN  56  -3.659  -3.722  -9.934
  429    HG3  GLN  56           HG1      GLN  56  -2.093  -3.540 -10.666
  430   HE21  GLN  56          HE21      GLN  56  -0.823  -5.362 -11.088
  431   HE22  GLN  56          HE22      GLN  56  -1.517  -6.945 -11.129
  432    H    GLY  57           HN       GLY  57   0.261  -1.456  -7.228
  433    HA2  GLY  57           HA2      GLY  57   2.493  -1.456  -8.134
  434    HA3  GLY  57           HA1      GLY  57   1.813  -1.133  -9.712
  435    H    ASP  58           HN       ASP  58   0.236   0.709  -7.380
  436    HA   ASP  58           HA       ASP  58   1.696   3.100  -8.199
  437    HB2  ASP  58           HB2      ASP  58  -0.794   2.788  -6.505
  438    HB3  ASP  58           HB1      ASP  58  -0.082   4.326  -6.956
  439    H    LEU  59           HN       LEU  59   0.931   4.507  -5.743
  440    HA   LEU  59           HA       LEU  59   2.548   3.213  -3.738
  441    HB2  LEU  59           HB2      LEU  59   3.174   5.746  -5.126
  442    HB3  LEU  59           HB1      LEU  59   3.355   5.760  -3.382
  443    HG   LEU  59           HG       LEU  59   4.752   3.917  -5.308
  444   HD11  LEU  59          HD11      LEU  59   5.609   6.197  -5.339
  445   HD12  LEU  59          HD12      LEU  59   6.765   5.106  -4.576
  446   HD13  LEU  59          HD13      LEU  59   5.771   6.170  -3.584
  447   HD21  LEU  59          HD21      LEU  59   4.759   4.045  -2.301
  448   HD22  LEU  59          HD22      LEU  59   6.055   3.291  -3.228
  449   HD23  LEU  59          HD23      LEU  59   4.414   2.656  -3.334
  450    H    ILE  60           HN       ILE  60   1.281   3.119  -2.025
  451    HA   ILE  60           HA       ILE  60  -0.879   4.982  -1.676
  452    HB   ILE  60           HB       ILE  60   0.135   2.755   0.107
  453   HG12  ILE  60          HG12      ILE  60  -2.450   2.835  -1.450
  454   HG13  ILE  60          HG11      ILE  60  -0.955   2.237  -2.162
  455   HG21  ILE  60          HG21      ILE  60  -0.903   4.315   1.546
  456   HG22  ILE  60          HG22      ILE  60  -2.098   3.050   1.253
  457   HG23  ILE  60          HG23      ILE  60  -2.221   4.596   0.412
  458   HD11  ILE  60          HD11      ILE  60  -0.814   0.515  -0.471
  459   HD12  ILE  60          HD12      ILE  60  -2.366   0.440  -1.307
  460   HD13  ILE  60          HD13      ILE  60  -2.266   1.138   0.311
  461    H    THR  61           HN       THR  61  -0.421   6.983  -0.973
  462    HA   THR  61           HA       THR  61   1.923   7.413   0.684
  463    HB   THR  61           HB       THR  61   1.715   8.965  -1.105
  464    HG1  THR  61           HG1      THR  61   0.816  10.469   1.122
  465   HG21  THR  61          HG21      THR  61  -0.183  10.422  -1.453
  466   HG22  THR  61          HG22      THR  61  -1.000   9.748  -0.045
  467   HG23  THR  61          HG23      THR  61  -0.725   8.744  -1.469
  468    H    HIS  62           HN       HIS  62  -1.597   7.587   0.998
  469    HA   HIS  62           HA       HIS  62  -1.222   7.753   3.890
  470    HB2  HIS  62           HB2      HIS  62  -3.100   9.632   2.437
  471    HB3  HIS  62           HB1      HIS  62  -2.950   9.474   4.174
  472    HD2  HIS  62           HD2      HIS  62  -0.758  10.715   5.328
  473    HE1  HIS  62           HE1      HIS  62   0.427  12.699   1.787
  474    HE2  HIS  62           HE2      HIS  62   0.641  12.648   4.307
  475    H    VAL  63           HN       VAL  63  -2.871   6.859   5.079
  476    HA   VAL  63           HA       VAL  63  -5.000   5.524   3.536
  477    HB   VAL  63           HB       VAL  63  -3.498   4.452   5.934
  478   HG11  VAL  63          HG11      VAL  63  -5.977   4.002   5.936
  479   HG12  VAL  63          HG12      VAL  63  -4.949   2.568   5.929
