*HEADER    TRANSCRIPTION                           21-MAR-11   2LAU              
*TITLE     SOLUTION STRUCTURE OF THE THAP-ZINC FINGER DOMAIN 1-81 FROM THE CELL  
*TITLE    2 GROWTH SUPPRESSOR HUMAN THAP11 PROTEIN                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: THAP DOMAIN-CONTAINING PROTEIN 11;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: THAP-TYPE ZINC FINGER REGION;                              
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: THAP11, HRIHFB2206;                                            
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PGEX-4T2                                   
*KEYWDS    ZINC FINGER, PROTEIN-DNA COMPLEX, DNA BINDING DOMAIN, TRANSCRIPTION   
*KEYWDS   2 FACTOR, CCCH, TRANSCRIPTION-DNA COMPLEX, TRANSCRIPTION               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    19                                                                    
*AUTHOR    J.DURAND, S.CAMPAGNE, A.MILON, V.GERVAIS                              
*REVDAT   1   26-SEP-12 2LAU    0                                                


assign (resid  32 and name   HB1 ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  36 and name  HD1# ) ( resid  32 and name   HG2 )  2.50  1.00  2.00 ! 45  
assign (resid  22 and name    HA ) ( resid  23 and name    HN )  2.50  1.00  1.00 ! 34  
assign (resid  57 and name    HA ) ( resid  58 and name    HN )  3.70  1.00  1.00 ! 305 
assign (resid  41 and name    HA ) ( resid  42 and name    HN )  3.70  1.00  1.00 ! 52  
assign (resid  71 and name    HA ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 67  
assign (resid  71 and name    HA ) ( resid  72 and name    HN )  2.50  1.00  1.00 ! 67  
assign (resid  71 and name    HA ) ( resid  72 and name  HG2# )  5.00  1.00  2.00 ! 67  
assign (resid  71 and name    HA ) ( resid  75 and name    HB )  5.00  1.00  1.00 ! 67  
assign (resid  71 and name   HG2 ) ( resid  76 and name    HA )  3.70  1.00  1.00 ! 67  
assign (resid  75 and name  HG1# ) ( resid  76 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG1# ) ( resid  74 and name    HB )  2.50  1.00  2.00 ! 87  
assign (resid  73 and name   HB2 ) ( resid  74 and name  HG2# )  3.70  1.00  2.00 ! 7   
assign (resid   5 and name    HA ) ( resid   6 and name    HN )  2.50  1.00  1.00 ! 51  
assign (resid  34 and name   HG1 ) ( resid  27 and name   HE# )  2.50  1.00  2.00 ! 64  
assign (resid  34 and name   HG1 ) ( resid  27 and name   HB1 )  5.00  1.00  1.00 ! 64  
assign (resid  77 and name    HB ) ( resid  36 and name   HB1 )  5.00  1.00  1.00 ! 37  
assign (resid  77 and name    HB ) ( resid  78 and name   HD2 )  3.70  1.00  1.00 ! 37  
assign (resid  40 and name   HB1 ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 38  
assign (resid  40 and name   HB1 ) ( resid  81 and name    HZ )  5.00  1.00  1.00 ! 38  
assign (resid  40 and name   HB1 ) ( resid  37 and name    HA )  5.00  1.00  1.00 ! 38  
assign (resid  40 and name   HB1 ) ( resid  81 and name   HE# )  3.70  1.00  2.00 ! 38  
assign (resid  40 and name    HA ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 38  
assign (resid  36 and name  HD2# ) ( resid  32 and name   HG2 )  2.50  1.00  2.00 ! 45  
assign (resid  64 and name  HG2# ) ( resid  65 and name    HN )  3.70  1.00  2.00 ! 49  
assign (resid  64 and name  HG2# ) ( resid  14 and name  HD21 )  3.70  1.00  2.00 ! 49  
assign (resid  64 and name  HG2# ) ( resid  14 and name  HD22 )  3.70  1.00  2.00 ! 49  
assign (resid  80 and name    HB ) ( resid  65 and name    HA )  2.50  1.00  1.00 ! 88  
assign (resid  41 and name  HG1# ) ( resid  38 and name    HA )  3.70  1.00  2.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  27 and name   HE# )  2.50  1.00  3.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  42 and name    HN )  3.70  1.00  2.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  27 and name    HZ )  2.50  1.00  2.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  53 and name    HZ )  3.70  1.00  2.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  81 and name   HE# )  3.70  1.00  3.00 ! 52  
assign (resid  46 and name  HG1# ) ( resid  47 and name    HN )  3.70  1.00  2.00 ! 48  
assign (resid  46 and name  HG1# ) ( resid  47 and name   HB1 )  2.50  1.00  2.00 ! 48  
assign (resid  54 and name   HG1 ) ( resid  55 and name   HD1 )  5.00  1.00  1.00 ! 66  
assign (resid  70 and name    HA ) ( resid  71 and name    HN )  2.50  1.00  1.00 ! 31  
assign (resid  71 and name   HD1 ) ( resid  37 and name   HZ3 )  5.00  1.00  1.00 ! 67  
assign (resid  71 and name   HD1 ) ( resid  37 and name   HZ2 )  3.70  1.00  1.00 ! 67  
assign (resid  71 and name   HD1 ) ( resid  37 and name   HH2 )  3.70  1.00  1.00 ! 67  
assign (resid  75 and name  HG2# ) ( resid  76 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  67 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  72 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  67 and name   HB2 )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  67 and name   HB1 )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  66 and name   HD# )  2.50  1.00  3.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  66 and name   HE# )  3.70  1.00  3.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  77 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  66 and name   HB1 )  2.50  1.00  2.00 ! 87  
assign (resid  53 and name   HB2 ) ( resid  54 and name    HN )  3.70  1.00  1.00 ! 65  
assign (resid  32 and name    HA ) ( resid  31 and name   HB# )  3.70  1.00  2.00 ! 53  
assign (resid  32 and name    HA ) ( resid  34 and name    HN )  5.00  1.00  1.00 ! 53  
assign (resid  32 and name    HA ) ( resid  33 and name    HN )  5.00  1.00  1.00 ! 53  
assign (resid  32 and name    HA ) ( resid  35 and name   HB1 )  2.50  1.00  1.00 ! 53  
assign (resid  32 and name    HA ) ( resid  35 and name   HB2 )  3.70  1.00  1.00 ! 53  
assign (resid  32 and name    HA ) ( resid  36 and name    HN )  2.50  1.00  1.00 ! 53  
assign (resid  34 and name   HG2 ) ( resid  27 and name   HD# )  2.50  1.00  2.00 ! 64  
assign (resid  34 and name   HG2 ) ( resid  27 and name   HB1 )  5.00  1.00  1.00 ! 64  
assign (resid  77 and name  HG1# ) ( resid  37 and name   HD1 )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name  HG1# ) ( resid  36 and name   HB1 )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name  HG1# ) ( resid  78 and name   HD2 )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name  HG1# ) ( resid  37 and name   HE1 )  3.70  1.00  2.00 ! 37  
assign (resid  46 and name  HG2# ) ( resid  47 and name    HN )  3.70  1.00  2.00 ! 48  
assign (resid  46 and name  HG2# ) ( resid  47 and name   HB1 )  2.50  1.00  2.00 ! 48  
assign (resid  40 and name   HB2 ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 38  
assign (resid  40 and name   HB2 ) ( resid  77 and name  HG2# )  3.70  1.00  2.00 ! 38  
assign (resid  40 and name   HB2 ) ( resid  81 and name    HZ )  5.00  1.00  1.00 ! 38  
assign (resid  40 and name   HB2 ) ( resid  37 and name    HA )  5.00  1.00  1.00 ! 38  
assign (resid  40 and name   HB2 ) ( resid  81 and name   HE# )  3.70  1.00  2.00 ! 38  
assign (resid   6 and name  HG2# ) ( resid  15 and name   HB2 )  3.70  1.00  2.00 ! 69  
assign (resid   6 and name  HG2# ) ( resid  15 and name   HB1 )  3.70  1.00  2.00 ! 69  
assign (resid  36 and name    HG ) ( resid  37 and name    HN )  5.00  1.00  1.00 ! 45  
assign (resid  39 and name    HA ) ( resid  40 and name    HN )  3.70  1.00  1.00 ! 60  
assign (resid  38 and name  HD2# ) ( resid  53 and name   HD# )  3.70  1.00  3.00 ! 71  
assign (resid  38 and name  HD2# ) ( resid  55 and name   HD1 )  3.70  1.00  2.00 ! 71  
assign (resid  38 and name  HD2# ) ( resid  55 and name   HD2 )  3.70  1.00  2.00 ! 71  
assign (resid  38 and name  HD2# ) ( resid  37 and name   HB2 )  3.70  1.00  2.00 ! 71  
assign (resid  38 and name  HD2# ) ( resid  35 and name    HA )  2.50  1.00  2.00 ! 71  
assign (resid  64 and name  HG1# ) ( resid  65 and name    HN )  3.70  1.00  2.00 ! 49  
assign (resid  64 and name  HG1# ) ( resid  14 and name  HD21 )  3.70  1.00  2.00 ! 49  
assign (resid  64 and name  HG1# ) ( resid  14 and name  HD22 )  3.70  1.00  2.00 ! 49  
assign (resid  55 and name   HD1 ) ( resid  54 and name   HG1 )  3.70  1.00  1.00 ! 282 
assign (resid  55 and name   HD1 ) ( resid  38 and name  HD2# )  5.00  1.00  2.00 ! 282 
assign (resid  55 and name   HD1 ) ( resid  54 and name    HA )  2.50  1.00  1.00 ! 282 
assign (resid  55 and name   HD1 ) ( resid  54 and name   HB1 )  3.70  1.00  1.00 ! 282 
assign (resid  55 and name   HD1 ) ( resid  38 and name  HD1# )  3.70  1.00  2.00 ! 282 
assign (resid  55 and name   HD1 ) ( resid  54 and name   HB2 )  3.70  1.00  1.00 ! 282 
assign (resid  10 and name   HD1 ) ( resid  41 and name  HG2# )  5.00  1.00  2.00 ! 278 
assign (resid  10 and name   HD1 ) ( resid   9 and name  HG2# )  3.70  1.00  2.00 ! 278 
assign (resid  54 and name   HG2 ) ( resid  55 and name   HD1 )  3.70  1.00  1.00 ! 66  
assign (resid  54 and name   HG2 ) ( resid  55 and name   HD2 )  3.70  1.00  1.00 ! 66  
assign (resid  70 and name   HB1 ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 31  
assign (resid  70 and name   HB1 ) ( resid  71 and name    HN )  3.70  1.00  1.00 ! 31  
assign (resid  71 and name   HD2 ) ( resid  37 and name   HZ2 )  3.70  1.00  1.00 ! 67  
assign (resid  31 and name    HA ) ( resid  35 and name    HN )  5.00  1.00  1.00 ! 86  
assign (resid  31 and name    HA ) ( resid  32 and name    HN )  3.70  1.00  1.00 ! 86  
assign (resid  31 and name    HA ) ( resid  34 and name    HN )  5.00  1.00  1.00 ! 86  
assign (resid  31 and name    HA ) ( resid  33 and name    HN )  5.00  1.00  1.00 ! 86  
assign (resid  31 and name    HA ) ( resid  34 and name   HB2 )  3.70  1.00  1.00 ! 86  
assign (resid  79 and name  HG2# ) ( resid  40 and name  HD21 )  3.70  1.00  2.00 ! 9   
assign (resid  79 and name  HG2# ) ( resid  40 and name  HD22 )  3.70  1.00  2.00 ! 9   
assign (resid  54 and name    HA ) ( resid  55 and name   HD1 )  2.50  1.00  1.00 ! 66  
assign (resid  54 and name    HA ) ( resid  55 and name   HD2 )  2.50  1.00  1.00 ! 66  
assign (resid  24 and name    HA ) ( resid  62 and name    HA )  2.50  1.00  1.00 ! 54  
assign (resid  24 and name    HA ) ( resid  25 and name    HN )  2.50  1.00  1.00 ! 54  
assign (resid  66 and name    HA ) ( resid  67 and name    HN )  2.50  1.00  1.00 ! 41  
assign (resid  66 and name    HA ) ( resid  78 and name    HA )  3.70  1.00  1.00 ! 41  
assign (resid  61 and name  HD2# ) ( resid  37 and name   HZ3 )  2.50  1.00  2.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  27 and name   HD# )  3.70  1.00  3.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  65 and name   HD2 )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  27 and name    HZ )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  81 and name   HD# )  5.00  1.00  3.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  37 and name   HH2 )  3.70  1.00  2.00 ! 78  
assign (resid  77 and name  HG2# ) ( resid  37 and name   HD1 )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  40 and name  HD21 )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  36 and name   HB1 )  5.00  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  40 and name  HD22 )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  36 and name   HB2 )  5.00  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  78 and name   HD2 )  2.50  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  37 and name   HE1 )  3.70  1.00  2.00 ! 37  
assign (resid  36 and name    HA ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  39 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  39 and name   HG2 )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  39 and name   HB2 )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  39 and name   HD2 )  3.70  1.00  1.00 ! 45  
assign (resid  34 and name    HA ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  33 and name    HG )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  28 and name   HG1 )  5.00  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  28 and name   HG2 )  5.00  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  28 and name   HD2 )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  37 and name   HB2 )  2.50  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  55 and name   HD2 ) ( resid  54 and name    HA )  2.50  1.00  1.00 ! 282 
assign (resid  55 and name   HD2 ) ( resid  38 and name  HD1# )  3.70  1.00  2.00 ! 282 
assign (resid  55 and name   HD2 ) ( resid  54 and name   HB2 )  3.70  1.00  1.00 ! 282 
assign (resid  62 and name   HB2 ) ( resid  22 and name  HD2# )  5.00  1.00  2.00 ! 83  
assign (resid  62 and name   HB2 ) ( resid   7 and name   HB1 )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name   HB2 ) ( resid   7 and name   HB2 )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name   HB2 ) ( resid  63 and name    HN )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name   HB2 ) ( resid  24 and name   HE# )  3.70  1.00  2.00 ! 83  
assign (resid  62 and name   HB2 ) ( resid  24 and name   HD# )  3.70  1.00  2.00 ! 83  
assign (resid  10 and name   HD2 ) ( resid  41 and name  HG2# )  5.00  1.00  2.00 ! 278 
assign (resid  10 and name   HD2 ) ( resid   9 and name    HA )  2.50  1.00  1.00 ! 278 
assign (resid  10 and name   HD2 ) ( resid   9 and name  HG2# )  3.70  1.00  2.00 ! 278 
assign (resid  60 and name   HB1 ) ( resid  24 and name   HB1 )  3.70  1.00  1.00 ! 75  
assign (resid  60 and name   HB1 ) ( resid  24 and name   HB2 )  3.70  1.00  1.00 ! 75  
assign (resid  60 and name   HB1 ) ( resid  61 and name    HN )  3.70  1.00  1.00 ! 75  
assign (resid  60 and name   HB1 ) ( resid  24 and name   HD# )  3.70  1.00  2.00 ! 75  
assign (resid  44 and name    HA ) ( resid  45 and name    HN )  3.70  1.00  1.00 ! 68  
assign (resid  47 and name    HA ) ( resid  48 and name    HN )  5.00  1.00  1.00 ! 55  
assign (resid  74 and name    HB ) ( resid  75 and name  HG1# )  3.70  1.00  2.00 ! 5   
assign (resid  74 and name    HB ) ( resid  75 and name    HN )  3.70  1.00  1.00 ! 5   
assign (resid  71 and name   HE1 ) ( resid  37 and name   HZ2 )  3.70  1.00  1.00 ! 67  
assign (resid  71 and name   HE1 ) ( resid  37 and name   HH2 )  3.70  1.00  1.00 ! 67  
assign (resid  31 and name   HB# ) ( resid  32 and name    HA )  5.00  1.00  2.00 ! 86  
assign (resid  31 and name   HB# ) ( resid  30 and name    HA )  3.70  1.00  2.00 ! 86  
assign (resid  31 and name   HB# ) ( resid  32 and name    HN )  3.70  1.00  2.00 ! 86  
assign (resid  54 and name   HB1 ) ( resid  55 and name   HD1 )  3.70  1.00  1.00 ! 66  
assign (resid  24 and name   HB1 ) ( resid  60 and name   HB1 )  3.70  1.00  1.00 ! 54  
assign (resid  24 and name   HB1 ) ( resid  26 and name  HG2# )  3.70  1.00  2.00 ! 54  
assign (resid  66 and name   HB2 ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 41  
assign (resid  45 and name   HA1 ) ( resid  46 and name    HN )  3.70  1.00  1.00 ! 1   
assign (resid  45 and name   HA1 ) ( resid  46 and name  HG1# )  3.70  1.00  2.00 ! 1   
assign (resid  45 and name   HA1 ) ( resid  52 and name  HG2# )  3.70  1.00  2.00 ! 1   
assign (resid  22 and name    HG ) ( resid  19 and name   HB1 )  3.70  1.00  1.00 ! 34  
assign (resid  22 and name    HG ) ( resid  19 and name   HB2 )  3.70  1.00  1.00 ! 34  
assign (resid  33 and name    HG ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HG ) ( resid  28 and name   HB1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HG ) ( resid  28 and name   HG2 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HG ) ( resid  34 and name    HN )  5.00  1.00  1.00 ! 59  
assign (resid  33 and name    HG ) ( resid  37 and name   HE1 )  3.70  1.00  1.00 ! 59  
assign (resid  41 and name  HG2# ) ( resid  10 and name   HD1 )  5.00  1.00  2.00 ! 52  
assign (resid  41 and name  HG2# ) ( resid  10 and name   HD2 )  5.00  1.00  2.00 ! 52  
assign (resid  41 and name  HG2# ) ( resid   9 and name    HA )  5.00  1.00  2.00 ! 52  
assign (resid  41 and name  HG2# ) ( resid  38 and name    HA )  3.70  1.00  2.00 ! 52  
assign (resid  41 and name  HG2# ) ( resid  42 and name    HN )  3.70  1.00  2.00 ! 52  
assign (resid  41 and name  HG2# ) ( resid  27 and name    HZ )  5.00  1.00  2.00 ! 52  
assign (resid   5 and name   HB2 ) ( resid   6 and name    HN )  3.70  1.00  1.00 ! 51  
assign (resid  76 and name    HA ) ( resid  71 and name   HG2 )  3.70  1.00  1.00 ! 57  
assign (resid  76 and name    HA ) ( resid  77 and name    HN )  3.70  1.00  1.00 ! 57  
assign (resid  76 and name    HA ) ( resid  71 and name   HG1 )  3.70  1.00  1.00 ! 57  
assign (resid  62 and name   HB1 ) ( resid  22 and name  HD2# )  5.00  1.00  2.00 ! 83  
assign (resid  62 and name   HB1 ) ( resid   7 and name   HB1 )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name   HB1 ) ( resid   7 and name   HB2 )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name   HB1 ) ( resid  63 and name    HN )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name   HB1 ) ( resid  24 and name   HE# )  3.70  1.00  2.00 ! 83  
assign (resid  71 and name   HE2 ) ( resid  70 and name    HN )  3.70  1.00  1.00 ! 67  
assign (resid   9 and name    HA ) ( resid  10 and name   HD2 )  2.50  1.00  1.00 ! 85  
assign (resid   9 and name    HA ) ( resid  41 and name  HG2# )  5.00  1.00  2.00 ! 85  
assign (resid  16 and name    HA ) ( resid  24 and name    HZ )  3.70  1.00  1.00 ! 70  
assign (resid  16 and name    HA ) ( resid  17 and name    HN )  3.70  1.00  1.00 ! 70  
assign (resid  16 and name    HA ) ( resid  24 and name   HE# )  2.50  1.00  2.00 ! 70  
assign (resid  16 and name    HA ) ( resid  24 and name   HD# )  3.70  1.00  2.00 ! 70  
assign (resid  24 and name   HB2 ) ( resid  60 and name   HB1 )  3.70  1.00  1.00 ! 54  
assign (resid  24 and name   HB2 ) ( resid  26 and name  HG2# )  3.70  1.00  2.00 ! 54  
assign (resid  43 and name    HA ) ( resid  44 and name    HN )  3.70  1.00  1.00 ! 42  