  480   HG13  VAL  63          HG13      VAL  63  -5.736   3.097   4.442
  481   HG21  VAL  63          HG21      VAL  63  -2.326   4.223   3.778
  482   HG22  VAL  63          HG22      VAL  63  -3.728   3.373   3.126
  483   HG23  VAL  63          HG23      VAL  63  -2.803   2.662   4.449
  484    H    ASN  64           HN       ASN  64  -6.889   6.381   4.052
  485    HA   ASN  64           HA       ASN  64  -8.598   7.325   5.204
  486    HB2  ASN  64           HB2      ASN  64  -7.186   5.978   7.509
  487    HB3  ASN  64           HB1      ASN  64  -8.713   6.833   7.696
  488   HD21  ASN  64          HD21      ASN  64  -7.780   3.943   7.837
  489   HD22  ASN  64          HD22      ASN  64  -8.949   3.097   6.895
  490    H    GLY  65           HN       GLY  65  -6.111   8.757   4.696
  491    HA2  GLY  65           HA2      GLY  65  -5.498  10.968   4.960
  492    HA3  GLY  65           HA1      GLY  65  -6.700  11.109   6.234
  493    H    GLU  66           HN       GLU  66  -4.412   8.527   6.500
  494    HA   GLU  66           HA       GLU  66  -3.042  10.047   8.618
  495    HB2  GLU  66           HB2      GLU  66  -3.232   7.055   8.382
  496    HB3  GLU  66           HB1      GLU  66  -2.713   7.986   9.780
  497    HG2  GLU  66           HG2      GLU  66  -5.476   8.259   8.688
  498    HG3  GLU  66           HG1      GLU  66  -5.057   6.936   9.760
  499    HA   PRO  67           HA       PRO  67   0.659   9.593   6.197
  500    HB2  PRO  67           HB2      PRO  67   2.187   9.933   8.666
  501    HB3  PRO  67           HB1      PRO  67   2.080  11.004   7.269
  502    HG2  PRO  67           HG2      PRO  67   0.982  11.616   9.666
  503    HG3  PRO  67           HG1      PRO  67   0.297  12.160   8.129
  504    HD2  PRO  67           HD2      PRO  67  -0.573   9.933   9.900
  505    HD3  PRO  67           HD1      PRO  67  -1.553  11.089   8.982
  506    H    VAL  68           HN       VAL  68   1.207   7.614   5.556
  507    HA   VAL  68           HA       VAL  68   1.741   5.557   7.569
  508    HB   VAL  68           HB       VAL  68   1.568   3.930   5.785
  509   HG11  VAL  68          HG11      VAL  68  -0.783   4.142   5.307
  510   HG12  VAL  68          HG12      VAL  68  -0.729   5.876   5.629
  511   HG13  VAL  68          HG13      VAL  68  -0.472   4.726   6.942
  512   HG21  VAL  68          HG21      VAL  68   0.951   4.569   3.506
  513   HG22  VAL  68          HG22      VAL  68   2.514   5.247   3.961
  514   HG23  VAL  68          HG23      VAL  68   1.079   6.273   3.948
  515    H    HIS  69           HN       HIS  69   3.373   7.768   5.747
  516    HA   HIS  69           HA       HIS  69   5.634   6.244   4.931
  517    HB2  HIS  69           HB2      HIS  69   4.830   8.540   4.068
  518    HB3  HIS  69           HB1      HIS  69   5.649   9.206   5.473
  519    HD2  HIS  69           HD2      HIS  69   7.323   6.322   3.460
  520    HE1  HIS  69           HE1      HIS  69   9.406   9.931   2.728
  521    HE2  HIS  69           HE2      HIS  69   9.275   7.459   2.186
  522    H    GLY  70           HN       GLY  70   6.265   5.057   6.747
  523    HA2  GLY  70           HA2      GLY  70   8.364   5.603   8.187
  524    HA3  GLY  70           HA1      GLY  70   7.201   6.575   9.072
  525    H    LEU  71           HN       LEU  71   5.069   4.466   8.489
  526    HA   LEU  71           HA       LEU  71   5.558   2.948  10.875
  527    HB2  LEU  71           HB2      LEU  71   3.405   2.291   8.907
  528    HB3  LEU  71           HB1      LEU  71   3.415   2.073  10.642
  529    HG   LEU  71           HG       LEU  71   3.296   4.743   9.318
  530   HD11  LEU  71          HD11      LEU  71   1.304   3.995   8.624