assign (resid  22 and name  HD2# ) ( resid  24 and name    HZ )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  62 and name   HB2 )  5.00  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  62 and name   HB1 )  5.00  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  14 and name   HB2 )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  23 and name    HN )  5.00  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  19 and name   HB2 )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  14 and name  HD21 )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  24 and name   HE# )  2.50  1.00  3.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  14 and name  HD22 )  3.70  1.00  2.00 ! 34  
assign (resid  67 and name   HB2 ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 80  
assign (resid  67 and name   HB2 ) ( resid  80 and name  HD1# )  3.70  1.00  2.00 ! 80  
assign (resid  38 and name  HD1# ) ( resid  53 and name   HD# )  3.70  1.00  3.00 ! 71  
assign (resid  38 and name  HD1# ) ( resid  55 and name   HD1 )  3.70  1.00  2.00 ! 71  
assign (resid  38 and name  HD1# ) ( resid  55 and name   HD2 )  3.70  1.00  2.00 ! 71  
assign (resid  38 and name  HD1# ) ( resid  27 and name   HE# )  2.50  1.00  3.00 ! 71  
assign (resid  38 and name  HD1# ) ( resid  27 and name    HZ )  2.50  1.00  2.00 ! 71  
assign (resid   7 and name   HB1 ) ( resid  62 and name   HB2 )  3.70  1.00  1.00 ! 306 
assign (resid   7 and name   HB1 ) ( resid  62 and name   HB1 )  3.70  1.00  1.00 ! 306 
assign (resid   9 and name  HG1# ) ( resid  10 and name   HD2 )  3.70  1.00  2.00 ! 85  
assign (resid   9 and name  HG1# ) ( resid  65 and name   HD2 )  5.00  1.00  2.00 ! 85  
assign (resid   9 and name  HG1# ) ( resid  81 and name   HE# )  3.70  1.00  3.00 ! 85  
assign (resid  58 and name   HA1 ) ( resid  59 and name    HN )  3.70  1.00  1.00 ! 294 
assign (resid  28 and name    HA ) ( resid  29 and name    HN )  3.70  1.00  1.00 ! 281 
assign (resid  38 and name    HA ) ( resid  39 and name    HN )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HA ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HA ) ( resid  41 and name  HG2# )  3.70  1.00  2.00 ! 71  
assign (resid  21 and name    HA ) ( resid  22 and name    HN )  3.70  1.00  1.00 ! 56  
assign (resid  30 and name    HA ) ( resid  31 and name   HB# )  3.70  1.00  2.00 ! 43  
assign (resid  30 and name    HA ) ( resid  31 and name    HN )  2.50  1.00  1.00 ! 43  
assign (resid  10 and name    HA ) ( resid  11 and name    HN )  3.70  1.00  1.00 ! 278 
assign (resid  52 and name  HG2# ) ( resid  53 and name    HN )  5.00  1.00  2.00 ! 18  
assign (resid  52 and name  HG2# ) ( resid  45 and name   HA1 )  5.00  1.00  2.00 ! 18  
assign (resid  61 and name  HD1# ) ( resid  65 and name   HD2 )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  66 and name    HZ )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  37 and name   HH2 )  5.00  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  37 and name   HE3 )  2.50  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  81 and name   HE# )  2.50  1.00  3.00 ! 78  
assign (resid  22 and name  HD1# ) ( resid  23 and name    HN )  5.00  1.00  2.00 ! 34  
assign (resid  22 and name  HD1# ) ( resid  19 and name   HB1 )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD1# ) ( resid  19 and name   HB2 )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD1# ) ( resid  14 and name  HD21 )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD1# ) ( resid  63 and name    HN )  5.00  1.00  2.00 ! 34  
assign (resid  22 and name  HD1# ) ( resid  14 and name  HD22 )  5.00  1.00  2.00 ! 34  
assign (resid  67 and name   HB1 ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 80  
assign (resid  67 and name   HB1 ) ( resid  80 and name  HD1# )  3.70  1.00  2.00 ! 80  
assign (resid  34 and name   HB1 ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name   HB1 ) ( resid  35 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name   HB1 ) ( resid  33 and name    HN )  5.00  1.00  1.00 ! 64  
assign (resid   7 and name   HB2 ) ( resid  62 and name   HB2 )  3.70  1.00  1.00 ! 306 
assign (resid   7 and name   HB2 ) ( resid  62 and name   HB1 )  3.70  1.00  1.00 ! 306 
assign (resid  80 and name  HG12 ) ( resid  67 and name    HA )  5.00  1.00  1.00 ! 88  
assign (resid  65 and name    HA ) ( resid  80 and name    HB )  2.50  1.00  1.00 ! 24  
assign (resid  28 and name   HB1 ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HB1 ) ( resid  33 and name    HG )  2.50  1.00  1.00 ! 281 
assign (resid  28 and name   HB1 ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HB1 ) ( resid  33 and name  HD2# )  3.70  1.00  2.00 ! 281 
assign (resid   6 and name    HA ) ( resid  15 and name    HA )  3.70  1.00  1.00 ! 69  
assign (resid  47 and name   HB1 ) ( resid  46 and name  HG2# )  3.70  1.00  2.00 ! 55  
assign (resid   9 and name  HG2# ) ( resid  10 and name   HD1 )  5.00  1.00  2.00 ! 85  
assign (resid   9 and name  HG2# ) ( resid  10 and name   HD2 )  3.70  1.00  2.00 ! 85  
assign (resid   9 and name  HG2# ) ( resid  65 and name   HE1 )  2.50  1.00  2.00 ! 85  
assign (resid   9 and name  HG2# ) ( resid  81 and name   HD# )  2.50  1.00  3.00 ! 85  
assign (resid   9 and name  HG2# ) ( resid  81 and name   HE# )  3.70  1.00  3.00 ! 85  
assign (resid  38 and name   HB1 ) ( resid  39 and name    HN )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name   HB1 ) ( resid  35 and name    HA )  2.50  1.00  1.00 ! 71  
assign (resid  21 and name   HB# ) ( resid  22 and name    HN )  3.70  1.00  2.00 ! 56  
assign (resid  30 and name   HB1 ) ( resid  31 and name    HN )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name   HB1 ) ( resid  33 and name  HD1# )  5.00  1.00  2.00 ! 43  
assign (resid  30 and name   HB1 ) ( resid  33 and name   HB1 )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name   HB1 ) ( resid  33 and name   HB2 )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name   HB1 ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name   HB1 ) ( resid  33 and name  HD2# )  5.00  1.00  2.00 ! 43  
assign (resid  69 and name   HA1 ) ( resid  70 and name    HN )  3.70  1.00  1.00 ! 3   
assign (resid  14 and name    HA ) ( resid  15 and name    HN )  2.50  1.00  1.00 ! 104 
assign (resid  80 and name  HG2# ) ( resid  65 and name    HA )  3.70  1.00  2.00 ! 88  
assign (resid  80 and name  HG2# ) ( resid  66 and name    HN )  3.70  1.00  2.00 ! 88  
assign (resid  80 and name  HG2# ) ( resid  81 and name    HN )  3.70  1.00  2.00 ! 88  
assign (resid  76 and name   HB1 ) ( resid  33 and name  HD1# )  5.00  1.00  2.00 ! 57  
assign (resid  76 and name   HB1 ) ( resid  33 and name  HD2# )  3.70  1.00  2.00 ! 57  
assign (resid   4 and name   HA2 ) ( resid   5 and name    HN )  3.70  1.00  1.00 ! 2   
assign (resid  28 and name   HB2 ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HB2 ) ( resid  33 and name    HG )  2.50  1.00  1.00 ! 281 
assign (resid  28 and name   HB2 ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HB2 ) ( resid  33 and name  HD1# )  3.70  1.00  2.00 ! 281 
assign (resid  28 and name   HB2 ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 281 
assign (resid  17 and name   HB1 ) ( resid  18 and name    HN )  5.00  1.00  1.00 ! 58  
assign (resid  52 and name    HA ) ( resid  53 and name    HN )  2.50  1.00  1.00 ! 18  
assign (resid  67 and name   HG1 ) ( resid  80 and name  HD1# )  3.70  1.00  2.00 ! 80  
assign (resid  25 and name   HB2 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name   HB2 ) ( resid  37 and name   HH2 )  3.70  1.00  1.00 ! 79  
assign (resid  70 and name   HD1 ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 31  
assign (resid  45 and name   HA2 ) ( resid  46 and name    HN )  3.70  1.00  1.00 ! 1   
assign (resid  38 and name   HB2 ) ( resid  39 and name    HN )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name   HB2 ) ( resid  35 and name    HA )  3.70  1.00  1.00 ! 71  
assign (resid  16 and name   HB2 ) ( resid   5 and name    HN )  5.00  1.00  1.00 ! 70  
assign (resid  39 and name   HG2 ) ( resid  36 and name    HA )  5.00  1.00  1.00 ! 60  
assign (resid  30 and name   HB2 ) ( resid  28 and name   HB1 )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name   HB2 ) ( resid  33 and name  HD1# )  3.70  1.00  2.00 ! 43  
assign (resid  30 and name   HB2 ) ( resid  33 and name   HB1 )  2.50  1.00  1.00 ! 43  
assign (resid  30 and name   HB2 ) ( resid  33 and name   HB2 )  2.50  1.00  1.00 ! 43  
assign (resid  30 and name   HB2 ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name   HB2 ) ( resid  33 and name  HD2# )  5.00  1.00  2.00 ! 43  
assign (resid  26 and name    HB ) ( resid  27 and name    HN )  3.70  1.00  1.00 ! 128 
assign (resid  60 and name   HB2 ) ( resid  61 and name    HN )  3.70  1.00  1.00 ! 75  
assign (resid  49 and name    HA ) ( resid  50 and name    HN )  3.70  1.00  1.00 ! 117 
assign (resid  80 and name  HD1# ) ( resid  67 and name   HB2 )  5.00  1.00  2.00 ! 88  
assign (resid  80 and name  HD1# ) ( resid  67 and name   HB1 )  3.70  1.00  2.00 ! 88  
assign (resid  80 and name  HD1# ) ( resid  65 and name    HA )  3.70  1.00  2.00 ! 88  
assign (resid  80 and name  HD1# ) ( resid  66 and name    HN )  5.00  1.00  2.00 ! 88  
assign (resid  80 and name  HD1# ) ( resid  67 and name   HG1 )  5.00  1.00  2.00 ! 88  
assign (resid  80 and name  HD1# ) ( resid  67 and name   HG2 )  3.70  1.00  2.00 ! 88  
assign (resid  80 and name  HD1# ) ( resid  67 and name    HA )  2.50  1.00  2.00 ! 88  
assign (resid  35 and name   HG1 ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 46  
assign (resid   4 and name   HA1 ) ( resid   5 and name    HN )  3.70  1.00  1.00 ! 2   
assign (resid  74 and name    HA ) ( resid  75 and name    HN )  3.70  1.00  1.00 ! 5   
assign (resid  70 and name   HB2 ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 31  
assign (resid  70 and name   HB2 ) ( resid  71 and name    HN )  3.70  1.00  1.00 ! 31  
assign (resid  28 and name   HG1 ) ( resid  33 and name    HG )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HG1 ) ( resid  27 and name    HA )  3.70  1.00  1.00 ! 281 
assign (resid  78 and name    HA ) ( resid  66 and name    HA )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name    HA ) ( resid  80 and name    HN )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name    HA ) ( resid  79 and name    HN )  2.50  1.00  1.00 ! 263 
assign (resid  67 and name   HG2 ) ( resid  80 and name  HD1# )  5.00  1.00  2.00 ! 80  
assign (resid  25 and name   HB1 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name   HB1 ) ( resid  37 and name   HH2 )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name   HB1 ) ( resid  26 and name    HN )  3.70  1.00  1.00 ! 79  
assign (resid  70 and name   HD2 ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 31  
assign (resid  37 and name    HA ) ( resid  40 and name   HB1 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HA ) ( resid  38 and name    HN )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name    HA ) ( resid  78 and name   HD2 )  3.70  1.00  1.00 ! 72  
assign (resid  16 and name   HB1 ) ( resid   5 and name   HD# )  3.70  1.00  2.00 ! 70  
assign (resid  16 and name   HB1 ) ( resid   5 and name    HN )  5.00  1.00  1.00 ! 70  
assign (resid  33 and name    HA ) ( resid  36 and name   HB1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HA ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HA ) ( resid  36 and name   HB2 )  2.50  1.00  1.00 ! 59  
assign (resid  33 and name    HA ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 59  
assign (resid  59 and name   HB1 ) ( resid  60 and name    HN )  3.70  1.00  1.00 ! 44  
assign (resid  42 and name   HB2 ) ( resid  43 and name    HN )  5.00  1.00  1.00 ! 17  
assign (resid  68 and name   HA1 ) ( resid  69 and name    HN )  3.70  1.00  1.00 ! 74  
assign (resid  26 and name  HG2# ) ( resid  27 and name    HN )  3.70  1.00  2.00 ! 128 
assign (resid  26 and name  HG2# ) ( resid  24 and name   HB1 )  3.70  1.00  2.00 ! 128 
assign (resid  26 and name  HG2# ) ( resid  24 and name   HB2 )  3.70  1.00  2.00 ! 128 
assign (resid  44 and name   HB# ) ( resid  45 and name    HN )  3.70  1.00  2.00 ! 68  
assign (resid  22 and name   HB2 ) ( resid  23 and name    HN )  3.70  1.00  1.00 ! 34  
assign (resid  33 and name  HD1# ) ( resid  37 and name   HD1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  28 and name   HB1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  76 and name   HB1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  30 and name   HB2 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  76 and name   HB2 )  5.00  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  76 and name   HD2 )  2.50  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  37 and name   HE1 )  3.70  1.00  2.00 ! 59  
assign (resid  76 and name   HB2 ) ( resid  33 and name  HD1# )  5.00  1.00  2.00 ! 57  
assign (resid  76 and name   HB2 ) ( resid  33 and name  HD2# )  3.70  1.00  2.00 ! 57  
assign (resid  28 and name   HG2 ) ( resid  34 and name    HA )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HG2 ) ( resid  33 and name   HB1 )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HG2 ) ( resid  33 and name   HB2 )  3.70  1.00  1.00 ! 281 
assign (resid  80 and name    HA ) ( resid  81 and name    HN )  2.50  1.00  1.00 ! 88  
assign (resid  78 and name   HB1 ) ( resid  81 and name    HZ )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HB1 ) ( resid  65 and name   HB2 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HB1 ) ( resid  65 and name   HB1 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HB1 ) ( resid  81 and name   HE# )  3.70  1.00  2.00 ! 263 
assign (resid  23 and name   HB2 ) ( resid  63 and name   HB2 )  5.00  1.00  1.00 ! 47  
assign (resid  25 and name    HA ) ( resid  26 and name    HN )  2.50  1.00  1.00 ! 79  
assign (resid  76 and name   HD1 ) ( resid  33 and name  HD1# )  3.70  1.00  2.00 ! 57  
assign (resid  76 and name   HD1 ) ( resid  33 and name  HD2# )  3.70  1.00  2.00 ! 57  
assign (resid  37 and name   HB1 ) ( resid  27 and name   HD# )  2.50  1.00  2.00 ! 72  
assign (resid  37 and name   HB1 ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 72  
assign (resid  33 and name   HB1 ) ( resid  28 and name   HB1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name   HB1 ) ( resid  30 and name   HB1 )  5.00  1.00  1.00 ! 59  
assign (resid  33 and name   HB1 ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name   HB1 ) ( resid  28 and name   HG2 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name   HB1 ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 59  
assign (resid  59 and name   HB2 ) ( resid  27 and name   HE# )  3.70  1.00  2.00 ! 44  
assign (resid  59 and name   HB2 ) ( resid  60 and name    HN )  5.00  1.00  1.00 ! 44  
assign (resid  42 and name   HB1 ) ( resid  43 and name    HN )  3.70  1.00  1.00 ! 17  
assign (resid  14 and name   HB2 ) ( resid  22 and name  HD2# )  3.70  1.00  2.00 ! 104 
assign (resid  20 and name   HB2 ) ( resid  21 and name    HN )  3.70  1.00  1.00 ! 39  
assign (resid  39 and name   HB2 ) ( resid  40 and name    HN )  3.70  1.00  1.00 ! 60  
assign (resid  35 and name   HG2 ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 46  
assign (resid  28 and name   HD2 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  34 and name    HA )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  37 and name   HE3 )  5.00  1.00  1.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  27 and name    HA )  2.50  1.00  1.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  27 and name   HB2 )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  34 and name   HB2 )  5.00  1.00  1.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  27 and name   HB1 )  3.70  1.00  1.00 ! 281 
assign (resid  18 and name    HA ) ( resid  19 and name    HN )  3.70  1.00  1.00 ! 129 
assign (resid  51 and name    HA ) ( resid  52 and name    HN )  3.70  1.00  1.00 ! 21  
assign (resid  61 and name    HA ) ( resid  62 and name    HN )  2.50  1.00  1.00 ! 78  
assign (resid  76 and name   HD2 ) ( resid  33 and name  HD1# )  5.00  1.00  2.00 ! 57  
assign (resid  76 and name   HD2 ) ( resid  33 and name  HD2# )  5.00  1.00  2.00 ! 57  
assign (resid  37 and name   HB2 ) ( resid  38 and name  HD2# )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HB2 ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HB2 ) ( resid  27 and name   HE# )  2.50  1.00  2.00 ! 72  
assign (resid  33 and name   HB2 ) ( resid  28 and name   HB1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name   HB2 ) ( resid  30 and name   HB1 )  5.00  1.00  1.00 ! 59  
assign (resid  33 and name   HB2 ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name   HB2 ) ( resid  28 and name   HG2 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name   HB2 ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 59  
assign (resid  36 and name   HB1 ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name   HB1 ) ( resid  77 and name  HG1# )  2.50  1.00  2.00 ! 45  
assign (resid  36 and name   HB1 ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  63 and name   HB1 ) ( resid  23 and name   HB2 )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name   HB1 ) ( resid  23 and name    HN )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name   HB1 ) ( resid  25 and name   HE# )  5.00  1.00  2.00 ! 4   
assign (resid  63 and name   HB1 ) ( resid  23 and name   HB1 )  5.00  1.00  1.00 ! 4   
assign (resid  47 and name   HB2 ) ( resid  46 and name  HG1# )  5.00  1.00  2.00 ! 55  
assign (resid  47 and name   HB2 ) ( resid  46 and name  HG2# )  5.00  1.00  2.00 ! 55  
assign (resid  19 and name   HB1 ) ( resid  22 and name    HG )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name   HB1 ) ( resid  22 and name  HD2# )  2.50  1.00  2.00 ! 62  
assign (resid  19 and name   HB1 ) ( resid  22 and name    HN )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name   HB1 ) ( resid  22 and name  HD1# )  3.70  1.00  2.00 ! 62  
assign (resid   5 and name   HB1 ) ( resid   6 and name    HN )  3.70  1.00  1.00 ! 51  
assign (resid  15 and name    HA ) ( resid   6 and name    HA )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HA ) ( resid  16 and name    HN )  3.70  1.00  1.00 ! 77  
assign (resid  28 and name   HD1 ) ( resid  37 and name   HZ3 )  5.00  1.00  1.00 ! 281 
assign (resid  28 and name   HD1 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 281 
assign (resid  28 and name   HD1 ) ( resid  34 and name    HA )  5.00  1.00  1.00 ! 281 
assign (resid  28 and name   HD1 ) ( resid  37 and name   HE3 )  5.00  1.00  1.00 ! 281 
assign (resid  28 and name   HD1 ) ( resid  27 and name    HA )  2.50  1.00  1.00 ! 281 
assign (resid  28 and name   HD1 ) ( resid  27 and name   HB2 )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HD1 ) ( resid  27 and name   HB1 )  3.70  1.00  1.00 ! 281 
assign (resid  18 and name   HB2 ) ( resid  15 and name    HN )  5.00  1.00  1.00 ! 129 
assign (resid  18 and name   HB2 ) ( resid  15 and name  HD22 )  5.00  1.00  1.00 ! 129 
assign (resid  18 and name   HB2 ) ( resid  19 and name    HN )  3.70  1.00  1.00 ! 129 
assign (resid  61 and name   HB1 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 78  
assign (resid  27 and name    HA ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HA ) ( resid  28 and name   HG1 )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HA ) ( resid  28 and name   HG2 )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HA ) ( resid  28 and name   HD2 )  2.50  1.00  1.00 ! 73  
assign (resid  27 and name    HA ) ( resid  28 and name   HD1 )  2.50  1.00  1.00 ! 73  
assign (resid  63 and name    HA ) ( resid  66 and name   HD# )  2.50  1.00  2.00 ! 4   
assign (resid  63 and name    HA ) ( resid  64 and name    HN )  3.70  1.00  1.00 ! 4   
assign (resid  63 and name    HA ) ( resid  66 and name    HN )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name    HA ) ( resid  25 and name   HE# )  3.70  1.00  2.00 ! 4   
assign (resid  36 and name   HB2 ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name   HB2 ) ( resid  77 and name  HG1# )  2.50  1.00  2.00 ! 45  
assign (resid  36 and name   HB2 ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  63 and name   HB2 ) ( resid  23 and name   HB2 )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name   HB2 ) ( resid  23 and name    HN )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name   HB2 ) ( resid  25 and name   HE# )  3.70  1.00  2.00 ! 4   
assign (resid  68 and name   HA2 ) ( resid  69 and name    HN )  3.70  1.00  1.00 ! 74  
assign (resid  19 and name   HB2 ) ( resid  15 and name    HN )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name   HB2 ) ( resid  22 and name    HG )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name   HB2 ) ( resid  22 and name  HD2# )  3.70  1.00  2.00 ! 62  
assign (resid  19 and name   HB2 ) ( resid  22 and name    HN )  5.00  1.00  1.00 ! 62  
assign (resid  19 and name   HB2 ) ( resid  22 and name  HD1# )  3.70  1.00  2.00 ! 62  
assign (resid  32 and name   HB2 ) ( resid  33 and name    HN )  5.00  1.00  1.00 ! 53  
assign (resid  72 and name  HG2# ) ( resid  71 and name    HA )  3.70  1.00  2.00 ! 63  
assign (resid  72 and name  HG2# ) ( resid  70 and name   HB1 )  3.70  1.00  2.00 ! 63  
assign (resid  72 and name  HG2# ) ( resid  70 and name   HD1 )  5.00  1.00  2.00 ! 63  
assign (resid  72 and name  HG2# ) ( resid  70 and name   HD2 )  3.70  1.00  2.00 ! 63  
assign (resid  72 and name  HG2# ) ( resid  70 and name   HG1 )  2.50  1.00  2.00 ! 63  
assign (resid  72 and name  HG2# ) ( resid  75 and name    HN )  5.00  1.00  2.00 ! 63  
assign (resid  72 and name  HG2# ) ( resid  75 and name    HB )  3.70  1.00  2.00 ! 63  
assign (resid  22 and name   HB1 ) ( resid  23 and name    HN )  3.70  1.00  1.00 ! 34  
assign (resid  35 and name   HD2 ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 46  
assign (resid  15 and name   HB2 ) ( resid  16 and name    HN )  3.70  1.00  1.00 ! 77  
assign (resid  18 and name   HB1 ) ( resid  15 and name  HD22 )  5.00  1.00  1.00 ! 129 
assign (resid  18 and name   HB1 ) ( resid  19 and name    HN )  3.70  1.00  1.00 ! 129 
assign (resid  60 and name    HA ) ( resid  61 and name    HN )  2.50  1.00  1.00 ! 75  
assign (resid  60 and name    HA ) ( resid  26 and name    HA )  3.70  1.00  1.00 ! 75  
assign (resid  61 and name   HB2 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 78  
assign (resid  61 and name   HB2 ) ( resid  62 and name    HN )  3.70  1.00  1.00 ! 78  
assign (resid  27 and name   HB2 ) ( resid  28 and name   HD2 )  5.00  1.00  1.00 ! 73  
assign (resid  27 and name   HB2 ) ( resid  28 and name   HD1 )  5.00  1.00  1.00 ! 73  
assign (resid  46 and name    HA ) ( resid  47 and name    HN )  3.70  1.00  1.00 ! 48  
assign (resid  35 and name    HA ) ( resid  38 and name  HD2# )  2.50  1.00  2.00 ! 46  
assign (resid  35 and name    HA ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 46  
assign (resid  35 and name    HA ) ( resid  36 and name    HN )  2.50  1.00  1.00 ! 46  
assign (resid  70 and name   HG1 ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 31  
assign (resid  70 and name   HG1 ) ( resid  71 and name    HN )  5.00  1.00  1.00 ! 31  
assign (resid  14 and name   HB1 ) ( resid  24 and name    HZ )  3.70  1.00  1.00 ! 104 
assign (resid  14 and name   HB1 ) ( resid  15 and name    HN )  3.70  1.00  1.00 ! 104 
assign (resid  14 and name   HB1 ) ( resid  22 and name  HD2# )  3.70  1.00  2.00 ! 104 
assign (resid  14 and name   HB1 ) ( resid  24 and name   HE# )  5.00  1.00  2.00 ! 104 
assign (resid  34 and name   HB2 ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name   HB2 ) ( resid  35 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name   HB2 ) ( resid  28 and name   HD2 )  3.70  1.00  1.00 ! 64  
assign (resid  32 and name   HG1 ) ( resid  36 and name  HD1# )  3.70  1.00  2.00 ! 53  
assign (resid  32 and name   HG1 ) ( resid  33 and name    HN )  5.00  1.00  1.00 ! 53  
assign (resid  74 and name  HG2# ) ( resid  73 and name   HB2 )  3.70  1.00  2.00 ! 5   
assign (resid  74 and name  HG2# ) ( resid  75 and name    HN )  3.70  1.00  2.00 ! 5   
assign (resid  74 and name  HG2# ) ( resid  73 and name   HD# )  3.70  1.00  3.00 ! 5   
assign (resid  74 and name  HG2# ) ( resid  73 and name   HB1 )  5.00  1.00  2.00 ! 5   
assign (resid  39 and name   HB1 ) ( resid  40 and name    HN )  3.70  1.00  1.00 ! 60  
assign (resid  39 and name   HB1 ) ( resid  36 and name    HA )  3.70  1.00  1.00 ! 60  
assign (resid  39 and name   HD1 ) ( resid  36 and name    HA )  3.70  1.00  1.00 ! 60  
assign (resid  15 and name   HB1 ) ( resid  16 and name    HN )  3.70  1.00  1.00 ! 77  
assign (resid  55 and name    HA ) ( resid  56 and name    HN )  3.70  1.00  1.00 ! 282 
assign (resid  78 and name   HD2 ) ( resid  77 and name    HB )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  77 and name  HG2# )  3.70  1.00  2.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  66 and name   HE# )  5.00  1.00  2.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  37 and name    HA )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  37 and name   HE1 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  77 and name    HA )  2.50  1.00  1.00 ! 263 
assign (resid  29 and name    HA ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 170 
assign (resid  54 and name   HB2 ) ( resid  55 and name   HD1 )  3.70  1.00  1.00 ! 66  
assign (resid  54 and name   HB2 ) ( resid  55 and name   HD2 )  3.70  1.00  1.00 ! 66  
assign (resid  79 and name    HA ) ( resid  81 and name   HE# )  3.70  1.00  2.00 ! 9   
assign (resid  62 and name    HA ) ( resid  24 and name    HA )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name    HA ) ( resid  63 and name    HN )  2.50  1.00  1.00 ! 83  
assign (resid  62 and name    HA ) ( resid  25 and name    HN )  3.70  1.00  1.00 ! 83  
assign (resid  27 and name   HB1 ) ( resid  28 and name   HD2 )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name   HB1 ) ( resid  28 and name   HD1 )  3.70  1.00  1.00 ! 73  
assign (resid  35 and name   HB1 ) ( resid  32 and name    HA )  3.70  1.00  1.00 ! 46  
assign (resid  35 and name   HB1 ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 46  
assign (resid  70 and name   HG2 ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 31  
assign (resid  65 and name   HB2 ) ( resid  78 and name   HB1 )  3.70  1.00  1.00 ! 24  
assign (resid  33 and name  HD2# ) ( resid  37 and name   HD1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  28 and name   HB1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  76 and name   HB1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  76 and name   HD2 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  37 and name   HE1 )  3.70  1.00  2.00 ! 59  
assign (resid  32 and name   HG2 ) ( resid  36 and name  HD2# )  3.70  1.00  2.00 ! 53  
assign (resid  67 and name    HA ) ( resid  68 and name    HN )  3.70  1.00  1.00 ! 80  
assign (resid  67 and name    HA ) ( resid  80 and name  HD1# )  2.50  1.00  2.00 ! 80  
assign (resid  41 and name    HB ) ( resid  42 and name    HN )  3.70  1.00  1.00 ! 52  
assign (resid  55 and name   HB1 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 282 
assign (resid  56 and name    HA ) ( resid  57 and name    HN )  5.00  1.00  1.00 ! 105 
assign (resid  78 and name   HD1 ) ( resid  77 and name    HB )  5.00  1.00  1.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  77 and name  HG2# )  3.70  1.00  2.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  66 and name   HE# )  3.70  1.00  2.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  37 and name    HA )  5.00  1.00  1.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  66 and name    HZ )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  37 and name   HE1 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  77 and name    HA )  2.50  1.00  1.00 ! 263 
assign (resid  75 and name    HA ) ( resid  76 and name    HN )  2.50  1.00  1.00 ! 87  
assign (resid  75 and name    HA ) ( resid  77 and name    HN )  5.00  1.00  1.00 ! 87  
assign (resid  73 and name    HA ) ( resid  74 and name    HN )  3.70  1.00  1.00 ! 7   
assign (resid  19 and name    HA ) ( resid  20 and name    HN )  2.50  1.00  1.00 ! 62  
assign (resid  35 and name   HB2 ) ( resid  32 and name    HA )  3.70  1.00  1.00 ! 46  
assign (resid  35 and name   HB2 ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 46  
assign (resid  65 and name   HB1 ) ( resid  78 and name   HB1 )  3.70  1.00  1.00 ! 24  
assign (resid  64 and name    HA ) ( resid  65 and name    HN )  3.70  1.00  1.00 ! 49  
assign (resid  64 and name    HA ) ( resid  66 and name    HN )  3.70  1.00  1.00 ! 49  
assign (resid  38 and name    HG ) ( resid  27 and name   HE# )  2.50  1.00  2.00 ! 71  
assign (resid  66 and name   HB1 ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 41  
assign (resid   3 and name    HA ) ( resid   4 and name    HN )  3.70  1.00  1.00 ! 262 
assign (resid  55 and name   HB2 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 282 
assign (resid  55 and name   HB2 ) ( resid  38 and name  HD2# )  3.70  1.00  2.00 ! 282 
assign (resid  29 and name   HB2 ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 170 
assign (resid  75 and name    HB ) ( resid  71 and name    HA )  5.00  1.00  1.00 ! 87  
assign (resid  75 and name    HB ) ( resid  72 and name    HN )  3.70  1.00  1.00 ! 87  
assign (resid  73 and name   HB1 ) ( resid  74 and name  HG2# )  3.70  1.00  2.00 ! 7   
assign (resid  53 and name    HA ) ( resid  54 and name    HN )  2.50  1.00  1.00 ! 65  
assign (resid  23 and name   HB1 ) ( resid  63 and name   HB2 )  5.00  1.00  1.00 ! 47  
assign (resid  23 and name   HB1 ) ( resid  24 and name    HN )  3.70  1.00  1.00 ! 47  
assign (resid  77 and name    HA ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 37  
assign (resid  77 and name    HA ) ( resid  78 and name   HD2 )  2.50  1.00  1.00 ! 37  
assign (resid  77 and name    HA ) ( resid  78 and name   HD1 )  2.50  1.00  1.00 ! 37  
assign (resid  65 and name    HA ) ( resid  80 and name    HB )  2.50  1.00  1.00 ! 24
assign (resid   6 and name    HA ) ( resid  15 and name    HA )  3.70  1.00  1.00 ! 69
assign (resid  26 and name    HA ) ( resid  60 and name    HA )  3.70  1.00  1.00 ! 128
assign (resid  65 and name    HA ) ( resid  80 and name    HB )  2.50  1.00  1.00 ! 24
assign (resid   6 and name    HA ) ( resid  15 and name    HA )  3.70  1.00  1.00 ! 69
assign (resid  26 and name    HA ) ( resid  60 and name    HA )  3.70  1.00  1.00 ! 128
assign (resid  77 and name    HA ) ( resid  37 and name   HE1 )  2.50  1.00  1.00 ! 37  
assign (resid  18 and name    HN ) ( resid  19 and name    HN )  2.50  1.00  1.00 ! 129 
assign (resid  18 and name    HN ) ( resid  17 and name    HA )  3.70  1.00  1.00 ! 129 
assign (resid  18 and name    HN ) ( resid  17 and name   HB2 )  3.70  1.00  1.00 ! 129 
assign (resid  63 and name    HN ) ( resid  22 and name   HB1 )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  62 and name    HA )  2.50  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  25 and name   HD# )  5.00  1.00  2.00 ! 4   
assign (resid  63 and name    HN ) ( resid  24 and name    HA )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  62 and name   HB2 )  3.70  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  66 and name   HD# )  5.00  1.00  2.00 ! 4   
assign (resid  63 and name    HN ) ( resid  64 and name    HN )  2.50  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  22 and name   HB2 )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  62 and name    HN )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  23 and name    HN )  3.70  1.00  1.00 ! 4   
assign (resid  75 and name    HN ) ( resid  76 and name    HN )  5.00  1.00  1.00 ! 87  
assign (resid  75 and name    HN ) ( resid  72 and name    HN )  3.70  1.00  1.00 ! 87  
assign (resid  60 and name    HN ) ( resid  59 and name   HB1 )  3.70  1.00  1.00 ! 75  
assign (resid  60 and name    HN ) ( resid  59 and name    HN )  5.00  1.00  1.00 ! 75  
assign (resid  60 and name    HN ) ( resid  59 and name    HA )  2.50  1.00  1.00 ! 75  
assign (resid  71 and name    HN ) ( resid  70 and name   HG1 )  3.70  1.00  1.00 ! 67  
assign (resid  71 and name    HN ) ( resid  25 and name   HE# )  5.00  1.00  2.00 ! 67  
assign (resid  71 and name    HN ) ( resid  70 and name    HA )  3.70  1.00  1.00 ! 67  
assign (resid  71 and name    HN ) ( resid  70 and name   HB1 )  3.70  1.00  1.00 ! 67  
assign (resid  71 and name    HN ) ( resid  70 and name   HB2 )  3.70  1.00  1.00 ! 67  
assign (resid  33 and name    HN ) ( resid  32 and name   HB2 )  2.50  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  32 and name    HA )  2.50  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  31 and name    HA )  5.00  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  35 and name    HN )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  34 and name    HN )  2.50  1.00  1.00 ! 59  
assign (resid   5 and name    HN ) ( resid  16 and name    HN )  3.70  1.00  1.00 ! 51  
assign (resid   5 and name    HN ) ( resid  16 and name    HA )  3.70  1.00  1.00 ! 51  
assign (resid   5 and name    HN ) ( resid   4 and name   HA2 )  3.70  1.00  1.00 ! 51  
assign (resid   5 and name    HN ) ( resid   4 and name   HA1 )  3.70  1.00  1.00 ! 51  
assign (resid   5 and name    HN ) ( resid  16 and name   HB1 )  3.70  1.00  1.00 ! 51  
assign (resid  43 and name    HN ) ( resid  42 and name    HA )  2.50  1.00  1.00 ! 42  
assign (resid  43 and name    HN ) ( resid  42 and name    HN )  3.70  1.00  1.00 ! 42  
assign (resid  43 and name    HN ) ( resid  42 and name   HB2 )  2.50  1.00  1.00 ! 42  
assign (resid  14 and name  HD22 ) ( resid  64 and name  HG2# )  3.70  1.00  2.00 ! 104 
assign (resid  14 and name  HD22 ) ( resid  22 and name  HD2# )  5.00  1.00  2.00 ! 104 
assign (resid  81 and name    HN ) ( resid  80 and name  HG2# )  3.70  1.00  2.00 ! 308 
assign (resid  81 and name    HN ) ( resid  80 and name  HG11 )  5.00  1.00  1.00 ! 308 
assign (resid  81 and name    HN ) ( resid  80 and name    HA )  2.50  1.00  1.00 ! 308 
assign (resid  52 and name    HN ) ( resid  53 and name    HN )  3.70  1.00  1.00 ! 18  
assign (resid  52 and name    HN ) ( resid  51 and name    HA )  3.70  1.00  1.00 ! 18  
assign (resid  25 and name    HN ) ( resid  62 and name    HA )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name    HN ) ( resid  24 and name    HN )  5.00  1.00  1.00 ! 79  
assign (resid  25 and name    HN ) ( resid  24 and name    HA )  2.50  1.00  1.00 ! 79  
assign (resid  25 and name    HN ) ( resid  24 and name   HB1 )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name    HN ) ( resid  24 and name   HB2 )  5.00  1.00  1.00 ! 79  
assign (resid  25 and name    HN ) ( resid  61 and name    HN )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name    HN ) ( resid  26 and name    HN )  5.00  1.00  1.00 ! 79  
assign (resid  16 and name    HN ) ( resid  15 and name   HB1 )  3.70  1.00  1.00 ! 70  
assign (resid  16 and name    HN ) ( resid  24 and name    HZ )  5.00  1.00  1.00 ! 70  
assign (resid  16 and name    HN ) ( resid  15 and name    HN )  5.00  1.00  1.00 ! 70  
assign (resid  16 and name    HN ) ( resid  17 and name    HN )  3.70  1.00  1.00 ! 70  
assign (resid  16 and name    HN ) ( resid   5 and name   HD# )  5.00  1.00  2.00 ! 70  
assign (resid  16 and name    HN ) ( resid  15 and name    HA )  3.70  1.00  1.00 ! 70  
assign (resid  19 and name    HN ) ( resid  18 and name    HN )  2.50  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  18 and name   HB1 )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  18 and name   HG2 )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  15 and name    HN )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  20 and name    HN )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  18 and name    HA )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  18 and name   HB2 )  3.70  1.00  1.00 ! 62  
assign (resid  24 and name    HN ) ( resid  25 and name    HN )  5.00  1.00  1.00 ! 54  
assign (resid  24 and name    HN ) ( resid  23 and name   HB1 )  3.70  1.00  1.00 ! 54  
assign (resid  24 and name    HN ) ( resid  23 and name    HN )  5.00  1.00  1.00 ! 54  
assign (resid  24 and name    HN ) ( resid  23 and name    HA )  2.50  1.00  1.00 ! 54  