  531   HD12  LEU  71          HD12      LEU  71   0.838   4.423  10.271
  532   HD13  LEU  71          HD13      LEU  71   1.221   2.747   9.865
  533   HD21  LEU  71          HD21      LEU  71   2.345   5.370  11.576
  534   HD22  LEU  71          HD22      LEU  71   4.062   4.962  11.558
  535   HD23  LEU  71          HD23      LEU  71   2.882   3.785  12.136
  536    H    VAL  72           HN       VAL  72   4.502   0.571  10.432
  537    HA   VAL  72           HA       VAL  72   6.474  -0.811   8.765
  538    HB   VAL  72           HB       VAL  72   5.937  -2.794  10.090
  539   HG11  VAL  72          HG11      VAL  72   6.723  -2.015  12.312
  540   HG12  VAL  72          HG12      VAL  72   6.504  -0.354  11.763
  541   HG13  VAL  72          HG13      VAL  72   7.684  -1.397  10.968
  542   HG21  VAL  72          HG21      VAL  72   3.685  -1.093  10.959
  543   HG22  VAL  72          HG22      VAL  72   4.449  -2.062  12.233
  544   HG23  VAL  72          HG23      VAL  72   3.794  -2.853  10.798
  545    H    HIS  73           HN       HIS  73   5.330  -3.111   8.135
  546    HA   HIS  73           HA       HIS  73   3.445  -2.435   6.148
  547    HB2  HIS  73           HB2      HIS  73   5.016  -4.323   5.955
  548    HB3  HIS  73           HB1      HIS  73   4.152  -5.161   7.238
  549    HD1  HIS  73           HD1      HIS  73   3.010  -3.533   3.957
  550    HD2  HIS  73           HD2      HIS  73   2.602  -7.029   6.164
  551    HE1  HIS  73           HE1      HIS  73   1.484  -5.041   2.623
  552    H    THR  74           HN       THR  74   3.082  -4.105   9.273
  553    HA   THR  74           HA       THR  74   0.308  -4.626   8.948
  554    HB   THR  74           HB       THR  74   0.465  -4.841  11.538
  555    HG1  THR  74           HG1      THR  74   2.371  -4.390  12.342
  556   HG21  THR  74          HG21      THR  74   0.316  -6.741  10.050
  557   HG22  THR  74          HG22      THR  74   1.547  -7.056  11.273
  558   HG23  THR  74          HG23      THR  74   2.024  -6.592   9.639
  559    H    GLU  75           HN       GLU  75   2.060  -1.857  10.295
  560    HA   GLU  75           HA       GLU  75  -0.005  -0.715  11.739
  561    HB2  GLU  75           HB2      GLU  75   2.328   0.560  10.309
  562    HB3  GLU  75           HB1      GLU  75   1.160   1.453  11.219
  563    HG2  GLU  75           HG2      GLU  75   2.547  -0.843  12.455
  564    HG3  GLU  75           HG1      GLU  75   3.265   0.771  12.442
  565    H    VAL  76           HN       VAL  76   0.811  -0.424   8.338
  566    HA   VAL  76           HA       VAL  76  -1.341   1.403   7.816
  567    HB   VAL  76           HB       VAL  76  -0.730   1.281   5.500
  568   HG11  VAL  76          HG11      VAL  76   0.721   2.599   6.909
  569   HG12  VAL  76          HG12      VAL  76   1.676   1.820   5.646
  570   HG13  VAL  76          HG13      VAL  76   1.694   1.180   7.290
  571   HG21  VAL  76          HG21      VAL  76   0.928  -0.276   4.630
  572   HG22  VAL  76          HG22      VAL  76  -0.447  -1.153   5.306
  573   HG23  VAL  76          HG23      VAL  76   1.062  -1.041   6.213
  574    H    VAL  77           HN       VAL  77  -0.836  -2.064   7.616
  575    HA   VAL  77           HA       VAL  77  -3.132  -2.791   6.174
  576    HB   VAL  77           HB       VAL  77  -1.450  -4.215   8.226
  577   HG11  VAL  77          HG11      VAL  77  -3.830  -4.984   8.414
  578   HG12  VAL  77          HG12      VAL  77  -2.665  -6.232   7.972
  579   HG13  VAL  77          HG13      VAL  77  -3.714  -5.527   6.739
  580   HG21  VAL  77          HG21      VAL  77  -0.846  -5.612   6.293
  581   HG22  VAL  77          HG22      VAL  77  -0.489  -3.906   6.018
  582   HG23  VAL  77          HG23      VAL  77  -1.909  -4.639   5.275
  583    H    GLU  78           HN       GLU  78  -2.581  -2.527   9.658
  584    HA   GLU  78           HA       GLU  78  -5.177  -3.042  10.527
  585    HB2  GLU  78           HB2      GLU  78  -3.194  -1.175  11.723
  586    HB3  GLU  78           HB1      GLU  78  -4.563  -1.865  12.557
  587    HG2  GLU  78           HG2      GLU  78  -3.612  -4.069  12.186
  588    HG3  GLU  78           HG1      GLU  78  -2.196  -3.339  11.466
  589    H    LEU  79           HN       LEU  79  -3.548  -0.042   9.923
  590    HA   LEU  79           HA       LEU  79  -5.465   1.837  10.360
  591    HB2  LEU  79           HB2      LEU  79  -3.045   1.760   9.000
  592    HB3  LEU  79           HB1      LEU  79  -4.185   2.336   7.801
  593    HG   LEU  79           HG       LEU  79  -4.892   4.082   9.509
  594   HD11  LEU  79          HD11      LEU  79  -3.899   2.951  11.464
  595   HD12  LEU  79          HD12      LEU  79  -3.321   4.606  11.271
  596   HD13  LEU  79          HD13      LEU  79  -2.295   3.251  10.797
  597   HD21  LEU  79          HD21      LEU  79  -2.475   3.907   7.880
  598   HD22  LEU  79          HD22      LEU  79  -2.416   5.155   9.129
  599   HD23  LEU  79          HD23      LEU  79  -3.720   5.159   7.939
  600    H    ILE  80           HN       ILE  80  -5.012   0.215   7.187
  601    HA   ILE  80           HA       ILE  80  -7.268   1.105   5.902
  602    HB   ILE  80           HB       ILE  80  -5.949  -1.602   5.802
  603   HG12  ILE  80          HG12      ILE  80  -5.587   0.552   3.787
  604   HG13  ILE  80          HG11      ILE  80  -4.749   0.682   5.317
  605   HG21  ILE  80          HG21      ILE  80  -7.888  -0.326   3.891
  606   HG22  ILE  80          HG22      ILE  80  -8.123  -1.791   4.849
  607   HG23  ILE  80          HG23      ILE  80  -6.936  -1.771   3.542
  608   HD11  ILE  80          HD11      ILE  80  -3.563  -1.276   4.970
  609   HD12  ILE  80          HD12      ILE  80  -3.483  -0.395   3.441
  610   HD13  ILE  80          HD13      ILE  80  -4.584  -1.766   3.617
  611    H    LEU  81           HN       LEU  81  -6.922  -1.896   7.764
  612    HA   LEU  81           HA       LEU  81  -9.540  -2.789   7.647
  613    HB2  LEU  81           HB2      LEU  81  -7.378  -3.104   9.696
  614    HB3  LEU  81           HB1      LEU  81  -8.949  -3.836   9.946
  615    HG   LEU  81           HG       LEU  81  -7.231  -4.360   7.524
  616   HD11  LEU  81          HD11      LEU  81  -6.069  -5.129   9.510
  617   HD12  LEU  81          HD12      LEU  81  -6.684  -6.499   8.587
  618   HD13  LEU  81          HD13      LEU  81  -7.518  -5.978  10.050
  619   HD21  LEU  81          HD21      LEU  81  -9.598  -4.776   7.171
  620   HD22  LEU  81          HD22      LEU  81  -9.662  -5.761   8.633
  621   HD23  LEU  81          HD23      LEU  81  -8.711  -6.298   7.248
  622    H    LYS  82           HN       LYS  82  -8.133  -0.519  10.001
  623    HA   LYS  82           HA       LYS  82 -10.400  -0.303  11.638
  624    HB2  LYS  82           HB2      LYS  82  -8.130   1.626  11.248
  625    HB3  LYS  82           HB1      LYS  82  -9.287   1.665  12.578
  626    HG2  LYS  82           HG2      LYS  82  -8.570  -0.666  13.117
  627    HG3  LYS  82           HG1      LYS  82  -7.296  -0.465  11.940
  628    HD2  LYS  82           HD2      LYS  82  -7.566   1.618  14.042
  629    HD3  LYS  82           HD1      LYS  82  -6.912   0.051  14.519
  630    HE2  LYS  82           HE2      LYS  82  -5.262   0.260  12.652
  631    HE3  LYS  82           HE1      LYS  82  -5.842   1.905  12.403
  632    HZ1  LYS  82           HZ1      LYS  82  -3.801   1.612  13.841