assign (resid  36 and name    HN ) ( resid  35 and name   HD2 )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  35 and name    HA )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  35 and name   HB1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  35 and name   HB2 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  37 and name   HD1 )  5.00  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  34 and name    HA )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  35 and name   HG1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  35 and name   HG2 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  37 and name    HN )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  34 and name    HN )  2.50  1.00  1.00 ! 45  
assign (resid  37 and name   HE1 ) ( resid  78 and name   HD2 )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  78 and name   HD1 )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  77 and name    HA )  2.50  1.00  2.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  77 and name  HG1# )  2.50  1.00  3.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  77 and name  HG2# )  2.50  1.00  3.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  33 and name    HG )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  76 and name   HB1 )  5.00  1.00  2.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  76 and name   HB2 )  5.00  1.00  2.00 ! 72  
assign (resid  70 and name    HN ) ( resid  71 and name   HE2 )  5.00  1.00  1.00 ! 31  
assign (resid  70 and name    HN ) ( resid  69 and name    HN )  5.00  1.00  1.00 ! 31  
assign (resid  70 and name    HN ) ( resid  69 and name   HA1 )  3.70  1.00  1.00 ! 31  
assign (resid  48 and name    HN ) ( resid  47 and name    HA )  5.00  1.00  1.00 ! 23  
assign (resid  48 and name    HN ) ( resid  47 and name   HB2 )  2.50  1.00  1.00 ! 23  
assign (resid  48 and name    HN ) ( resid  47 and name   HB2 )  5.00  1.00  1.00 ! 23  
assign (resid   4 and name    HN ) ( resid   3 and name    HA )  2.50  1.00  1.00 ! 2   
assign (resid   4 and name    HN ) ( resid   3 and name   HB2 )  5.00  1.00  1.00 ! 2   
assign (resid   9 and name    HN ) ( resid   8 and name   HB2 )  3.70  1.00  1.00 ! 85  
assign (resid  27 and name    HN ) ( resid  26 and name    HB )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HN ) ( resid  26 and name  HG2# )  3.70  1.00  2.00 ! 73  
assign (resid  27 and name    HN ) ( resid  26 and name    HA )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HN ) ( resid  26 and name    HN )  5.00  1.00  1.00 ! 73  
assign (resid  27 and name    HN ) ( resid  28 and name   HD2 )  5.00  1.00  1.00 ! 73  
assign (resid  53 and name    HN ) ( resid  52 and name  HG2# )  5.00  1.00  2.00 ! 65  
assign (resid  53 and name    HN ) ( resid  52 and name    HA )  2.50  1.00  1.00 ! 65  
assign (resid  76 and name    HN ) ( resid  75 and name    HA )  2.50  1.00  1.00 ! 57  
assign (resid  76 and name    HN ) ( resid  75 and name    HB )  5.00  1.00  1.00 ! 57  
assign (resid  76 and name    HN ) ( resid  75 and name  HG1# )  3.70  1.00  2.00 ! 57  
assign (resid  76 and name    HN ) ( resid  75 and name  HG2# )  5.00  1.00  2.00 ! 57  
assign (resid  76 and name    HN ) ( resid  77 and name    HN )  2.50  1.00  1.00 ! 57  
assign (resid  46 and name    HN ) ( resid  45 and name   HA2 )  2.50  1.00  1.00 ! 48  
assign (resid  46 and name    HN ) ( resid  45 and name    HN )  2.50  1.00  1.00 ! 48  
assign (resid  40 and name    HN ) ( resid  39 and name   HB1 )  2.50  1.00  1.00 ! 38  
assign (resid  40 and name    HN ) ( resid  41 and name  HG1# )  3.70  1.00  2.00 ! 38  
assign (resid  40 and name    HN ) ( resid  39 and name    HA )  2.50  1.00  1.00 ! 38  
assign (resid  40 and name    HN ) ( resid  39 and name    HN )  3.70  1.00  1.00 ! 38  
assign (resid  40 and name    HN ) ( resid  41 and name    HN )  2.50  1.00  1.00 ! 38  
assign (resid  40 and name    HN ) ( resid  38 and name    HN )  5.00  1.00  1.00 ! 38  
assign (resid  40 and name    HN ) ( resid  37 and name    HA )  2.50  1.00  1.00 ! 38  
assign (resid  74 and name    HN ) ( resid  73 and name    HA )  2.50  1.00  1.00 ! 5   
assign (resid  74 and name    HN ) ( resid  73 and name   HB1 )  3.70  1.00  1.00 ! 5   
assign (resid  74 and name    HN ) ( resid  73 and name   HB2 )  3.70  1.00  1.00 ! 5   
assign (resid  80 and name    HN ) ( resid  79 and name    HA )  2.50  1.00  1.00 ! 88  
assign (resid  80 and name    HN ) ( resid  65 and name   HB2 )  5.00  1.00  1.00 ! 88  
assign (resid  80 and name    HN ) ( resid  81 and name    HN )  5.00  1.00  1.00 ! 88  
assign (resid  80 and name    HN ) ( resid  65 and name   HB1 )  5.00  1.00  1.00 ! 88  
assign (resid  80 and name    HN ) ( resid  79 and name  HG2# )  3.70  1.00  2.00 ! 88  
assign (resid  80 and name    HN ) ( resid  65 and name    HA )  3.70  1.00  1.00 ! 88  
assign (resid  80 and name    HN ) ( resid  79 and name    HN )  3.70  1.00  1.00 ! 88  
assign (resid  80 and name    HN ) ( resid  78 and name    HA )  3.70  1.00  1.00 ! 88  
assign (resid  80 and name    HN ) ( resid  79 and name    HB )  5.00  1.00  1.00 ! 88  
assign (resid  15 and name    HN ) ( resid  19 and name   HB2 )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  14 and name   HB1 )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  19 and name    HN )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  24 and name    HZ )  5.00  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  14 and name    HA )  2.50  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  14 and name   HB2 )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  18 and name   HB2 )  5.00  1.00  1.00 ! 77  
assign (resid  44 and name    HN ) ( resid  43 and name   HG1 )  3.70  1.00  1.00 ! 68  
assign (resid  44 and name    HN ) ( resid  43 and name   HB1 )  3.70  1.00  1.00 ! 68  
assign (resid  44 and name    HN ) ( resid  43 and name    HA )  3.70  1.00  1.00 ! 68  
assign (resid  44 and name    HN ) ( resid  45 and name    HN )  5.00  1.00  1.00 ! 68  
assign (resid  39 and name    HN ) ( resid  40 and name    HN )  2.50  1.00  1.00 ! 60  
assign (resid  39 and name    HN ) ( resid  38 and name  HD2# )  3.70  1.00  2.00 ! 60  
assign (resid  39 and name    HN ) ( resid  36 and name    HA )  2.50  1.00  1.00 ! 60  
assign (resid  39 and name    HN ) ( resid  38 and name   HB2 )  2.50  1.00  1.00 ! 60  
assign (resid  39 and name    HN ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 60  
assign (resid  41 and name    HN ) ( resid  38 and name    HN )  5.00  1.00  1.00 ! 52  
assign (resid  41 and name    HN ) ( resid  38 and name    HA )  5.00  1.00  1.00 ! 52  
assign (resid  41 and name    HN ) ( resid  42 and name    HN )  2.50  1.00  1.00 ! 52  
assign (resid  30 and name    HN ) ( resid  29 and name    HA )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name    HN ) ( resid  29 and name   HB2 )  2.50  1.00  1.00 ! 43  
assign (resid  30 and name    HN ) ( resid  29 and name   HG1 )  2.50  1.00  1.00 ! 43  
assign (resid  30 and name    HN ) ( resid  28 and name   HB1 )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name    HN ) ( resid  31 and name    HN )  5.00  1.00  1.00 ! 43  
assign (resid  51 and name    HN ) ( resid  50 and name    HA )  3.70  1.00  1.00 ! 21  
assign (resid  67 and name    HN ) ( resid  66 and name   HB1 )  3.70  1.00  1.00 ! 80  
assign (resid  67 and name    HN ) ( resid  75 and name  HG1# )  5.00  1.00  2.00 ! 80  
assign (resid  67 and name    HN ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 80  
assign (resid  67 and name    HN ) ( resid  66 and name    HA )  3.70  1.00  1.00 ! 80  
assign (resid  67 and name    HN ) ( resid  66 and name    HN )  3.70  1.00  1.00 ! 80  
assign (resid  67 and name    HN ) ( resid  80 and name  HD1# )  5.00  1.00  2.00 ! 80  
assign (resid  38 and name    HN ) ( resid  35 and name    HA )  2.50  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  41 and name    HN )  5.00  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name    HA )  2.50  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name   HB1 )  2.50  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name   HB2 )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name   HE3 )  5.00  1.00  1.00 ! 71  
assign (resid  72 and name    HN ) ( resid  75 and name    HN )  5.00  1.00  1.00 ! 63  
assign (resid  72 and name    HN ) ( resid  75 and name    HB )  3.70  1.00  1.00 ! 63  
assign (resid  72 and name    HN ) ( resid  71 and name    HA )  2.50  1.00  1.00 ! 63  
assign (resid  72 and name    HN ) ( resid  71 and name   HG2 )  3.70  1.00  1.00 ! 63  
assign (resid  72 and name    HN ) ( resid  75 and name  HG2# )  5.00  1.00  2.00 ! 63  
assign (resid  72 and name    HN ) ( resid  71 and name   HB1 )  3.70  1.00  1.00 ! 63  
assign (resid  47 and name    HN ) ( resid  46 and name    HA )  3.70  1.00  1.00 ! 55  
assign (resid  47 and name    HN ) ( resid  46 and name  HG1# )  5.00  1.00  2.00 ! 55  
assign (resid  47 and name    HN ) ( resid  46 and name  HG2# )  5.00  1.00  2.00 ! 55  
assign (resid  35 and name    HN ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  34 and name   HD2 )  2.50  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  36 and name    HN )  2.50  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  34 and name    HA )  2.50  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  33 and name    HA )  3.70  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  37 and name    HN )  5.00  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  34 and name    HN )  2.50  1.00  1.00 ! 46  
assign (resid  22 and name    HN ) ( resid  19 and name   HB2 )  3.70  1.00  1.00 ! 34  
assign (resid  22 and name    HN ) ( resid  19 and name    HA )  5.00  1.00  1.00 ! 34  
assign (resid  22 and name    HN ) ( resid  21 and name    HA )  3.70  1.00  1.00 ! 34  
assign (resid  22 and name    HN ) ( resid  21 and name   HB# )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name    HN ) ( resid  20 and name    HN )  5.00  1.00  1.00 ! 34  
assign (resid  22 and name    HN ) ( resid  21 and name    HN )  2.50  1.00  1.00 ! 34  
assign (resid  22 and name    HN ) ( resid  23 and name    HN )  5.00  1.00  1.00 ! 34  
assign (resid  22 and name    HN ) ( resid  19 and name   HB1 )  3.70  1.00  1.00 ! 34  
assign (resid  65 and name    HN ) ( resid  64 and name    HA )  3.70  1.00  1.00 ! 24  
assign (resid  65 and name    HN ) ( resid  64 and name  HG2# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name    HN ) ( resid  64 and name  HG1# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name    HN ) ( resid  66 and name   HD# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name    HN ) ( resid  64 and name    HN )  2.50  1.00  1.00 ! 24  
assign (resid  65 and name    HN ) ( resid  66 and name    HN )  3.70  1.00  1.00 ! 24  
assign (resid  15 and name  HD21 ) ( resid  18 and name   HB1 )  3.70  1.00  1.00 ! 77  
assign (resid  69 and name    HN ) ( resid  70 and name    HN )  5.00  1.00  1.00 ! 3   
assign (resid  69 and name    HN ) ( resid  68 and name    HN )  5.00  1.00  1.00 ! 3   
assign (resid  31 and name    HN ) ( resid  30 and name    HN )  5.00  1.00  1.00 ! 86  
assign (resid  31 and name    HN ) ( resid  30 and name    HA )  2.50  1.00  1.00 ! 86  
assign (resid  31 and name    HN ) ( resid  30 and name   HB1 )  5.00  1.00  1.00 ! 86  
assign (resid  31 and name    HN ) ( resid  30 and name   HB2 )  5.00  1.00  1.00 ! 86  
assign (resid  31 and name    HN ) ( resid  32 and name    HN )  3.70  1.00  1.00 ! 86  
assign (resid  68 and name    HN ) ( resid  67 and name    HA )  3.70  1.00  1.00 ! 74  
assign (resid  68 and name    HN ) ( resid  69 and name    HN )  5.00  1.00  1.00 ! 74  
assign (resid  54 and name    HN ) ( resid  53 and name    HA )  2.50  1.00  1.00 ! 66  
assign (resid  54 and name    HN ) ( resid  53 and name   HB1 )  3.70  1.00  1.00 ! 66  
assign (resid  54 and name    HN ) ( resid  53 and name   HD# )  3.70  1.00  2.00 ! 66  
assign (resid  54 and name    HN ) ( resid  53 and name   HB2 )  5.00  1.00  1.00 ! 66  
assign (resid  17 and name    HN ) ( resid  16 and name    HN )  3.70  1.00  1.00 ! 58  
assign (resid  17 and name    HN ) ( resid  18 and name   HD2 )  5.00  1.00  1.00 ! 58  
assign (resid  17 and name    HN ) ( resid  16 and name    HA )  3.70  1.00  1.00 ! 58  
assign (resid  64 and name    HN ) ( resid  63 and name    HN )  2.50  1.00  1.00 ! 49  
assign (resid  64 and name    HN ) ( resid  65 and name    HN )  2.50  1.00  1.00 ! 49  
assign (resid  64 and name    HN ) ( resid  63 and name    HA )  3.70  1.00  1.00 ! 49  
assign (resid  66 and name    HN ) ( resid  65 and name   HB1 )  5.00  1.00  1.00 ! 41  
assign (resid  66 and name    HN ) ( resid  64 and name    HA )  3.70  1.00  1.00 ! 41  
assign (resid  66 and name    HN ) ( resid  67 and name    HN )  3.70  1.00  1.00 ! 41  
assign (resid  66 and name    HN ) ( resid  65 and name    HN )  2.50  1.00  1.00 ! 41  
assign (resid  66 and name    HN ) ( resid  65 and name    HA )  3.70  1.00  1.00 ! 41  
assign (resid  66 and name    HN ) ( resid  80 and name  HG2# )  3.70  1.00  2.00 ! 41  
assign (resid  20 and name    HN ) ( resid  19 and name    HA )  2.50  1.00  1.00 ! 39  
assign (resid  20 and name    HN ) ( resid  22 and name    HN )  5.00  1.00  1.00 ! 39  
assign (resid  20 and name    HN ) ( resid  21 and name    HN )  3.70  1.00  1.00 ! 39  
assign (resid  20 and name    HN ) ( resid  19 and name   HB1 )  3.70  1.00  1.00 ! 39  
assign (resid  15 and name  HD22 ) ( resid  18 and name   HB1 )  3.70  1.00  1.00 ! 77  
assign (resid  42 and name    HN ) ( resid  43 and name    HN )  3.70  1.00  1.00 ! 17  
assign (resid  42 and name    HN ) ( resid  41 and name    HB )  3.70  1.00  1.00 ! 17  
assign (resid  42 and name    HN ) ( resid  41 and name    HA )  3.70  1.00  1.00 ! 17  
assign (resid  42 and name    HN ) ( resid  41 and name  HG1# )  3.70  1.00  2.00 ! 17  
assign (resid  42 and name    HN ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 17  
assign (resid  42 and name    HN ) ( resid  41 and name  HG2# )  3.70  1.00  2.00 ! 17  
assign (resid  79 and name    HN ) ( resid  80 and name    HN )  3.70  1.00  1.00 ! 9   
assign (resid  79 and name    HN ) ( resid  78 and name    HA )  3.70  1.00  1.00 ! 9   
assign (resid  61 and name    HN ) ( resid  60 and name    HA )  2.50  1.00  1.00 ! 78  
assign (resid  61 and name    HN ) ( resid  60 and name   HB2 )  2.50  1.00  1.00 ! 78  
assign (resid  61 and name    HN ) ( resid  62 and name    HN )  5.00  1.00  1.00 ! 78  
assign (resid  32 and name    HN ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 53  
assign (resid  32 and name    HN ) ( resid  31 and name   HB# )  2.50  1.00  2.00 ! 53  
assign (resid  32 and name    HN ) ( resid  30 and name   HB2 )  5.00  1.00  1.00 ! 53  
assign (resid  32 and name    HN ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  59 and name    HN ) ( resid  60 and name    HN )  5.00  1.00  1.00 ! 44  
assign (resid  59 and name    HN ) ( resid  58 and name   HA1 )  3.70  1.00  1.00 ! 44  
assign (resid  59 and name    HN ) ( resid  58 and name   HA2 )  3.70  1.00  1.00 ! 44  
assign (resid  40 and name  HD21 ) ( resid  79 and name    HA )  3.70  1.00  1.00 ! 38  
assign (resid  26 and name    HN ) ( resid  25 and name   HD# )  3.70  1.00  2.00 ! 128 
assign (resid  26 and name    HN ) ( resid  25 and name    HN )  5.00  1.00  1.00 ! 128 
assign (resid  26 and name    HN ) ( resid  25 and name   HB2 )  3.70  1.00  1.00 ! 128 
assign (resid  26 and name    HN ) ( resid  25 and name   HB1 )  3.70  1.00  1.00 ! 128 
assign (resid  26 and name    HN ) ( resid  25 and name    HA )  2.50  1.00  1.00 ! 128 
assign (resid  45 and name    HN ) ( resid  46 and name    HN )  3.70  1.00  1.00 ! 1   
assign (resid  45 and name    HN ) ( resid  44 and name    HN )  5.00  1.00  1.00 ! 1   
assign (resid  45 and name    HN ) ( resid  44 and name    HA )  3.70  1.00  1.00 ! 1   
assign (resid  45 and name    HN ) ( resid  44 and name   HB# )  5.00  1.00  2.00 ! 1   
assign (resid  62 and name    HN ) ( resid  61 and name   HB2 )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name    HN ) ( resid  61 and name    HA )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name    HN ) ( resid  61 and name   HB1 )  3.70  1.00  1.00 ! 83  
assign (resid  37 and name    HN ) ( resid  36 and name    HN )  2.50  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name  HD2# )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name    HG )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  39 and name    HN )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name   HB1 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name   HB2 )  3.70  1.00  1.00 ! 72  
assign (resid  34 and name    HN ) ( resid  33 and name    HN )  2.50  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  33 and name  HD2# )  2.50  1.00  2.00 ! 64  
assign (resid  34 and name    HN ) ( resid  36 and name    HN )  5.00  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  32 and name    HA )  2.50  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  35 and name    HN )  2.50  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  28 and name   HG2 )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  33 and name   HB1 )  2.50  1.00  1.00 ! 64  
assign (resid  21 and name    HN ) ( resid  19 and name    HA )  3.70  1.00  1.00 ! 56  
assign (resid  21 and name    HN ) ( resid  20 and name   HG1 )  3.70  1.00  1.00 ! 56  
assign (resid  21 and name    HN ) ( resid  22 and name    HN )  2.50  1.00  1.00 ! 56  
assign (resid  21 and name    HN ) ( resid  20 and name    HN )  3.70  1.00  1.00 ! 56  
assign (resid  21 and name    HN ) ( resid  20 and name    HA )  3.70  1.00  1.00 ! 56  
assign (resid  21 and name    HN ) ( resid  20 and name   HB2 )  3.70  1.00  1.00 ! 56  
assign (resid  23 and name    HN ) ( resid  63 and name    HN )  3.70  1.00  1.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name   HB1 )  2.50  1.00  1.00 ! 47  
assign (resid  23 and name    HN ) ( resid  24 and name   HD# )  5.00  1.00  2.00 ! 47  
assign (resid  23 and name    HN ) ( resid  24 and name    HN )  5.00  1.00  1.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name    HA )  2.50  1.00  1.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name    HN )  5.00  1.00  1.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name  HD1# )  3.70  1.00  2.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name   HB2 )  3.70  1.00  1.00 ! 47  
assign (resid  77 and name    HN ) ( resid  75 and name    HA )  3.70  1.00  1.00 ! 37  
assign (resid  77 and name    HN ) ( resid  75 and name  HG1# )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name    HN ) ( resid  76 and name    HN )  2.50  1.00  1.00 ! 37  
assign (resid  77 and name    HN ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name    HN ) ( resid  76 and name    HA )  3.70  1.00  1.00 ! 37  
assign (resid  77 and name    HN ) ( resid  76 and name   HB2 )  3.70  1.00  1.00 ! 37  
assign (resid  77 and name    HN ) ( resid  76 and name   HG2 )  5.00  1.00  1.00 ! 37  
assign (resid  40 and name  HD22 ) ( resid  79 and name    HA )  5.00  1.00  1.00 ! 38  
assign (resid  17 and name   HB2 ) ( resid  18 and name    HN )  3.70  1.00  1.00 ! 58  
assign (resid  29 and name    HA ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 170 
assign (resid  38 and name    HA ) ( resid  39 and name    HN )  5.00  1.00  1.00 ! 71  
assign (resid  38 and name    HA ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 71  
assign (resid  71 and name   HD1 ) ( resid  37 and name   HZ2 )  2.50  1.00  1.00 ! 67  
assign (resid  71 and name   HD1 ) ( resid  37 and name   HH2 )  3.70  1.00  1.00 ! 67  
assign (resid  21 and name    HA ) ( resid  22 and name    HN )  3.70  1.00  1.00 ! 56  
assign (resid  30 and name    HA ) ( resid  31 and name    HN )  2.50  1.00  1.00 ! 43  
assign (resid  30 and name    HA ) ( resid  32 and name    HN )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name    HA ) ( resid  31 and name   HB# )  3.70  1.00  2.00 ! 43  
assign (resid  42 and name   HB1 ) ( resid  16 and name   HB2 )  3.70  1.00  1.00 ! 17  
assign (resid  67 and name    HN ) ( resid  80 and name  HD1# )  3.70  1.00  2.00 ! 80  
assign (resid  67 and name    HN ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 80  
assign (resid  67 and name    HN ) ( resid  66 and name    HA )  3.70  1.00  1.00 ! 80  
assign (resid  38 and name    HN ) ( resid  36 and name    HA )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name   HB1 )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name   HB2 )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  37 and name    HN )  2.50  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  34 and name    HA )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  35 and name    HA )  3.70  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  36 and name    HN )  5.00  1.00  1.00 ! 71  
assign (resid  38 and name    HN ) ( resid  39 and name    HN )  3.70  1.00  1.00 ! 71  
assign (resid  72 and name    HN ) ( resid  71 and name    HA )  2.50  1.00  1.00 ! 63  
assign (resid  72 and name    HN ) ( resid  75 and name    HN )  3.70  1.00  1.00 ! 63  
assign (resid  72 and name    HN ) ( resid  75 and name    HB )  3.70  1.00  1.00 ! 63  
assign (resid  72 and name    HN ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 63  
assign (resid  47 and name    HN ) ( resid  46 and name  HG2# )  3.70  1.00  2.00 ! 55  
assign (resid  47 and name   HB2 ) ( resid  48 and name    HN )  3.70  1.00  1.00 ! 55  
assign (resid  35 and name    HN ) ( resid  34 and name    HN )  2.50  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  34 and name    HA )  3.70  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  34 and name   HB1 )  3.70  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  32 and name    HA )  2.50  1.00  1.00 ! 46  
assign (resid  35 and name    HN ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 46  
assign (resid  77 and name  HG2# ) ( resid  37 and name   HD1 )  2.50  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  78 and name   HD2 )  2.50  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  37 and name   HE1 )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name  HG2# ) ( resid  36 and name   HB2 )  3.70  1.00  2.00 ! 37  
assign (resid  22 and name    HN ) ( resid  21 and name    HA )  3.70  1.00  1.00 ! 34  
assign (resid  22 and name    HN ) ( resid  21 and name   HB# )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name    HN ) ( resid  21 and name    HN )  3.70  1.00  1.00 ! 34  
assign (resid  22 and name    HN ) ( resid  19 and name   HB2 )  3.70  1.00  1.00 ! 34  
assign (resid  65 and name    HN ) ( resid  64 and name  HG1# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name    HN ) ( resid  64 and name    HN )  2.50  1.00  1.00 ! 24  
assign (resid  65 and name    HN ) ( resid  66 and name    HN )  3.70  1.00  1.00 ! 24  
assign (resid  65 and name    HN ) ( resid  64 and name    HA )  3.70  1.00  1.00 ! 24  
assign (resid  65 and name    HN ) ( resid  64 and name  HG2# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name    HN ) ( resid  66 and name   HD# )  3.70  1.00  2.00 ! 24  
assign (resid  36 and name    HA ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  39 and name   HB2 )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HA ) ( resid  39 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  32 and name   HG1 ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  39 and name   HB1 ) ( resid  40 and name    HN )  3.70  1.00  1.00 ! 60  
assign (resid  80 and name  HG2# ) ( resid  81 and name    HN )  3.70  1.00  2.00 ! 88  
assign (resid  37 and name   HD1 ) ( resid  38 and name    HN )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  77 and name  HG2# )  2.50  1.00  3.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  36 and name    HA )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  33 and name    HG )  5.00  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  78 and name   HD2 )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  36 and name   HB1 )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  36 and name   HB2 )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  34 and name    HA )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  33 and name  HD1# )  2.50  1.00  3.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  77 and name    HA )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  36 and name    HN )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  77 and name  HG1# )  2.50  1.00  3.00 ! 72  
assign (resid  37 and name   HD1 ) ( resid  36 and name  HD2# )  3.70  1.00  3.00 ! 72  
assign (resid   9 and name  HG2# ) ( resid  81 and name   HE# )  3.70  1.00  3.00 ! 85  
assign (resid   9 and name  HG2# ) ( resid  10 and name   HD1 )  3.70  1.00  2.00 ! 85  
assign (resid   9 and name  HG2# ) ( resid  10 and name   HD2 )  3.70  1.00  2.00 ! 85  
assign (resid   9 and name  HG2# ) ( resid  65 and name   HE1 )  2.50  1.00  2.00 ! 85  
assign (resid   9 and name  HG2# ) ( resid  81 and name   HD# )  2.50  1.00  3.00 ! 85  
assign (resid  21 and name   HB# ) ( resid  22 and name    HN )  3.70  1.00  2.00 ! 56  
assign (resid  30 and name   HB1 ) ( resid  31 and name    HN )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name   HB1 ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 43  
assign (resid  81 and name    HN ) ( resid  80 and name  HG2# )  3.70  1.00  2.00 ! 308 
assign (resid  81 and name    HN ) ( resid  80 and name    HA )  2.50  1.00  1.00 ! 308 
assign (resid  33 and name  HD2# ) ( resid  37 and name   HD1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  37 and name   HE1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  34 and name    HN )  5.00  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  37 and name   HZ2 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  76 and name   HB1 )  5.00  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  76 and name   HD2 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD2# ) ( resid  28 and name   HB1 )  3.70  1.00  2.00 ! 59  
assign (resid  26 and name    HB ) ( resid  27 and name    HN )  2.50  1.00  1.00 ! 128 
assign (resid  67 and name    HA ) ( resid  68 and name    HN )  3.70  1.00  1.00 ! 80  
assign (resid  67 and name    HA ) ( resid  80 and name  HD1# )  2.50  1.00  2.00 ! 80  
assign (resid  41 and name    HB ) ( resid  42 and name    HN )  3.70  1.00  1.00 ! 52  
assign (resid  64 and name  HG1# ) ( resid  65 and name    HN )  3.70  1.00  2.00 ! 49  
assign (resid  64 and name  HG1# ) ( resid  14 and name  HD22 )  3.70  1.00  2.00 ! 49  
assign (resid  24 and name   HE# ) ( resid  62 and name   HB2 )  5.00  1.00  3.00 ! 54  
assign (resid  24 and name   HE# ) ( resid  14 and name   HB1 )  5.00  1.00  3.00 ! 54  
assign (resid  24 and name   HE# ) ( resid  22 and name  HD2# )  3.70  1.00  4.00 ! 54  
assign (resid  24 and name   HE# ) ( resid  62 and name   HB1 )  3.70  1.00  3.00 ! 54  
assign (resid  24 and name   HE# ) ( resid  16 and name    HA )  2.50  1.00  3.00 ! 54  
assign (resid  60 and name   HB1 ) ( resid  61 and name    HN )  3.70  1.00  1.00 ! 75  
assign (resid  60 and name   HB1 ) ( resid  24 and name   HD# )  3.70  1.00  2.00 ! 75  
assign (resid  52 and name    HA ) ( resid  53 and name    HN )  3.70  1.00  1.00 ! 18  
assign (resid  28 and name   HB2 ) ( resid  33 and name  HD2# )  5.00  1.00  2.00 ! 281 
assign (resid  28 and name   HB2 ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HB2 ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HB2 ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 281 
assign (resid  25 and name   HB2 ) ( resid  37 and name   HH2 )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name   HB2 ) ( resid  26 and name    HN )  3.70  1.00  1.00 ! 79  
assign (resid  38 and name   HB2 ) ( resid  39 and name    HN )  2.50  1.00  1.00 ! 71  
assign (resid  17 and name    HA ) ( resid  18 and name    HN )  3.70  1.00  1.00 ! 58  
assign (resid  45 and name   HA2 ) ( resid  46 and name    HN )  2.50  1.00  1.00 ! 1   
assign (resid  16 and name   HB2 ) ( resid  42 and name   HB1 )  3.70  1.00  1.00 ! 70  
assign (resid  30 and name   HB2 ) ( resid  28 and name   HB2 )  5.00  1.00  1.00 ! 43  
assign (resid  30 and name   HB2 ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 43  
assign (resid  31 and name    HN ) ( resid  30 and name    HA )  2.50  1.00  1.00 ! 86  
assign (resid  31 and name    HN ) ( resid  30 and name   HB1 )  5.00  1.00  1.00 ! 86  
assign (resid  31 and name    HN ) ( resid  32 and name    HN )  3.70  1.00  1.00 ! 86  
assign (resid  31 and name    HN ) ( resid  30 and name    HN )  5.00  1.00  1.00 ! 86  
assign (resid  68 and name    HN ) ( resid  67 and name    HA )  3.70  1.00  1.00 ! 74  
assign (resid  54 and name    HN ) ( resid  53 and name    HA )  3.70  1.00  1.00 ! 66  
assign (resid  81 and name   HE# ) ( resid   9 and name  HG2# )  3.70  1.00  4.00 ! 308 
assign (resid  81 and name   HE# ) ( resid  61 and name  HD2# )  3.70  1.00  4.00 ! 308 
assign (resid  81 and name   HE# ) ( resid  41 and name  HG1# )  3.70  1.00  4.00 ! 308 
assign (resid  81 and name   HE# ) ( resid  40 and name   HB1 )  3.70  1.00  3.00 ! 308 
assign (resid  81 and name   HE# ) ( resid  78 and name   HB1 )  3.70  1.00  3.00 ! 308 
assign (resid  81 and name   HE# ) ( resid  40 and name   HB2 )  3.70  1.00  3.00 ! 308 
assign (resid  81 and name   HE# ) ( resid   9 and name  HG1# )  5.00  1.00  4.00 ! 308 
assign (resid  17 and name    HN ) ( resid  18 and name    HN )  2.50  1.00  1.00 ! 58  
assign (resid  17 and name    HN ) ( resid  16 and name    HN )  3.70  1.00  1.00 ! 58  
assign (resid  17 and name    HN ) ( resid  19 and name    HN )  5.00  1.00  1.00 ! 58  
assign (resid  17 and name    HN ) ( resid  16 and name    HA )  3.70  1.00  1.00 ! 58  
assign (resid  64 and name    HN ) ( resid  65 and name    HN )  2.50  1.00  1.00 ! 49  
assign (resid  64 and name    HN ) ( resid  63 and name    HN )  2.50  1.00  1.00 ! 49  
assign (resid  14 and name    HA ) ( resid  15 and name    HN )  2.50  1.00  1.00 ! 104 
assign (resid  66 and name    HN ) ( resid  65 and name    HN )  3.70  1.00  1.00 ! 41  
assign (resid  66 and name    HN ) ( resid  64 and name    HA )  3.70  1.00  1.00 ! 41  
assign (resid  66 and name    HN ) ( resid  63 and name    HA )  5.00  1.00  1.00 ! 41  
assign (resid  20 and name    HN ) ( resid  21 and name    HN )  3.70  1.00  1.00 ! 39  
assign (resid  20 and name    HN ) ( resid  19 and name    HN )  3.70  1.00  1.00 ! 39  
assign (resid  73 and name   HD# ) ( resid  74 and name  HG2# )  3.70  1.00  4.00 ! 7   
assign (resid  38 and name    HG ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 71  
assign (resid  22 and name   HB1 ) ( resid  23 and name    HN )  3.70  1.00  1.00 ! 34  
assign (resid  74 and name  HG2# ) ( resid  73 and name   HD# )  2.50  1.00  3.00 ! 5   
assign (resid  74 and name  HG2# ) ( resid  75 and name    HN )  5.00  1.00  2.00 ! 5   
assign (resid  70 and name   HB2 ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 31  
assign (resid  55 and name   HD1 ) ( resid  54 and name   HG1 )  3.70  1.00  1.00 ! 282 
assign (resid  55 and name   HD1 ) ( resid  54 and name    HA )  2.50  1.00  1.00 ! 282 
assign (resid  29 and name   HB1 ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 170 
assign (resid  25 and name   HB1 ) ( resid  37 and name   HH2 )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name   HB1 ) ( resid  26 and name    HN )  3.70  1.00  1.00 ! 79  
assign (resid  37 and name    HA ) ( resid  78 and name   HD2 )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name    HA ) ( resid  40 and name   HB1 )  3.70  1.00  1.00 ! 72  
assign (resid  71 and name   HD2 ) ( resid  37 and name   HZ2 )  3.70  1.00  1.00 ! 67  
assign (resid  33 and name    HA ) ( resid  36 and name   HB1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HA ) ( resid  36 and name   HB2 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HA ) ( resid  34 and name    HN )  2.50  1.00  1.00 ! 59  
assign (resid  33 and name    HA ) ( resid  36 and name    HN )  2.50  1.00  1.00 ! 59  
assign (resid  79 and name  HG2# ) ( resid  40 and name  HD21 )  2.50  1.00  2.00 ! 9   
assign (resid  79 and name  HG2# ) ( resid  40 and name  HD22 )  3.70  1.00  2.00 ! 9   
assign (resid  59 and name   HB1 ) ( resid  60 and name    HN )  3.70  1.00  1.00 ! 44  
assign (resid  59 and name   HB1 ) ( resid  27 and name   HE# )  5.00  1.00  2.00 ! 44  
assign (resid  59 and name   HB1 ) ( resid  27 and name   HD# )  5.00  1.00  2.00 ! 44  
assign (resid  63 and name   HB1 ) ( resid  25 and name   HE# )  5.00  1.00  2.00 ! 4   
assign (resid  22 and name    HG ) ( resid  19 and name   HB1 )  3.70  1.00  1.00 ! 34  
assign (resid  22 and name    HG ) ( resid  19 and name   HB2 )  3.70  1.00  1.00 ! 34  
assign (resid  33 and name    HG ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HG ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 59  
assign (resid  42 and name    HN ) ( resid  41 and name    HB )  5.00  1.00  1.00 ! 17  
assign (resid  42 and name    HN ) ( resid  41 and name  HG1# )  3.70  1.00  2.00 ! 17  
assign (resid  42 and name    HN ) ( resid  41 and name  HG2# )  3.70  1.00  2.00 ! 17  
assign (resid  42 and name    HN ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 17  
assign (resid  37 and name   HZ3 ) ( resid  61 and name  HD2# )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HZ3 ) ( resid  61 and name   HB1 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HZ3 ) ( resid  27 and name    HA )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HZ3 ) ( resid  61 and name   HB2 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HZ3 ) ( resid  27 and name   HE# )  5.00  1.00  2.00 ! 72  
assign (resid  37 and name   HZ3 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 72  
assign (resid  79 and name    HN ) ( resid  78 and name    HA )  3.70  1.00  1.00 ! 9   
assign (resid  79 and name    HN ) ( resid  80 and name    HN )  3.70  1.00  1.00 ! 9   
assign (resid  18 and name    HN ) ( resid  17 and name   HB2 )  3.70  1.00  1.00 ! 129 
assign (resid  18 and name    HN ) ( resid  17 and name    HA )  3.70  1.00  1.00 ! 129 
assign (resid  18 and name    HN ) ( resid  17 and name    HN )  2.50  1.00  1.00 ! 129 
assign (resid  18 and name    HN ) ( resid  19 and name    HN )  2.50  1.00  1.00 ! 129 
assign (resid  18 and name    HN ) ( resid  17 and name   HB1 )  3.70  1.00  1.00 ! 129 
assign (resid  80 and name  HD1# ) ( resid  67 and name    HN )  5.00  1.00  2.00 ! 88  
assign (resid  80 and name  HD1# ) ( resid  67 and name    HA )  2.50  1.00  2.00 ! 88  
assign (resid  39 and name    HA ) ( resid  40 and name    HN )  3.70  1.00  1.00 ! 60  
assign (resid  62 and name   HB2 ) ( resid  24 and name   HE# )  3.70  1.00  2.00 ! 83  
assign (resid  62 and name   HB2 ) ( resid  63 and name    HN )  3.70  1.00  1.00 ! 83  
assign (resid  78 and name   HD2 ) ( resid  77 and name  HG2# )  3.70  1.00  2.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  37 and name    HA )  5.00  1.00  1.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  37 and name   HE1 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  77 and name    HA )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  66 and name   HE# )  3.70  1.00  2.00 ! 263 
assign (resid  78 and name   HD2 ) ( resid  66 and name    HZ )  5.00  1.00  1.00 ! 263 
assign (resid  25 and name    HA ) ( resid  26 and name    HN )  2.50  1.00  1.00 ! 79  
assign (resid  37 and name   HB1 ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HB1 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 72  
assign (resid  33 and name   HB1 ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 59  
assign (resid  59 and name   HB2 ) ( resid  60 and name    HN )  5.00  1.00  1.00 ! 44  
assign (resid  59 and name   HB2 ) ( resid  27 and name   HE# )  5.00  1.00  2.00 ! 44  
assign (resid  59 and name   HB2 ) ( resid  27 and name   HD# )  5.00  1.00  2.00 ! 44  
assign (resid  61 and name    HN ) ( resid  60 and name   HB1 )  3.70  1.00  1.00 ! 78  
assign (resid  61 and name    HN ) ( resid  60 and name    HA )  2.50  1.00  1.00 ! 78  
assign (resid  61 and name    HN ) ( resid  60 and name    HN )  5.00  1.00  1.00 ! 78  
assign (resid  61 and name    HN ) ( resid  25 and name    HN )  3.70  1.00  1.00 ! 78  
assign (resid  32 and name    HN ) ( resid  30 and name    HA )  5.00  1.00  1.00 ! 53  
assign (resid  32 and name    HN ) ( resid  31 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  32 and name    HN ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  32 and name    HN ) ( resid  33 and name    HN )  2.50  1.00  1.00 ! 53  
assign (resid  32 and name    HN ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 53  
assign (resid  32 and name    HN ) ( resid  31 and name   HB# )  2.50  1.00  2.00 ! 53  