  633    HZ2  LYS  82           HZ2      LYS  82  -4.830   0.982  15.024
  634    HZ3  LYS  82           HZ3      LYS  82  -5.039   2.568  14.479
  635    H    SER  83           HN       SER  83 -10.113   0.808   8.507
  636    HA   SER  83           HA       SER  83 -11.138   3.363   8.483
  637    HB2  SER  83           HB2      SER  83 -12.063   2.754   6.235
  638    HB3  SER  83           HB1      SER  83 -10.364   2.343   6.464
  639    HG   SER  83           HG       SER  83 -10.828   0.285   6.356
  640    H    GLY  84           HN       GLY  84 -13.139   0.432   8.007
  641    HA2  GLY  84           HA2      GLY  84 -15.158   0.061   9.255
  642    HA3  GLY  84           HA1      GLY  84 -15.303   1.800   9.465
  643    H    ASN  85           HN       ASN  85 -15.711  -0.876   7.284
  644    HA   ASN  85           HA       ASN  85 -17.169  -1.259   5.603
  645    HB2  ASN  85           HB2      ASN  85 -19.079  -0.268   6.296
  646    HB3  ASN  85           HB1      ASN  85 -18.269   1.235   6.718
  647   HD21  ASN  85          HD21      ASN  85 -19.680  -0.606   4.082
  648   HD22  ASN  85          HD22      ASN  85 -19.941   0.744   3.039
  649    H    LYS  86           HN       LYS  86 -15.468   1.828   5.470
  650    HA   LYS  86           HA       LYS  86 -14.598   1.162   2.809
  651    HB2  LYS  86           HB2      LYS  86 -15.047   3.430   1.977
  652    HB3  LYS  86           HB1      LYS  86 -16.488   2.503   2.303
  653    HG2  LYS  86           HG2      LYS  86 -16.458   3.662   4.595
  654    HG3  LYS  86           HG1      LYS  86 -15.349   4.779   3.807
  655    HD2  LYS  86           HD2      LYS  86 -17.233   4.790   1.965
  656    HD3  LYS  86           HD1      LYS  86 -18.231   4.312   3.339
  657    HE2  LYS  86           HE2      LYS  86 -17.511   6.279   4.571
  658    HE3  LYS  86           HE1      LYS  86 -16.459   6.748   3.235
  659    HZ1  LYS  86           HZ1      LYS  86 -18.429   6.957   1.835
  660    HZ2  LYS  86           HZ2      LYS  86 -18.506   7.989   3.168
  661    HZ3  LYS  86           HZ3      LYS  86 -19.418   6.564   3.148
  662    H    VAL  87           HN       VAL  87 -12.770   2.168   2.204
  663    HA   VAL  87           HA       VAL  87 -11.379   3.676   4.312
  664    HB   VAL  87           HB       VAL  87 -10.624   1.416   4.522
  665   HG11  VAL  87          HG11      VAL  87 -11.297   0.633   2.301
  666   HG12  VAL  87          HG12      VAL  87  -9.640   0.161   2.694
  667   HG13  VAL  87          HG13      VAL  87  -9.934   1.504   1.589
  668   HG21  VAL  87          HG21      VAL  87  -8.631   3.204   3.144
  669   HG22  VAL  87          HG22      VAL  87  -8.188   1.673   3.896
  670   HG23  VAL  87          HG23      VAL  87  -8.866   2.973   4.877
  671    H    ALA  88           HN       ALA  88 -10.309   5.404   3.642
  672    HA   ALA  88           HA       ALA  88 -10.275   5.976   0.780
  673    HB1  ALA  88           HB1      ALA  88 -11.191   7.696   2.239
  674    HB2  ALA  88           HB2      ALA  88  -9.723   8.261   1.439
  675    HB3  ALA  88           HB3      ALA  88  -9.667   7.760   3.130
  676    H    ILE  89           HN       ILE  89  -8.537   5.392  -0.285
  677    HA   ILE  89           HA       ILE  89  -5.952   5.393   1.121
  678    HB   ILE  89           HB       ILE  89  -6.587   3.864  -1.391
  679   HG12  ILE  89          HG12      ILE  89  -7.293   3.289   1.407
  680   HG13  ILE  89          HG11      ILE  89  -7.927   2.615  -0.081
  681   HG21  ILE  89          HG21      ILE  89  -4.628   2.521  -0.524
  682   HG22  ILE  89          HG22      ILE  89  -4.342   3.861   0.589
  683   HG23  ILE  89          HG23      ILE  89  -4.278   4.130  -1.153