assign (resid  14 and name   HB1 ) ( resid  24 and name   HE# )  5.00  1.00  2.00 ! 104 
assign (resid  14 and name   HB1 ) ( resid  24 and name    HZ )  3.70  1.00  1.00 ! 104 
assign (resid  14 and name   HB1 ) ( resid  15 and name    HN )  3.70  1.00  1.00 ! 104 
assign (resid  61 and name  HD2# ) ( resid  37 and name   HZ3 )  2.50  1.00  2.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  41 and name  HG1# )  2.50  1.00  3.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  27 and name   HE# )  3.70  1.00  3.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  27 and name    HZ )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  66 and name    HZ )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  37 and name   HH2 )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  27 and name   HD# )  3.70  1.00  3.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  37 and name   HE3 )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD2# ) ( resid  65 and name   HD2 )  3.70  1.00  2.00 ! 78  
assign (resid  37 and name   HE1 ) ( resid  77 and name  HG2# )  3.70  1.00  3.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  33 and name  HD2# )  3.70  1.00  3.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  78 and name   HD2 )  5.00  1.00  2.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  33 and name  HD1# )  3.70  1.00  3.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  77 and name    HA )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HE1 ) ( resid  77 and name  HG1# )  3.70  1.00  3.00 ! 72  
assign (resid  26 and name  HG2# ) ( resid  27 and name    HN )  3.70  1.00  2.00 ! 128 
assign (resid  26 and name  HG2# ) ( resid  24 and name   HB1 )  3.70  1.00  2.00 ! 128 
assign (resid  53 and name   HD# ) ( resid  41 and name  HG1# )  5.00  1.00  4.00 ! 65  
assign (resid  53 and name   HD# ) ( resid  38 and name  HD1# )  3.70  1.00  4.00 ! 65  
assign (resid  41 and name  HG1# ) ( resid  81 and name   HE# )  3.70  1.00  3.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  42 and name    HN )  3.70  1.00  2.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  61 and name  HD2# )  2.50  1.00  3.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  53 and name   HD# )  3.70  1.00  3.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  61 and name  HD1# )  3.70  1.00  3.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  27 and name    HZ )  3.70  1.00  2.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  27 and name   HD# )  3.70  1.00  3.00 ! 52  
assign (resid  41 and name  HG1# ) ( resid  53 and name    HZ )  5.00  1.00  2.00 ! 52  
assign (resid  14 and name  HD22 ) ( resid  64 and name  HG1# )  3.70  1.00  2.00 ! 104 
assign (resid  14 and name  HD22 ) ( resid  64 and name  HG2# )  2.50  1.00  2.00 ! 104 
assign (resid  24 and name   HD# ) ( resid  60 and name   HB1 )  3.70  1.00  3.00 ! 54  
assign (resid  24 and name   HD# ) ( resid  16 and name    HA )  3.70  1.00  3.00 ! 54  
assign (resid   4 and name   HA2 ) ( resid   5 and name    HN )  2.50  1.00  1.00 ! 2   
assign (resid  61 and name    HA ) ( resid  62 and name    HN )  3.70  1.00  1.00 ! 78  
assign (resid  78 and name    HA ) ( resid  79 and name    HN )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name    HA ) ( resid  66 and name    HA )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name    HA ) ( resid  80 and name    HN )  3.70  1.00  1.00 ! 263 
assign (resid  37 and name   HB2 ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HB2 ) ( resid  27 and name   HD# )  2.50  1.00  2.00 ! 72  
assign (resid  33 and name   HB2 ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 59  
assign (resid  36 and name   HB1 ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name   HB1 ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name   HB1 ) ( resid  77 and name  HG1# )  3.70  1.00  2.00 ! 45  
assign (resid  16 and name   HB1 ) ( resid   5 and name    HN )  3.70  1.00  1.00 ! 70  
assign (resid  16 and name   HB1 ) ( resid  42 and name   HB2 )  3.70  1.00  1.00 ! 70  
assign (resid  34 and name   HG1 ) ( resid  27 and name   HE# )  3.70  1.00  2.00 ! 64  
assign (resid  24 and name    HZ ) ( resid  14 and name   HB1 )  3.70  1.00  1.00 ! 54  
assign (resid  24 and name    HZ ) ( resid  22 and name  HD2# )  3.70  1.00  2.00 ! 54  
assign (resid  24 and name    HZ ) ( resid  15 and name    HN )  3.70  1.00  1.00 ! 54  
assign (resid  24 and name    HZ ) ( resid  16 and name    HA )  3.70  1.00  1.00 ! 54  
assign (resid  61 and name  HD1# ) ( resid  81 and name   HE# )  2.50  1.00  3.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  37 and name   HZ3 )  2.50  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  41 and name  HG1# )  3.70  1.00  3.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  27 and name   HE# )  5.00  1.00  3.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  81 and name   HD# )  5.00  1.00  3.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  66 and name    HZ )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  37 and name   HH2 )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  37 and name   HE3 )  3.70  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  65 and name   HD2 )  2.50  1.00  2.00 ! 78  
assign (resid  61 and name  HD1# ) ( resid  66 and name   HD# )  3.70  1.00  3.00 ! 78  
assign (resid  38 and name  HD2# ) ( resid  55 and name   HD1 )  3.70  1.00  2.00 ! 71  
assign (resid  38 and name  HD2# ) ( resid  53 and name   HD# )  3.70  1.00  3.00 ! 71  
assign (resid  38 and name  HD2# ) ( resid  35 and name    HA )  2.50  1.00  2.00 ! 71  
assign (resid  66 and name   HB1 ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 41  
assign (resid   4 and name   HA1 ) ( resid   5 and name    HN )  2.50  1.00  1.00 ! 2   
assign (resid  71 and name    HA ) ( resid  72 and name    HN )  2.50  1.00  1.00 ! 67  
assign (resid  71 and name    HA ) ( resid  75 and name    HB )  5.00  1.00  1.00 ! 67  
assign (resid  71 and name    HA ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 67  
assign (resid  71 and name    HA ) ( resid  66 and name   HD# )  3.70  1.00  2.00 ! 67  
assign (resid  55 and name   HD2 ) ( resid  54 and name    HA )  3.70  1.00  1.00 ! 282 
assign (resid  29 and name   HB2 ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 170 
assign (resid  23 and name   HB2 ) ( resid  24 and name    HN )  5.00  1.00  1.00 ! 47  
assign (resid  23 and name   HB2 ) ( resid  25 and name   HE# )  3.70  1.00  2.00 ! 47  
assign (resid  10 and name   HD2 ) ( resid   9 and name  HG2# )  3.70  1.00  2.00 ! 278 
assign (resid  61 and name   HB1 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 78  
assign (resid  27 and name    HA ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HA ) ( resid  28 and name   HD2 )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HA ) ( resid  28 and name   HD1 )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HA ) ( resid  37 and name   HE3 )  5.00  1.00  1.00 ! 73  
assign (resid  23 and name    HA ) ( resid  24 and name    HN )  2.50  1.00  1.00 ! 47  
assign (resid  36 and name   HB2 ) ( resid  77 and name  HG2# )  3.70  1.00  2.00 ! 45  
assign (resid  36 and name   HB2 ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name   HB2 ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name   HB2 ) ( resid  77 and name  HG1# )  2.50  1.00  2.00 ! 45  
assign (resid  63 and name   HB2 ) ( resid  25 and name   HE# )  3.70  1.00  2.00 ! 4   
assign (resid  62 and name    HN ) ( resid  61 and name    HA )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name    HN ) ( resid  65 and name   HD2 )  3.70  1.00  1.00 ! 83  
assign (resid  37 and name    HN ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name    HA )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name   HB1 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name   HB2 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  34 and name    HA )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name    HN )  2.50  1.00  1.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name  HD1# )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name  HD2# )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name    HN ) ( resid  36 and name    HG )  5.00  1.00  1.00 ! 72  
assign (resid  34 and name    HN ) ( resid  35 and name    HN )  2.50  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  33 and name  HD2# )  3.70  1.00  2.00 ! 64  
assign (resid  34 and name    HN ) ( resid  33 and name    HG )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  32 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  28 and name   HG2 )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  33 and name    HN )  2.50  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  33 and name  HD1# )  3.70  1.00  2.00 ! 64  
assign (resid  34 and name    HN ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HN ) ( resid  32 and name   HB2 )  5.00  1.00  1.00 ! 64  
assign (resid  21 and name    HN ) ( resid  22 and name    HN )  3.70  1.00  1.00 ! 56  
assign (resid  21 and name    HN ) ( resid  20 and name    HN )  3.70  1.00  1.00 ! 56  
assign (resid  23 and name    HN ) ( resid  22 and name   HB1 )  3.70  1.00  1.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name  HD2# )  5.00  1.00  2.00 ! 47  
assign (resid  23 and name    HN ) ( resid  63 and name    HN )  3.70  1.00  1.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name  HD1# )  3.70  1.00  2.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name    HA )  3.70  1.00  1.00 ! 47  
assign (resid  23 and name    HN ) ( resid  22 and name   HB2 )  3.70  1.00  1.00 ! 47  
assign (resid  40 and name   HB1 ) ( resid  81 and name   HE# )  3.70  1.00  2.00 ! 38  
assign (resid  40 and name   HB1 ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 38  
assign (resid  22 and name  HD2# ) ( resid  24 and name    HZ )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  23 and name    HN )  3.70  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  19 and name   HB1 )  2.50  1.00  2.00 ! 34  
assign (resid  22 and name  HD2# ) ( resid  19 and name   HB2 )  3.70  1.00  2.00 ! 34  
assign (resid  77 and name    HN ) ( resid  75 and name    HA )  3.70  1.00  1.00 ! 37  
assign (resid  77 and name    HN ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name    HN ) ( resid  76 and name    HN )  2.50  1.00  1.00 ! 37  
assign (resid  67 and name   HB2 ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 80  
assign (resid  64 and name    HA ) ( resid  65 and name    HN )  3.70  1.00  1.00 ! 49  
assign (resid  64 and name    HA ) ( resid  66 and name    HN )  3.70  1.00  1.00 ! 49  
assign (resid  34 and name    HA ) ( resid  35 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  28 and name   HD2 )  3.70  1.00  1.00 ! 64  
assign (resid  41 and name    HA ) ( resid  42 and name    HN )  3.70  1.00  1.00 ! 52  
assign (resid  70 and name    HA ) ( resid  71 and name    HN )  3.70  1.00  1.00 ! 31  
assign (resid  62 and name   HB1 ) ( resid  24 and name   HE# )  3.70  1.00  2.00 ! 83  
assign (resid  55 and name   HB1 ) ( resid  27 and name   HE# )  5.00  1.00  2.00 ! 282 
assign (resid  55 and name   HB1 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 282 
assign (resid  18 and name    HA ) ( resid  19 and name    HN )  3.70  1.00  1.00 ! 129 
assign (resid  60 and name    HA ) ( resid  61 and name    HN )  3.70  1.00  1.00 ! 75  
assign (resid  61 and name   HB2 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 78  
assign (resid  78 and name   HD1 ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  37 and name   HE1 )  3.70  1.00  1.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  66 and name   HE# )  3.70  1.00  2.00 ! 263 
assign (resid  78 and name   HD1 ) ( resid  66 and name    HZ )  3.70  1.00  1.00 ! 263 
assign (resid  46 and name    HA ) ( resid  47 and name    HN )  3.70  1.00  1.00 ! 48  
assign (resid  73 and name    HA ) ( resid  74 and name    HN )  3.70  1.00  1.00 ! 7   
assign (resid  35 and name    HA ) ( resid  38 and name    HN )  3.70  1.00  1.00 ! 46  
assign (resid  35 and name    HA ) ( resid  38 and name   HB1 )  5.00  1.00  1.00 ! 46  
assign (resid  35 and name    HA ) ( resid  38 and name  HD2# )  2.50  1.00  2.00 ! 46  
assign (resid  32 and name   HB1 ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  26 and name    HA ) ( resid  60 and name    HA )  3.70  1.00  1.00 ! 128 
assign (resid  26 and name    HA ) ( resid  27 and name    HN )  2.50  1.00  1.00 ! 128 
assign (resid  63 and name    HN ) ( resid  64 and name    HN )  2.50  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  62 and name   HB2 )  3.70  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  23 and name    HN )  3.70  1.00  1.00 ! 4   
assign (resid  63 and name    HN ) ( resid  62 and name   HB1 )  3.70  1.00  1.00 ! 4   
assign (resid  41 and name  HG2# ) ( resid  42 and name    HN )  3.70  1.00  2.00 ! 52  
assign (resid  41 and name  HG2# ) ( resid  27 and name    HZ )  5.00  1.00  2.00 ! 52  
assign (resid  46 and name  HG1# ) ( resid  47 and name    HN )  5.00  1.00  2.00 ! 48  
assign (resid  25 and name   HD# ) ( resid  66 and name   HE# )  2.50  1.00  4.00 ! 79  
assign (resid  25 and name   HD# ) ( resid  66 and name    HZ )  3.70  1.00  3.00 ! 79  
assign (resid  25 and name   HD# ) ( resid  26 and name    HN )  3.70  1.00  3.00 ! 79  
assign (resid  25 and name   HD# ) ( resid  63 and name    HA )  3.70  1.00  3.00 ! 79  
assign (resid  25 and name   HD# ) ( resid  66 and name   HD# )  2.50  1.00  4.00 ! 79  
assign (resid  70 and name   HB1 ) ( resid  72 and name  HG2# )  5.00  1.00  2.00 ! 31  
assign (resid  28 and name   HG2 ) ( resid  34 and name    HN )  5.00  1.00  1.00 ! 281 
assign (resid  28 and name   HG2 ) ( resid  34 and name    HA )  3.70  1.00  1.00 ! 281 
assign (resid  79 and name    HA ) ( resid  81 and name   HE# )  3.70  1.00  2.00 ! 9   
assign (resid  79 and name    HA ) ( resid  40 and name  HD21 )  3.70  1.00  1.00 ! 9   
assign (resid  79 and name    HA ) ( resid  80 and name    HN )  2.50  1.00  1.00 ! 9   
assign (resid  62 and name    HA ) ( resid  63 and name    HN )  2.50  1.00  1.00 ! 83  
assign (resid  62 and name    HA ) ( resid  25 and name    HN )  3.70  1.00  1.00 ! 83  
assign (resid  62 and name    HA ) ( resid  24 and name    HA )  3.70  1.00  1.00 ! 83  
assign (resid  78 and name   HB1 ) ( resid  81 and name   HE# )  3.70  1.00  2.00 ! 263 
assign (resid  78 and name   HB1 ) ( resid  81 and name    HZ )  5.00  1.00  1.00 ! 263 
assign (resid  76 and name   HD1 ) ( resid  33 and name  HD2# )  5.00  1.00  2.00 ! 57  
assign (resid  35 and name   HB1 ) ( resid  36 and name    HN )  5.00  1.00  1.00 ! 46  
assign (resid  34 and name   HG2 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 64  
assign (resid  75 and name    HN ) ( resid  72 and name    HN )  5.00  1.00  1.00 ! 87  
assign (resid  75 and name    HN ) ( resid  74 and name  HG2# )  5.00  1.00  2.00 ! 87  
assign (resid  75 and name    HN ) ( resid  76 and name    HN )  5.00  1.00  1.00 ! 87  
assign (resid  75 and name    HN ) ( resid  74 and name    HB )  3.70  1.00  1.00 ! 87  
assign (resid  60 and name    HN ) ( resid  59 and name   HB1 )  3.70  1.00  1.00 ! 75  
assign (resid  60 and name    HN ) ( resid  59 and name   HB2 )  5.00  1.00  1.00 ! 75  
assign (resid  71 and name    HN ) ( resid  70 and name    HA )  3.70  1.00  1.00 ! 67  
assign (resid  33 and name    HN ) ( resid  32 and name   HG1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  30 and name   HB1 )  5.00  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  30 and name   HB2 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  32 and name   HG2 )  5.00  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  32 and name    HN )  2.50  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  34 and name    HN )  2.50  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  32 and name   HB1 )  3.70  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  32 and name    HA )  5.00  1.00  1.00 ! 59  
assign (resid  33 and name    HN ) ( resid  32 and name   HB2 )  3.70  1.00  1.00 ! 59  
assign (resid   5 and name    HN ) ( resid   4 and name   HA2 )  3.70  1.00  1.00 ! 51  
assign (resid   5 and name    HN ) ( resid   4 and name   HA1 )  2.50  1.00  1.00 ! 51  
assign (resid   5 and name    HN ) ( resid  16 and name    HN )  3.70  1.00  1.00 ! 51  
assign (resid  43 and name    HN ) ( resid  42 and name    HN )  5.00  1.00  1.00 ! 42  
assign (resid  19 and name   HB1 ) ( resid  22 and name    HN )  5.00  1.00  1.00 ! 62  
assign (resid  19 and name   HB1 ) ( resid  20 and name    HN )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name   HB1 ) ( resid  22 and name    HG )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name   HB1 ) ( resid  22 and name  HD2# )  3.70  1.00  2.00 ! 62  
assign (resid  38 and name  HD1# ) ( resid  55 and name   HD1 )  5.00  1.00  2.00 ! 71  
assign (resid  38 and name  HD1# ) ( resid  53 and name   HD# )  3.70  1.00  3.00 ! 71  
assign (resid  38 and name  HD1# ) ( resid  27 and name    HZ )  3.70  1.00  2.00 ! 71  
assign (resid  38 and name  HD1# ) ( resid  27 and name   HD# )  3.70  1.00  3.00 ! 71  
assign (resid  40 and name  HD21 ) ( resid  79 and name  HG2# )  2.50  1.00  2.00 ! 38  
assign (resid  40 and name  HD21 ) ( resid  79 and name    HA )  5.00  1.00  1.00 ! 38  
assign (resid  33 and name  HD1# ) ( resid  37 and name   HD1 )  2.50  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  37 and name   HE1 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  34 and name    HN )  5.00  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  76 and name   HB1 )  5.00  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  76 and name   HD2 )  3.70  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  28 and name   HB1 )  3.70  1.00  2.00 ! 59  
assign (resid   3 and name    HA ) ( resid   4 and name    HN )  3.70  1.00  1.00 ! 262 
assign (resid  75 and name    HA ) ( resid  77 and name    HN )  3.70  1.00  1.00 ! 87  
assign (resid  75 and name    HA ) ( resid  76 and name    HN )  2.50  1.00  1.00 ! 87  
assign (resid  19 and name    HA ) ( resid  20 and name    HN )  2.50  1.00  1.00 ! 62  