  684   HD11  ILE  89          HD11      ILE  89  -6.950   0.869   1.235
  685   HD12  ILE  89          HD12      ILE  89  -5.429   1.758   1.344
  686   HD13  ILE  89          HD13      ILE  89  -5.972   1.128  -0.210
  687    H    SER  90           HN       SER  90  -4.803   7.136   0.662
  688    HA   SER  90           HA       SER  90  -5.166   8.619  -1.768
  689    HB2  SER  90           HB2      SER  90  -2.929   8.996   0.220
  690    HB3  SER  90           HB1      SER  90  -3.693  10.203  -0.814
  691    HG   SER  90           HG       SER  90  -4.868  10.590   0.891
  692    H    THR  91           HN       THR  91  -4.224   8.138  -3.638
  693    HA   THR  91           HA       THR  91  -1.860   6.403  -3.609
  694    HB   THR  91           HB       THR  91  -2.662   6.228  -6.156
  695    HG1  THR  91           HG1      THR  91  -5.180   6.309  -4.921
  696   HG21  THR  91          HG21      THR  91  -2.395   4.302  -4.750
  697   HG22  THR  91          HG22      THR  91  -4.010   4.228  -5.468
  698   HG23  THR  91          HG23      THR  91  -3.809   4.746  -3.792
  699    H    THR  92           HN       THR  92  -0.292   6.698  -5.281
  700    HA   THR  92           HA       THR  92  -0.133   9.122  -6.789
  701    HB   THR  92           HB       THR  92   0.600  10.092  -4.702
  702    HG1  THR  92           HG1      THR  92   2.952   9.443  -6.183
  703   HG21  THR  92          HG21      THR  92   1.102   8.021  -3.501
  704   HG22  THR  92          HG22      THR  92   2.428   9.182  -3.369
  705   HG23  THR  92          HG23      THR  92   2.561   7.811  -4.472
  706    HA   PRO  93           HA       PRO  93   2.168   6.440  -9.470
  707    HB2  PRO  93           HB2      PRO  93   4.168   8.641  -9.620
  708    HB3  PRO  93           HB1      PRO  93   3.411   7.731 -10.927
  709    HG2  PRO  93           HG2      PRO  93   2.595  10.197 -10.370
  710    HG3  PRO  93           HG1      PRO  93   1.419   8.934 -10.785
  711    HD2  PRO  93           HD2      PRO  93   2.060  10.130  -8.130
  712    HD3  PRO  93           HD1      PRO  93   0.510   9.535  -8.755
  713    H    LEU  94           HN       LEU  94   3.928   5.113  -9.548
  714    HA   LEU  94           HA       LEU  94   5.763   5.250  -7.256
  715    HB2  LEU  94           HB2      LEU  94   4.491   3.244  -7.074
  716    HB3  LEU  94           HB1      LEU  94   4.655   2.902  -8.787
  717    HG   LEU  94           HG       LEU  94   7.093   2.486  -8.426
  718   HD11  LEU  94          HD11      LEU  94   6.392   2.612  -5.502
  719   HD12  LEU  94          HD12      LEU  94   7.337   3.817  -6.376
  720   HD13  LEU  94          HD13      LEU  94   7.949   2.174  -6.203
  721   HD21  LEU  94          HD21      LEU  94   6.812   0.294  -7.496
  722   HD22  LEU  94          HD22      LEU  94   5.396   0.682  -8.475
  723   HD23  LEU  94          HD23      LEU  94   5.304   0.771  -6.716
  724    H    GLU  95           HN       GLU  95   6.990   6.765  -8.550
  725    HA   GLU  95           HA       GLU  95   8.502   5.484 -10.714
  726    HB2  GLU  95           HB2      GLU  95   8.463   8.409 -10.029
  727    HB3  GLU  95           HB1      GLU  95   9.085   7.671 -11.490
  728    HG2  GLU  95           HG2      GLU  95   6.175   7.511 -10.750
  729    HG3  GLU  95           HG1      GLU  95   6.850   8.864 -11.661
  730    H    ASN  96           HN       ASN  96  10.463   4.848 -10.261
  731    HA   ASN  96           HA       ASN  96  12.064   6.276  -8.276
  732    HB2  ASN  96           HB2      ASN  96  10.949   4.343  -7.126
  733    HB3  ASN  96           HB1      ASN  96  11.778   3.265  -8.242
  734   HD21  ASN  96          HD21      ASN  96  13.946   2.864  -7.985
  735   HD22  ASN  96          HD22      ASN  96  14.846   3.382  -6.599
  736    H2   PRO  97           HT1      PRO  97  10.143  -8.099  -8.327
  737    H3   PRO  97           HT2      PRO  97  11.314  -8.849  -9.194
  738    HA   PRO  97           HA       PRO  97  11.408  -7.369 -10.743
  739    HB2  PRO  97           HB2      PRO  97   8.865  -6.049 -10.731
  740    HB3  PRO  97           HB1      PRO  97   9.581  -7.039 -12.013
  741    HG2  PRO  97           HG2      PRO  97   7.683  -7.805  -9.879
  742    HG3  PRO  97           HG1      PRO  97   7.934  -8.527 -11.477
  743    HD2  PRO  97           HD2      PRO  97   8.746  -9.796  -9.276
  744    HD3  PRO  97           HD1      PRO  97   9.734  -9.825 -10.747
  745    H    PHE  98           HN       PHE  98  12.768  -6.272  -9.418
  746    HA   PHE  98           HA       PHE  98  13.569  -4.820  -7.885
  747    HB2  PHE  98           HB2      PHE  98  12.928  -2.483  -8.266
  748    HB3  PHE  98           HB1      PHE  98  13.219  -3.344  -9.765
  749    HD1  PHE  98           HD2      PHE  98  10.710  -1.694  -7.672
  750    HD2  PHE  98           HD1      PHE  98  11.427  -3.740 -11.337
  751    HE1  PHE  98           HE2      PHE  98   8.552  -0.890  -8.538
  752    HE2  PHE  98           HE1      PHE  98   9.275  -2.931 -12.210
  753    HZ   PHE  98           HZ       PHE  98   7.836  -1.507 -10.811
  754    H    ASP  99           HN       ASP  99  11.534  -6.470  -6.792
  755    HA   ASP  99           HA       ASP  99  10.614  -4.698  -4.634
  756    HB2  ASP  99           HB2      ASP  99   8.535  -5.930  -4.451
  757    HB3  ASP  99           HB1      ASP  99   8.708  -5.334  -6.094
  758    H    GLU 100           HN       GLU 100  11.443  -7.994  -5.595
  759    HA   GLU 100           HA       GLU 100  11.718  -8.847  -2.843
  760    HB2  GLU 100           HB2      GLU 100  12.519 -10.368  -5.325
  761    HB3  GLU 100           HB1      GLU 100  12.163 -11.024  -3.736
  762    HG2  GLU 100           HG2      GLU 100  10.025  -9.522  -5.142
  763    HG3  GLU 100           HG1      GLU 100  10.427 -11.141  -5.710
  764    H    ASP 101           HN       ASP 101  13.383  -6.936  -2.715
  765    HA   ASP 101           HA       ASP 101  15.991  -7.460  -3.788
  766    HB2  ASP 101           HB2      ASP 101  15.102  -5.172  -3.133
  767    HB3  ASP 101           HB1      ASP 101  15.355  -5.647  -1.456
  768    H    GLN 102           HN       GLN 102  15.177  -7.085  -0.356
  769    HA   GLN 102           HA       GLN 102  16.821  -9.466   0.202
  770    HB2  GLN 102           HB2      GLN 102  16.534  -6.901   1.760
  771    HB3  GLN 102           HB1      GLN 102  17.205  -8.363   2.468
  772    HG2  GLN 102           HG2      GLN 102  18.294  -6.802   0.138
  773    HG3  GLN 102           HG1      GLN 102  18.994  -6.945   1.749
  774   HE21  GLN 102          HE21      GLN 102  20.104  -7.606  -0.885
  775   HE22  GLN 102          HE22      GLN 102  20.560  -9.273  -0.798
  776    H    HIS 103           HN       HIS 103  14.109  -7.514   1.371
  777    HA   HIS 103           HA       HIS 103  12.761  -9.953   2.192
  778    HB2  HIS 103           HB2      HIS 103  14.086  -8.862   4.147
  779    HB3  HIS 103           HB1      HIS 103  12.827  -7.634   4.109
  780    HD2  HIS 103           HD2      HIS 103  10.437  -8.338   5.243
  781    HE1  HIS 103           HE1      HIS 103  11.552 -12.313   6.178
  782    HE2  HIS 103           HE2      HIS 103   9.858 -10.475   6.599
  783    H    THR 104           HN       THR 104  10.542  -9.789   2.154
  784    HA   THR 104           HA       THR 104   9.318  -7.211   1.581
  785    HB   THR 104           HB       THR 104   8.182  -9.105  -0.243
  786    HG1  THR 104           HG1      THR 104   9.961  -9.555  -1.547