assign (resid  35 and name   HB2 ) ( resid  32 and name    HA )  3.70  1.00  1.00 ! 46  
assign (resid  81 and name    HZ ) ( resid  78 and name   HB1 )  3.70  1.00  1.00 ! 308 
assign (resid  40 and name   HB2 ) ( resid  81 and name   HE# )  5.00  1.00  2.00 ! 38  
assign (resid  22 and name  HD1# ) ( resid  23 and name    HN )  3.70  1.00  2.00 ! 34  
assign (resid  27 and name   HE# ) ( resid  38 and name    HG )  3.70  1.00  3.00 ! 73  
assign (resid  27 and name   HE# ) ( resid  37 and name   HZ3 )  5.00  1.00  3.00 ! 73  
assign (resid  27 and name   HE# ) ( resid  61 and name  HD2# )  3.70  1.00  4.00 ! 73  
assign (resid  27 and name   HE# ) ( resid  61 and name  HD1# )  5.00  1.00  4.00 ! 73  
assign (resid  27 and name   HE# ) ( resid  55 and name   HB1 )  5.00  1.00  3.00 ! 73  
assign (resid  27 and name   HE# ) ( resid  38 and name  HD1# )  2.50  1.00  4.00 ! 73  
assign (resid  27 and name   HE# ) ( resid  55 and name   HB2 )  5.00  1.00  3.00 ! 73  
assign (resid  27 and name   HE# ) ( resid  37 and name   HE3 )  3.70  1.00  3.00 ! 73  
assign (resid  67 and name   HB1 ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 80  
assign (resid  22 and name    HA ) ( resid  23 and name    HN )  2.50  1.00  1.00 ! 34  
assign (resid  34 and name   HB1 ) ( resid  35 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name   HB1 ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 64  
assign (resid  42 and name    HA ) ( resid  43 and name    HN )  5.00  1.00  1.00 ! 17  
assign (resid  64 and name    HB ) ( resid  65 and name    HN )  3.70  1.00  1.00 ! 49  
assign (resid  55 and name   HB2 ) ( resid  27 and name   HE# )  5.00  1.00  2.00 ! 282 
assign (resid  55 and name   HB2 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 282 
assign (resid  75 and name    HB ) ( resid  72 and name    HN )  3.70  1.00  1.00 ! 87  
assign (resid  75 and name    HB ) ( resid  71 and name    HA )  5.00  1.00  1.00 ! 87  
assign (resid  75 and name    HB ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 87  
assign (resid  71 and name   HG1 ) ( resid  72 and name    HN )  5.00  1.00  1.00 ! 67  
assign (resid  53 and name    HA ) ( resid  54 and name    HN )  2.50  1.00  1.00 ! 65  
assign (resid  23 and name   HB1 ) ( resid  24 and name    HN )  3.70  1.00  1.00 ! 47  
assign (resid  23 and name   HB1 ) ( resid  25 and name   HE# )  3.70  1.00  2.00 ! 47  
assign (resid  77 and name    HA ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 37  
assign (resid  77 and name    HA ) ( resid  78 and name   HD2 )  3.70  1.00  1.00 ! 37  
assign (resid  77 and name    HA ) ( resid  37 and name   HE1 )  2.50  1.00  1.00 ! 37  
assign (resid  25 and name    HN ) ( resid  61 and name    HN )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name    HN ) ( resid  24 and name    HA )  3.70  1.00  1.00 ! 79  
assign (resid  16 and name    HN ) ( resid  17 and name    HN )  3.70  1.00  1.00 ! 70  
assign (resid  16 and name    HN ) ( resid   5 and name    HN )  3.70  1.00  1.00 ! 70  
assign (resid  16 and name    HN ) ( resid  15 and name    HA )  3.70  1.00  1.00 ! 70  
assign (resid  19 and name    HN ) ( resid  17 and name    HN )  5.00  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  18 and name    HN )  2.50  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  18 and name    HA )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  18 and name   HB2 )  5.00  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  18 and name   HB1 )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name    HN ) ( resid  15 and name    HN )  3.70  1.00  1.00 ! 62  
assign (resid  24 and name    HN ) ( resid  23 and name   HB2 )  5.00  1.00  1.00 ! 54  
assign (resid  24 and name    HN ) ( resid  23 and name    HA )  3.70  1.00  1.00 ! 54  
assign (resid  24 and name    HN ) ( resid  23 and name   HB1 )  3.70  1.00  1.00 ! 54  
assign (resid  36 and name    HN ) ( resid  35 and name    HN )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  37 and name   HD1 )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  37 and name    HN )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  34 and name    HN )  2.50  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  35 and name    HA )  3.70  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  35 and name   HB1 )  5.00  1.00  1.00 ! 45  
assign (resid  36 and name    HN ) ( resid  35 and name   HB2 )  3.70  1.00  1.00 ! 45  
assign (resid  40 and name    HA ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 38  
assign (resid  66 and name   HE# ) ( resid  78 and name   HD2 )  5.00  1.00  3.00 ! 41  
assign (resid  66 and name   HE# ) ( resid  61 and name  HD1# )  2.50  1.00  4.00 ! 41  
assign (resid  66 and name   HE# ) ( resid  25 and name   HD# )  2.50  1.00  4.00 ! 41  
assign (resid  66 and name   HE# ) ( resid  37 and name   HZ2 )  2.50  1.00  3.00 ! 41  
assign (resid  66 and name   HE# ) ( resid  25 and name   HE# )  3.70  1.00  4.00 ! 41  
assign (resid  66 and name   HE# ) ( resid  75 and name  HG2# )  3.70  1.00  4.00 ! 41  
assign (resid  66 and name   HE# ) ( resid  63 and name    HA )  3.70  1.00  3.00 ! 41  
assign (resid  37 and name   HZ2 ) ( resid  71 and name   HD1 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HZ2 ) ( resid  71 and name   HD2 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HZ2 ) ( resid  66 and name   HE# )  3.70  1.00  2.00 ! 72  
assign (resid  37 and name   HZ2 ) ( resid  66 and name    HZ )  3.70  1.00  1.00 ! 72  
assign (resid  76 and name   HB1 ) ( resid  33 and name  HD2# )  3.70  1.00  2.00 ! 57  
assign (resid  76 and name   HB1 ) ( resid  77 and name    HN )  3.70  1.00  1.00 ! 57  
assign (resid  76 and name   HB1 ) ( resid  33 and name  HD1# )  3.70  1.00  2.00 ! 57  
assign (resid  76 and name    HA ) ( resid  77 and name    HN )  3.70  1.00  1.00 ! 57  
assign (resid   9 and name  HG1# ) ( resid  81 and name   HE# )  3.70  1.00  3.00 ! 85  
assign (resid   9 and name  HG1# ) ( resid  65 and name   HE1 )  3.70  1.00  2.00 ! 85  
assign (resid   9 and name  HG1# ) ( resid  81 and name   HD# )  3.70  1.00  3.00 ! 85  
assign (resid   9 and name  HG1# ) ( resid  65 and name   HD2 )  5.00  1.00  2.00 ! 85  
assign (resid  25 and name   HE# ) ( resid  23 and name   HB2 )  3.70  1.00  3.00 ! 79  
assign (resid  25 and name   HE# ) ( resid  23 and name   HB1 )  3.70  1.00  3.00 ! 79  
assign (resid  25 and name   HE# ) ( resid  66 and name   HE# )  3.70  1.00  4.00 ! 79  
assign (resid  25 and name   HE# ) ( resid  63 and name    HA )  2.50  1.00  3.00 ! 79  
assign (resid  25 and name   HE# ) ( resid  66 and name   HD# )  3.70  1.00  4.00 ! 79  
assign (resid  28 and name   HD2 ) ( resid  27 and name    HA )  2.50  1.00  1.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  34 and name    HA )  3.70  1.00  1.00 ! 281 
assign (resid  28 and name   HD2 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 281 
assign (resid  75 and name  HG1# ) ( resid  76 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG1# ) ( resid  74 and name    HB )  2.50  1.00  2.00 ! 87  
assign (resid  76 and name   HD2 ) ( resid  33 and name  HD2# )  3.70  1.00  2.00 ! 57  
assign (resid  76 and name   HD2 ) ( resid  33 and name  HD1# )  3.70  1.00  2.00 ! 57  
assign (resid  19 and name   HB2 ) ( resid  22 and name    HN )  3.70  1.00  1.00 ! 62  
assign (resid  19 and name   HB2 ) ( resid  22 and name  HD2# )  3.70  1.00  2.00 ! 62  
assign (resid  19 and name   HB2 ) ( resid  15 and name    HN )  3.70  1.00  1.00 ! 62  
assign (resid  36 and name  HD1# ) ( resid  32 and name   HG1 )  2.50  1.00  2.00 ! 45  
assign (resid  36 and name  HD1# ) ( resid  37 and name    HN )  3.70  1.00  2.00 ! 45  
assign (resid  50 and name    HA ) ( resid  51 and name    HN )  5.00  1.00  1.00 ! 61  
assign (resid  15 and name    HA ) ( resid  24 and name   HE# )  5.00  1.00  2.00 ! 77  
assign (resid  15 and name    HA ) ( resid  24 and name    HZ )  5.00  1.00  1.00 ! 77  
assign (resid  15 and name    HA ) ( resid  16 and name    HN )  3.70  1.00  1.00 ! 77  
assign (resid  58 and name   HA1 ) ( resid  59 and name    HN )  3.70  1.00  1.00 ! 294 
assign (resid  75 and name  HG2# ) ( resid  67 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  72 and name    HN )  5.00  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  66 and name   HB1 )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  71 and name    HA )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  77 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  67 and name   HB2 )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  66 and name   HE# )  3.70  1.00  3.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  76 and name    HN )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  66 and name   HB2 )  3.70  1.00  2.00 ! 87  
assign (resid  75 and name  HG2# ) ( resid  66 and name   HD# )  2.50  1.00  3.00 ! 87  
assign (resid  32 and name    HA ) ( resid  35 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  32 and name    HA ) ( resid  34 and name    HN )  2.50  1.00  1.00 ! 53  
assign (resid  32 and name    HA ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  32 and name    HA ) ( resid  36 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  77 and name  HG1# ) ( resid  37 and name   HD1 )  2.50  1.00  2.00 ! 37  
assign (resid  77 and name  HG1# ) ( resid  37 and name   HE1 )  3.70  1.00  2.00 ! 37  
assign (resid  77 and name  HG1# ) ( resid  36 and name   HB1 )  2.50  1.00  2.00 ! 37  
assign (resid  77 and name  HG1# ) ( resid  36 and name   HB2 )  2.50  1.00  2.00 ! 37  
assign (resid  70 and name   HG2 ) ( resid  72 and name  HG2# )  3.70  1.00  2.00 ! 31  
assign (resid  27 and name    HN ) ( resid  26 and name    HB )  3.70  1.00  1.00 ! 73  
assign (resid  27 and name    HN ) ( resid  26 and name  HG2# )  3.70  1.00  2.00 ! 73  
assign (resid  53 and name    HN ) ( resid  52 and name    HA )  2.50  1.00  1.00 ! 65  
assign (resid  53 and name    HN ) ( resid  54 and name    HN )  3.70  1.00  1.00 ! 65  
assign (resid  76 and name    HN ) ( resid  77 and name    HN )  2.50  1.00  1.00 ! 57  
assign (resid  76 and name    HN ) ( resid  75 and name    HN )  5.00  1.00  1.00 ! 57  
assign (resid  76 and name    HN ) ( resid  75 and name    HA )  2.50  1.00  1.00 ! 57  
assign (resid  76 and name    HN ) ( resid  75 and name  HG1# )  3.70  1.00  2.00 ! 57  
assign (resid  76 and name    HN ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 57  
assign (resid  46 and name    HN ) ( resid  45 and name   HA2 )  2.50  1.00  1.00 ! 48  
assign (resid  46 and name    HN ) ( resid  45 and name   HA1 )  2.50  1.00  1.00 ! 48  
assign (resid  40 and name    HN ) ( resid  39 and name    HA )  3.70  1.00  1.00 ! 38  
assign (resid  40 and name    HN ) ( resid  39 and name   HB2 )  3.70  1.00  1.00 ! 38  
assign (resid  40 and name    HN ) ( resid  39 and name    HN )  3.70  1.00  1.00 ! 38  
assign (resid  40 and name    HN ) ( resid  41 and name    HN )  3.70  1.00  1.00 ! 38  
assign (resid  27 and name    HZ ) ( resid  61 and name  HD2# )  3.70  1.00  2.00 ! 73  
assign (resid  27 and name    HZ ) ( resid  41 and name  HG1# )  3.70  1.00  2.00 ! 73  
assign (resid  27 and name    HZ ) ( resid  41 and name  HG2# )  5.00  1.00  2.00 ! 73  
assign (resid  27 and name    HZ ) ( resid  38 and name  HD1# )  3.70  1.00  2.00 ! 73  
assign (resid  36 and name  HD2# ) ( resid  37 and name    HN )  5.00  1.00  2.00 ! 45  
assign (resid  64 and name  HG2# ) ( resid  65 and name    HN )  2.50  1.00  2.00 ! 49  
assign (resid  64 and name  HG2# ) ( resid  14 and name  HD22 )  3.70  1.00  2.00 ! 49  
assign (resid  64 and name  HG2# ) ( resid  65 and name   HE1 )  3.70  1.00  2.00 ! 49  
assign (resid  64 and name  HG2# ) ( resid  65 and name   HD2 )  3.70  1.00  2.00 ! 49  
assign (resid  65 and name   HE1 ) ( resid   9 and name  HG2# )  2.50  1.00  2.00 ! 24  
assign (resid  65 and name   HE1 ) ( resid  64 and name  HG2# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name    HA ) ( resid  80 and name  HG2# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name    HA ) ( resid  66 and name    HN )  3.70  1.00  1.00 ! 24  
assign (resid  65 and name    HA ) ( resid  80 and name    HB )  3.70  1.00  1.00 ! 24  
assign (resid  65 and name    HA ) ( resid  80 and name  HG11 )  5.00  1.00  1.00 ! 24  
assign (resid  65 and name    HA ) ( resid  80 and name    HN )  3.70  1.00  1.00 ! 24  
assign (resid  17 and name   HB1 ) ( resid  18 and name    HN )  3.70  1.00  1.00 ! 58  
assign (resid  18 and name   HB1 ) ( resid  19 and name    HN )  3.70  1.00  1.00 ! 129 
assign (resid  31 and name    HA ) ( resid  35 and name    HN )  3.70  1.00  1.00 ! 86  
assign (resid  31 and name    HA ) ( resid  32 and name    HN )  3.70  1.00  1.00 ! 86  
assign (resid  31 and name    HA ) ( resid  34 and name    HN )  3.70  1.00  1.00 ! 86  
assign (resid  31 and name    HA ) ( resid  34 and name   HB1 )  3.70  1.00  1.00 ! 86  
assign (resid  54 and name    HA ) ( resid  55 and name   HD1 )  2.50  1.00  1.00 ! 66  
assign (resid  54 and name    HA ) ( resid  55 and name   HD2 )  3.70  1.00  1.00 ! 66  
assign (resid  24 and name    HA ) ( resid  25 and name    HN )  2.50  1.00  1.00 ! 54  
assign (resid  66 and name    HA ) ( resid  67 and name    HN )  3.70  1.00  1.00 ! 41  
assign (resid  66 and name    HA ) ( resid  78 and name    HA )  3.70  1.00  1.00 ! 41  
assign (resid  42 and name   HB2 ) ( resid  16 and name   HB1 )  3.70  1.00  1.00 ! 17  
assign (resid  81 and name   HD# ) ( resid   9 and name  HG2# )  2.50  1.00  4.00 ! 308 
assign (resid  81 and name   HD# ) ( resid  61 and name  HD2# )  5.00  1.00  4.00 ! 308 
assign (resid  81 and name   HD# ) ( resid  41 and name  HG2# )  3.70  1.00  4.00 ! 308 
assign (resid  81 and name   HD# ) ( resid   9 and name  HG1# )  3.70  1.00  4.00 ! 308 
assign (resid  66 and name    HZ ) ( resid  61 and name  HD2# )  5.00  1.00  2.00 ! 41  
assign (resid  66 and name    HZ ) ( resid  61 and name  HD1# )  3.70  1.00  2.00 ! 41  
assign (resid  66 and name    HZ ) ( resid  25 and name   HD# )  3.70  1.00  2.00 ! 41  
assign (resid  66 and name    HZ ) ( resid  37 and name   HZ2 )  3.70  1.00  1.00 ! 41  
assign (resid  66 and name    HZ ) ( resid  37 and name   HH2 )  3.70  1.00  1.00 ! 41  
assign (resid  32 and name   HB2 ) ( resid  34 and name    HN )  5.00  1.00  1.00 ! 53  
assign (resid  32 and name   HB2 ) ( resid  33 and name    HN )  3.70  1.00  1.00 ! 53  
assign (resid  37 and name   HH2 ) ( resid  25 and name   HB2 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HH2 ) ( resid  25 and name   HB1 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HH2 ) ( resid  66 and name    HZ )  3.70  1.00  1.00 ! 72  
assign (resid  74 and name    HN ) ( resid  73 and name    HA )  3.70  1.00  1.00 ! 5   
assign (resid  26 and name    HN ) ( resid  25 and name   HB2 )  3.70  1.00  1.00 ! 128 
assign (resid  26 and name    HN ) ( resid  25 and name   HB1 )  3.70  1.00  1.00 ! 128 
assign (resid  26 and name    HN ) ( resid  25 and name    HA )  3.70  1.00  1.00 ! 128 
assign (resid  26 and name    HN ) ( resid  25 and name   HD# )  3.70  1.00  2.00 ! 128 
assign (resid  39 and name   HB2 ) ( resid  36 and name    HA )  2.50  1.00  1.00 ! 60  
assign (resid  39 and name   HB2 ) ( resid  40 and name    HN )  3.70  1.00  1.00 ! 60  
assign (resid  27 and name   HD# ) ( resid  38 and name    HG )  3.70  1.00  3.00 ! 73  
assign (resid  27 and name   HD# ) ( resid  37 and name   HZ3 )  3.70  1.00  3.00 ! 73  
assign (resid  27 and name   HD# ) ( resid  61 and name  HD2# )  5.00  1.00  4.00 ! 73  
assign (resid  27 and name   HD# ) ( resid  55 and name   HB1 )  3.70  1.00  3.00 ! 73  
assign (resid  27 and name   HD# ) ( resid  34 and name   HG2 )  3.70  1.00  3.00 ! 73  
assign (resid  27 and name   HD# ) ( resid  55 and name   HB2 )  3.70  1.00  3.00 ! 73  
assign (resid  27 and name   HD# ) ( resid  28 and name   HD2 )  3.70  1.00  3.00 ! 73  
assign (resid  27 and name   HD# ) ( resid  37 and name   HE3 )  3.70  1.00  3.00 ! 73  
assign (resid  28 and name   HD1 ) ( resid  27 and name    HA )  2.50  1.00  1.00 ! 281 
assign (resid  28 and name   HD1 ) ( resid  27 and name   HD# )  3.70  1.00  2.00 ! 281 
assign (resid  74 and name    HB ) ( resid  75 and name    HN )  3.70  1.00  1.00 ! 5   
assign (resid  74 and name    HB ) ( resid  75 and name  HG1# )  2.50  1.00  2.00 ! 5   
assign (resid  31 and name   HB# ) ( resid  30 and name    HA )  3.70  1.00  2.00 ! 86  
assign (resid  31 and name   HB# ) ( resid  32 and name    HN )  2.50  1.00  2.00 ! 86  
assign (resid  24 and name   HB1 ) ( resid  26 and name  HG2# )  3.70  1.00  2.00 ! 54  
assign (resid  63 and name    HA ) ( resid  65 and name    HN )  3.70  1.00  1.00 ! 4   
assign (resid  63 and name    HA ) ( resid  66 and name    HN )  5.00  1.00  1.00 ! 4   
assign (resid  63 and name    HA ) ( resid  25 and name   HD# )  3.70  1.00  2.00 ! 4   
assign (resid  63 and name    HA ) ( resid  66 and name   HE# )  3.70  1.00  2.00 ! 4   
assign (resid  63 and name    HA ) ( resid  25 and name   HE# )  2.50  1.00  2.00 ! 4   
assign (resid  63 and name    HA ) ( resid  66 and name   HD# )  2.50  1.00  2.00 ! 4   
assign (resid  66 and name   HB2 ) ( resid  75 and name  HG2# )  3.70  1.00  2.00 ! 41  
assign (resid  45 and name   HA1 ) ( resid  46 and name    HN )  2.50  1.00  1.00 ! 1   
assign (resid  80 and name    HN ) ( resid  79 and name    HN )  3.70  1.00  1.00 ! 88  
assign (resid  80 and name    HN ) ( resid  78 and name    HA )  3.70  1.00  1.00 ! 88  
assign (resid  15 and name    HN ) ( resid  14 and name    HA )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  14 and name   HB2 )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  14 and name   HB1 )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  24 and name    HZ )  3.70  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  19 and name    HN )  5.00  1.00  1.00 ! 77  
assign (resid  15 and name    HN ) ( resid  19 and name   HB2 )  3.70  1.00  1.00 ! 77  
assign (resid  44 and name    HN ) ( resid  43 and name    HN )  3.70  1.00  1.00 ! 68  
assign (resid  39 and name    HN ) ( resid  38 and name    HA )  3.70  1.00  1.00 ! 60  
assign (resid  39 and name    HN ) ( resid  38 and name    HN )  2.50  1.00  1.00 ! 60  
assign (resid  39 and name    HN ) ( resid  36 and name    HA )  3.70  1.00  1.00 ! 60  