  787   HG21  THR 104          HG21      THR 104   8.090  -6.646  -0.416
  788   HG22  THR 104          HG22      THR 104   8.697  -7.400  -1.891
  789   HG23  THR 104          HG23      THR 104   9.819  -6.622  -0.773
  790    H    GLN 105           HN       GLN 105   7.149  -7.140   2.194
  791    HA   GLN 105           HA       GLN 105   6.149  -9.619   3.438
  792    HB2  GLN 105           HB2      GLN 105   6.806  -7.593   4.934
  793    HB3  GLN 105           HB1      GLN 105   5.291  -6.900   4.368
  794    HG2  GLN 105           HG2      GLN 105   5.106  -8.066   6.537
  795    HG3  GLN 105           HG1      GLN 105   4.042  -8.719   5.292
  796   HE21  GLN 105          HE21      GLN 105   6.783  -9.302   7.307
  797   HE22  GLN 105          HE22      GLN 105   6.953 -10.985   6.950
  798    H    ILE 106           HN       ILE 106   3.984 -10.146   3.180
  799    HA   ILE 106           HA       ILE 106   2.413  -8.425   1.399
  800    HB   ILE 106           HB       ILE 106   3.219  -9.968  -0.158
  801   HG12  ILE 106          HG12      ILE 106   0.570 -11.040   0.840
  802   HG13  ILE 106          HG11      ILE 106   0.798  -9.726  -0.307
  803   HG21  ILE 106          HG21      ILE 106   2.684 -12.183   1.811
  804   HG22  ILE 106          HG22      ILE 106   4.263 -11.519   1.396
  805   HG23  ILE 106          HG23      ILE 106   3.322 -12.380   0.179
  806   HD11  ILE 106          HD11      ILE 106   0.144 -11.746  -1.443
  807   HD12  ILE 106          HD12      ILE 106   1.508 -12.614  -0.741
  808   HD13  ILE 106          HD13      ILE 106   1.791 -11.308  -1.891
  809    H    THR 107           HN       THR 107   0.399  -8.141   2.061
  810    HA   THR 107           HA       THR 107  -0.901 -10.191   3.686
  811    HB   THR 107           HB       THR 107  -0.845  -7.281   4.521
  812    HG1  THR 107           HG1      THR 107   1.117  -7.985   5.102
  813   HG21  THR 107          HG21      THR 107  -2.885  -8.494   5.165
  814   HG22  THR 107          HG22      THR 107  -1.902  -8.093   6.572
  815   HG23  THR 107          HG23      THR 107  -1.901  -9.738   5.935
  816    H    LYS 108           HN       LYS 108  -2.919 -10.505   3.180
  817    HA   LYS 108           HA       LYS 108  -4.129  -8.884   1.107
  818    HB2  LYS 108           HB2      LYS 108  -4.921 -11.448   2.498
  819    HB3  LYS 108           HB1      LYS 108  -5.961 -10.647   1.329
  820    HG2  LYS 108           HG2      LYS 108  -4.934 -11.919  -0.187
  821    HG3  LYS 108           HG1      LYS 108  -3.588 -10.793  -0.021
  822    HD2  LYS 108           HD2      LYS 108  -2.675 -12.965   0.207
  823    HD3  LYS 108           HD1      LYS 108  -2.736 -12.282   1.833
  824    HE2  LYS 108           HE2      LYS 108  -4.723 -13.536   2.344
  825    HE3  LYS 108           HE1      LYS 108  -4.842 -14.099   0.678
  826    HZ1  LYS 108           HZ1      LYS 108  -3.886 -15.725   2.281
  827    HZ2  LYS 108           HZ2      LYS 108  -2.544 -14.714   2.443
  828    HZ3  LYS 108           HZ3      LYS 108  -2.904 -15.406   0.941
  829    H    VAL 109           HN       VAL 109  -5.694  -7.337   1.489
  830    HA   VAL 109           HA       VAL 109  -6.887  -7.362   4.164
  831    HB   VAL 109           HB       VAL 109  -5.030  -5.771   4.188
  832   HG11  VAL 109          HG11      VAL 109  -4.966  -5.234   1.803
  833   HG12  VAL 109          HG12      VAL 109  -5.029  -3.778   2.797
  834   HG13  VAL 109          HG13      VAL 109  -6.478  -4.341   1.967
  835   HG21  VAL 109          HG21      VAL 109  -7.528  -5.338   5.125
  836   HG22  VAL 109          HG22      VAL 109  -7.276  -3.884   4.158
  837   HG23  VAL 109          HG23      VAL 109  -6.146  -4.290   5.449