assign (resid  39 and name    HN ) ( resid  38 and name   HB2 )  2.50  1.00  1.00 ! 60  
assign (resid  39 and name    HN ) ( resid  37 and name    HN )  5.00  1.00  1.00 ! 60  
assign (resid  39 and name    HN ) ( resid  38 and name  HD1# )  3.70  1.00  2.00 ! 60  
assign (resid  39 and name    HN ) ( resid  40 and name    HN )  3.70  1.00  1.00 ! 60  
assign (resid  41 and name    HN ) ( resid  38 and name    HA )  5.00  1.00  1.00 ! 52  
assign (resid  41 and name    HN ) ( resid  42 and name    HN )  3.70  1.00  1.00 ! 52  
assign (resid  41 and name    HN ) ( resid  40 and name   HB2 )  3.70  1.00  1.00 ! 52  
assign (resid  41 and name    HN ) ( resid  40 and name    HA )  3.70  1.00  1.00 ! 52  
assign (resid  41 and name    HN ) ( resid  40 and name    HN )  3.70  1.00  1.00 ! 52  
assign (resid  30 and name    HN ) ( resid  29 and name    HA )  3.70  1.00  1.00 ! 43  
assign (resid  30 and name    HN ) ( resid  31 and name    HN )  5.00  1.00  1.00 ! 43  
assign (resid  34 and name   HB2 ) ( resid  35 and name    HN )  3.70  1.00  1.00 ! 64  
assign (resid  34 and name   HB2 ) ( resid  31 and name    HA )  3.70  1.00  1.00 ! 64  
assign (resid  53 and name    HZ ) ( resid  41 and name  HG1# )  3.70  1.00  2.00 ! 65  
assign (resid  40 and name  HD22 ) ( resid  79 and name  HG2# )  2.50  1.00  2.00 ! 38  
assign (resid  74 and name    HA ) ( resid  75 and name    HN )  3.70  1.00  1.00 ! 5   
assign (resid  37 and name   HE3 ) ( resid  61 and name  HD2# )  3.70  1.00  3.00 ! 72  
assign (resid  37 and name   HE3 ) ( resid  61 and name  HD1# )  3.70  1.00  3.00 ! 72  
assign (resid  37 and name   HE3 ) ( resid  27 and name    HA )  5.00  1.00  2.00 ! 72  
assign (resid  37 and name   HE3 ) ( resid  27 and name   HD# )  2.50  1.00  3.00 ! 72  
assign (resid  58 and name   HA2 ) ( resid  59 and name    HN )  3.70  1.00  1.00 ! 294 
assign (resid  54 and name   HG2 ) ( resid  55 and name   HD1 )  3.70  1.00  1.00 ! 66  
assign (resid  28 and name   HB1 ) ( resid  33 and name  HD1# )  3.70  1.00  2.00 ! 281 
assign (resid  28 and name   HB1 ) ( resid  30 and name    HN )  3.70  1.00  1.00 ! 281 
assign (resid  16 and name    HA ) ( resid  24 and name   HE# )  2.50  1.00  2.00 ! 70  
assign (resid  16 and name    HA ) ( resid  17 and name    HN )  3.70  1.00  1.00 ! 70  
assign (resid  16 and name    HA ) ( resid  24 and name   HD# )  3.70  1.00  2.00 ! 70  
assign (resid  16 and name    HA ) ( resid  24 and name    HZ )  3.70  1.00  1.00 ! 70  
assign (resid  65 and name   HD2 ) ( resid  61 and name  HD2# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name   HD2 ) ( resid  61 and name    HA )  5.00  1.00  1.00 ! 24  
assign (resid  65 and name   HD2 ) ( resid  61 and name  HD1# )  3.70  1.00  2.00 ! 24  
assign (resid  65 and name   HD2 ) ( resid  62 and name    HN )  3.70  1.00  1.00 ! 24  
assign (resid  65 and name   HD2 ) ( resid   9 and name  HG1# )  5.00  1.00  2.00 ! 24  
assign (resid  65 and name   HD2 ) ( resid  64 and name  HG2# )  3.70  1.00  2.00 ! 24  
assign (resid  20 and name    HA ) ( resid  21 and name    HN )  3.70  1.00  1.00 ! 39  
assign (resid  36 and name    HG ) ( resid  37 and name    HN )  3.70  1.00  1.00 ! 45  
assign (resid  22 and name   HB2 ) ( resid  23 and name    HN )  3.70  1.00  1.00 ! 34  
assign (resid  72 and name  HG2# ) ( resid  70 and name   HB2 )  3.70  1.00  2.00 ! 63  
assign (resid  72 and name  HG2# ) ( resid  70 and name   HB1 )  3.70  1.00  2.00 ! 63  
assign (resid  72 and name  HG2# ) ( resid  75 and name    HB )  5.00  1.00  2.00 ! 63  
assign (resid  66 and name   HD# ) ( resid  65 and name    HN )  3.70  1.00  3.00 ! 41  
assign (resid  66 and name   HD# ) ( resid  61 and name  HD1# )  3.70  1.00  4.00 ! 41  
assign (resid  66 and name   HD# ) ( resid  71 and name    HA )  3.70  1.00  3.00 ! 41  
assign (resid  66 and name   HD# ) ( resid  25 and name   HD# )  2.50  1.00  4.00 ! 41  
assign (resid  66 and name   HD# ) ( resid  25 and name   HE# )  3.70  1.00  4.00 ! 41  
assign (resid  66 and name   HD# ) ( resid  75 and name  HG2# )  2.50  1.00  4.00 ! 41  
assign (resid  22 and name   HB2 ) ( resid  24 and name   HD# )  3.70  1.00  2.00 ! 34
assign (resid  22 and name   HB2 ) ( resid  24 and name    HZ )  3.70  1.00  1.00 ! 34
assign (resid  70 and name    HA ) ( resid  25 and name   HE# )  3.70  1.00  2.00 ! 31
assign (resid  25 and name   HE# ) ( resid  70 and name    HA )  5.00  1.00  3.00 ! 79
assign (resid  57 and name  HG2# ) ( resid  59 and name   HE1 )  2.50  1.00  1.00 ! 305
assign (resid  59 and name   HE1 ) ( resid  57 and name  HG2# )  2.50  1.00  1.00 ! 44
assign (resid  27 and name   HE# ) ( resid  38 and name    HA )  5.00  1.00  3.00 ! 73
assign (resid  38 and name    HA ) ( resid  27 and name   HE# )  3.70  1.00  2.00 ! 71
assign (resid  55 and name    HA ) ( resid  59 and name   HE1 )  3.70  1.00  1.00 ! 282
assign (resid  59 and name   HE1 ) ( resid  55 and name    HA )  3.70  1.00  1.00 ! 44
assign (resid  59 and name    HA ) ( resid  60 and name    HN )  2.50  1.00  1.00 ! 44
assign (resid   5 and name    HA ) ( resid   6 and name    HN )  3.70  1.00  1.00 ! 51
assign (resid   7 and name    HA ) ( resid  61 and name    HA )  3.70  1.00  1.00 ! 306
assign (resid  59 and name   HD2 ) ( resid  60 and name    HN )  3.70  1.00  1.00 ! 44
assign (resid  60 and name    HN ) ( resid  59 and name   HD2 )  3.70  1.00  1.00 ! 75
assign (resid   9 and name  HG2# ) ( resid  13 and name    HA )  3.70  1.00  1.00 ! 85
assign (resid  13 and name    HA ) ( resid   9 and name  HG2# )  3.70  1.00  1.00 ! 307
assign (resid  40 and name  HD21 ) ( resid  77 and name  HG1# )  3.70  1.00  1.00 ! 38
assign (resid  77 and name  HG1# ) ( resid  40 and name  HD21 )  3.70  1.00  1.00 ! 37
assign (resid  40 and name  HD21 ) ( resid  77 and name  HG2# )  2.50  1.00  1.00 ! 38
assign (resid  77 and name  HG2# ) ( resid  40 and name  HD21 )  2.50  1.00  1.00 ! 37
assign (resid  77 and name  HG2# ) ( resid  40 and name  HD22 )  2.50  1.00  1.00 ! 37
assign (resid  40 and name  HD22 ) ( resid  77 and name  HG2# )  2.50  1.00  1.00 ! 38
assign (resid  41 and name    HN ) ( resid  39 and name   HB2 )  5.00  1.00  1.00 ! 52
assign (resid  41 and name    HN ) ( resid  39 and name   HB1 )  5.00  1.00  1.00 ! 52
assign (resid  39 and name   HB2 ) ( resid  41 and name    HN )  5.00  1.00  1.00 ! 60
assign (resid  39 and name   HB1 ) ( resid  41 and name    HN )  5.00  1.00  1.00 ! 60
assign (resid  77 and name  HG1# ) ( resid  76 and name    HN )  3.70  1.00  1.00 ! 37
assign (resid  76 and name    HN ) ( resid  77 and name  HG1# )  3.70  1.00  1.00 ! 57
assign (resid  24 and name    HA ) ( resid  63 and name    HN )  3.70  1.00  1.00 ! 54
assign (resid  66 and name   HD# ) ( resid  63 and name    HA )  2.50  1.00  3.00 ! 41  
assign (resid  66 and name   HE# ) ( resid  78 and name    HA )  5.00  1.00  3.00 ! 41  
assign (resid  78 and name    HA ) ( resid  66 and name   HD# )  5.00  1.00  2.00 ! 263 
assign (resid  78 and name    HA ) ( resid  66 and name   HE# )  5.00  1.00  2.00 ! 263 
assign (resid  25 and name   HD# ) ( resid  71 and name   HE2 )  5.00  1.00  3.00 ! 79  
assign (resid  25 and name   HD# ) ( resid  71 and name   HE1 )  5.00  1.00  3.00 ! 79  
assign (resid  71 and name   HE2 ) ( resid  25 and name   HD# )  5.00  1.00  2.00 ! 67  
assign (resid  37 and name   HH2 ) ( resid  71 and name   HE2 )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name   HH2 ) ( resid  71 and name   HE1 )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name   HZ2 ) ( resid  71 and name   HE2 )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name   HZ2 ) ( resid  71 and name   HE1 )  5.00  1.00  1.00 ! 72  
assign (resid  71 and name   HE2 ) ( resid  37 and name   HZ2 )  5.00  1.00  1.00 ! 67  
assign (resid  71 and name   HE1 ) ( resid  37 and name   HH2 )  5.00  1.00  1.00 ! 67  
assign (resid  71 and name   HE1 ) ( resid  37 and name   HZ2 )  5.00  1.00  1.00 ! 67  
assign (resid  81 and name   HD# ) ( resid  65 and name   HE1 )  5.00  1.00  3.00 ! 308 
assign (resid  65 and name   HE1 ) ( resid  81 and name   HD# )  5.00  1.00  2.00 ! 24  
assign (resid  81 and name   HE# ) ( resid  65 and name   HD2 )  5.00  1.00  3.00 ! 308 
assign (resid  65 and name   HD2 ) ( resid  81 and name   HE# )  5.00  1.00  2.00 ! 24  
assign (resid  62 and name   HB1 ) ( resid  65 and name   HE1 )  5.00  1.00  1.00 ! 83  
assign (resid  65 and name   HE1 ) ( resid  62 and name   HB1 )  5.00  1.00  1.00 ! 24  
assign (resid  24 and name   HD# ) ( resid  62 and name   HB2 )  5.00  1.00  3.00 ! 54  
assign (resid  62 and name   HB2 ) ( resid  24 and name   HD# )  5.00  1.00  2.00 ! 83  
assign (resid  25 and name   HB2 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 79  
assign (resid  23 and name   HB1 ) ( resid  25 and name   HD# )  5.00  1.00  2.00 ! 47  
assign (resid  25 and name   HB1 ) ( resid  37 and name   HZ3 )  3.70  1.00  1.00 ! 79  
assign (resid  25 and name   HD# ) ( resid  23 and name   HB2 )  5.00  1.00  3.00 ! 79  
assign (resid  37 and name   HZ3 ) ( resid  25 and name   HB2 )  3.70  1.00  1.00 ! 72  
assign (resid  37 and name   HZ3 ) ( resid  25 and name   HB1 )  3.70  1.00  1.00 ! 72  
assign (resid  23 and name   HB2 ) ( resid  25 and name   HD# )  5.00  1.00  2.00 ! 47  
assign (resid  24 and name   HE# ) ( resid  14 and name   HB2 )  5.00  1.00  3.00 ! 54  
assign (resid  24 and name    HZ ) ( resid  14 and name   HB2 )  5.00  1.00  1.00 ! 54  
assign (resid  14 and name   HB2 ) ( resid  24 and name   HE# )  5.00  1.00  2.00 ! 104 
assign (resid  14 and name   HB2 ) ( resid  24 and name    HZ )  5.00  1.00  1.00 ! 104 
assign (resid  19 and name   HB2 ) ( resid  24 and name    HZ )  5.00  1.00  1.00 ! 62  
assign (resid  19 and name   HB1 ) ( resid  24 and name    HZ )  5.00  1.00  1.00 ! 62  
assign (resid  24 and name    HZ ) ( resid  19 and name   HB2 )  5.00  1.00  1.00 ! 54  
assign (resid  24 and name    HZ ) ( resid  19 and name   HB1 )  5.00  1.00  1.00 ! 54  
assign (resid  60 and name   HB2 ) ( resid  24 and name   HD# )  5.00  1.00  2.00 ! 75  
assign (resid  24 and name   HD# ) ( resid  60 and name   HB2 )  5.00  1.00  3.00 ! 54  
assign (resid  78 and name   HB2 ) ( resid  81 and name   HE# )  5.00  1.00  2.00 ! 263 
assign (resid  78 and name   HB2 ) ( resid  81 and name    HZ )  5.00  1.00  1.00 ! 263 
assign (resid  81 and name   HE# ) ( resid  78 and name   HB2 )  5.00  1.00  3.00 ! 308 
assign (resid  71 and name   HB2 ) ( resid  25 and name   HE# )  5.00  1.00  2.00 ! 67  
assign (resid  61 and name  HD2# ) ( resid  25 and name   HD# )  5.00  1.00  3.00 ! 78  
assign (resid  25 and name   HD# ) ( resid  61 and name  HD2# )  5.00  1.00  4.00 ! 79  
assign (resid  25 and name   HD# ) ( resid  61 and name  HD1# )  5.00  1.00  4.00 ! 79  
assign (resid  25 and name   HE# ) ( resid  71 and name   HB2 )  5.00  1.00  3.00 ! 79  
assign (resid  25 and name   HE# ) ( resid  71 and name   HB1 )  5.00  1.00  3.00 ! 79  
assign (resid  71 and name   HB1 ) ( resid  25 and name   HE# )  5.00  1.00  2.00 ! 67  
assign (resid  61 and name  HD1# ) ( resid  25 and name   HD# )  5.00  1.00  3.00 ! 78  
assign (resid   8 and name   HB1 ) ( resid  59 and name   HD2 )  5.00  1.00  1.00 ! 303 
assign (resid  59 and name   HD2 ) ( resid   8 and name   HB2 )  5.00  1.00  1.00 ! 44  
assign (resid  59 and name   HD2 ) ( resid   8 and name   HB1 )  5.00  1.00  1.00 ! 44  
assign (resid   8 and name   HB1 ) ( resid  59 and name   HD2 )  5.00  1.00  1.00 ! 303 
assign (resid  25 and name   HE# ) ( resid  70 and name    HA )  5.00  1.00  3.00 ! 79  
assign (resid  70 and name    HA ) ( resid  25 and name   HE# )  5.00  1.00  2.00 ! 31  
assign (resid  63 and name   HB1 ) ( resid  13 and name    HA )  3.70  1.00  1.00 ! 4   
assign (resid  13 and name    HA ) ( resid  63 and name   HB1 )  3.70  1.00  1.00 ! 307 
assign (resid  13 and name    HA ) ( resid  63 and name   HB2 )  3.70  1.00  1.00 ! 307 
assign (resid  63 and name   HB2 ) ( resid  13 and name    HA )  3.70  1.00  1.00 ! 4   
assign (resid   6 and name  HG2# ) ( resid  15 and name   HB1 )  5.00  1.00  2.00 ! 69  
assign (resid   6 and name  HG2# ) ( resid  15 and name   HB2 )  5.00  1.00  2.00 ! 69  
assign (resid  15 and name   HB1 ) ( resid   6 and name  HG2# )  5.00  1.00  2.00 ! 77  
assign (resid  15 and name   HB2 ) ( resid   6 and name  HG2# )  5.00  1.00  2.00 ! 77  
assign (resid  33 and name  HD1# ) ( resid  76 and name   HB2 )  5.00  1.00  2.00 ! 59  
assign (resid  59 and name   HE1 ) ( resid  57 and name  HG2# )  5.00  1.00  2.00 ! 44  
assign (resid  57 and name  HG2# ) ( resid  59 and name   HE1 )  5.00  1.00  2.00 ! 305 
assign (resid  59 and name   HE1 ) ( resid  55 and name    HA )  5.00  1.00  1.00 ! 44  
assign (resid  55 and name    HA ) ( resid  59 and name   HE1 )  5.00  1.00  1.00 ! 282 
assign (resid  27 and name    HZ ) ( resid  61 and name  HD1# )  5.00  1.00  2.00 ! 73  
assign (resid  61 and name  HD1# ) ( resid  27 and name    HZ )  5.00  1.00  2.00 ! 78  
assign (resid  37 and name   HZ2 ) ( resid  71 and name   HG2 )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name   HZ2 ) ( resid  28 and name   HG1 )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name   HZ2 ) ( resid  71 and name   HG1 )  5.00  1.00  1.00 ! 72  
assign (resid  37 and name   HZ2 ) ( resid  28 and name   HG2 )  5.00  1.00  1.00 ! 72  
assign (resid  28 and name   HG1 ) ( resid  37 and name   HZ2 )  5.00  1.00  1.00 ! 281 
assign (resid  28 and name   HG2 ) ( resid  37 and name   HZ2 )  5.00  1.00  1.00 ! 281 
assign (resid  37 and name   HD1 ) ( resid  28 and name   HG2 )  5.00  1.00  2.00 ! 72  
assign (resid  28 and name   HG2 ) ( resid  37 and name   HD1 )  5.00  1.00  1.00 ! 281 
assign (resid  27 and name   HE# ) ( resid  41 and name  HG2# )  5.00  1.00  4.00 ! 73  
assign (resid  41 and name  HG2# ) ( resid  27 and name   HE# )  5.00  1.00  3.00 ! 52  
assign (resid  81 and name   HD# ) ( resid  79 and name    HA )  5.00  1.00  3.00 ! 308 
assign (resid  79 and name    HA ) ( resid  81 and name   HD# )  5.00  1.00  2.00 ! 9   
assign (resid  19 and name    HA ) ( resid  22 and name  HD2# )  5.00  1.00  2.00 ! 62  
assign (resid  24 and name   HE# ) ( resid  62 and name    HA )  5.00  1.00  3.00 ! 54  
assign (resid  62 and name    HA ) ( resid  24 and name   HE# )  5.00  1.00  2.00 ! 83  
assign (resid  62 and name    HA ) ( resid  24 and name   HD# )  5.00  1.00  2.00 ! 83  
assign (resid  24 and name   HD# ) ( resid  62 and name    HA )  5.00  1.00  3.00 ! 54  
assign (resid  40 and name   HB2 ) ( resid  81 and name    HZ )  5.00  1.00  1.00 ! 38  
assign (resid  40 and name   HB1 ) ( resid  81 and name    HZ )  5.00  1.00  1.00 ! 38  
assign (resid  81 and name    HZ ) ( resid  40 and name   HB2 )  5.00  1.00  1.00 ! 308 
assign (resid  81 and name    HZ ) ( resid  40 and name   HB1 )  5.00  1.00  1.00 ! 308 
assign (resid  33 and name   HB1 ) ( resid  30 and name   HB1 )  5.00  1.00  1.00 ! 59  
assign (resid  30 and name   HB1 ) ( resid  33 and name   HB1 )  5.00  1.00  1.00 ! 43  
assign (resid  30 and name   HB1 ) ( resid  33 and name  HD1# )  5.00  1.00  2.00 ! 43  
assign (resid  30 and name   HB1 ) ( resid  33 and name   HB2 )  5.00  1.00  1.00 ! 43  
assign (resid  33 and name  HD2# ) ( resid  30 and name   HB2 )  5.00  1.00  2.00 ! 59  
assign (resid  33 and name  HD1# ) ( resid  30 and name   HB2 )  5.00  1.00  2.00 ! 59  
assign (resid  30 and name   HB2 ) ( resid  33 and name  HD2# )  5.00  1.00  2.00 ! 43  
assign (resid  30 and name   HB2 ) ( resid  33 and name  HD1# )  5.00  1.00  2.00 ! 43  
assign (resid  20 and name   HB2 ) ( resid   4 and name   HA1 )  5.00  1.00  1.00 ! 39  
assign (resid  20 and name   HB2 ) ( resid   4 and name   HA2 )  5.00  1.00  1.00 ! 39  
assign (resid  20 and name   HB1 ) ( resid   4 and name   HA1 )  5.00  1.00  1.00 ! 39  
assign (resid  20 and name   HB1 ) ( resid   4 and name   HA2 )  5.00  1.00  1.00 ! 39  
assign (resid   4 and name   HA1 ) ( resid  20 and name   HB2 )  5.00  1.00  1.00 ! 2   
assign (resid   4 and name   HA1 ) ( resid  20 and name   HB1 )  5.00  1.00  1.00 ! 2   
assign (resid   4 and name   HA2 ) ( resid  20 and name   HB2 )  5.00  1.00  1.00 ! 2   
assign (resid   4 and name   HA2 ) ( resid  20 and name   HB1 )  5.00  1.00  1.00 ! 2   
assign (resid  55 and name   HD1 ) ( resid  54 and name   HB2 )  5.00  1.00  1.00 ! 282 
assign (resid  55 and name   HD1 ) ( resid  54 and name   HB1 )  5.00  1.00  1.00 ! 282 
assign (resid  34 and name    HA ) ( resid  28 and name   HB2 )  5.00  1.00  1.00 ! 64  
assign (resid  34 and name    HA ) ( resid  28 and name   HD1 )  5.00  1.00  1.00 ! 64  
assign (resid  28 and name   HD1 ) ( resid  34 and name    HA )  5.00  1.00  1.00 ! 281 
assign (resid  33 and name   HB1 ) ( resid  34 and name    HA )  5.00  1.00  1.00 ! 59  
assign (resid  34 and name    HA ) ( resid  33 and name    HG )  5.00  1.00  1.00 ! 64  
assign (resid  78 and name   HD2 ) ( resid  77 and name  HG1# )  5.00  1.00  2.00 ! 263 
assign (resid  62 and name   HB1 ) ( resid   9 and name    HB )  5.00  1.00  1.00 ! 83  
assign (resid   9 and name    HB ) ( resid  62 and name   HB1 )  5.00  1.00  1.00 ! 85  
assign (resid   9 and name    HB ) ( resid  14 and name   HB2 )  5.00  1.00  1.00 ! 85  
assign (resid  14 and name   HB2 ) ( resid   9 and name    HB )  5.00  1.00  1.00 ! 104 
assign (resid  62 and name   HB1 ) ( resid  14 and name   HB2 )  5.00  1.00  1.00 ! 83  
assign (resid  14 and name   HB2 ) ( resid  62 and name   HB1 )  5.00  1.00  1.00 ! 104 
assign (resid   7 and name    HA ) ( resid  61 and name    HA )  3.70  1.00  1.00 ! 306
assign (resid  61 and name    HA ) ( resid   7 and name    HA )  3.70  1.00  1.00 ! 78
assign (resid  61 and name   HB1 ) ( resid  65 and name   HD2 )  3.70  1.00  1.00 ! 78
assign (resid  65 and name   HD2 ) ( resid  61 and name   HB1 )  3.70  1.00  1.00 ! 24
assign (resid  61 and name   HB2 ) ( resid  65 and name   HD2 )  5.00  1.00  1.00 ! 78
assign (resid  65 and name   HD2 ) ( resid  61 and name   HB2 )  5.00  1.00  1.00 ! 24
assign (resid  33 and name   HB1 ) ( resid  28 and name   HB1 )  3.70  1.00  1.00 ! 59
assign (resid  28 and name   HB1 ) ( resid  33 and name   HB1 )  3.70  1.00  1.00 ! 281
assign (resid  28 and name   HB1 ) ( resid  33 and name   HB2 )  3.70  1.00  1.00 ! 281
assign (resid  28 and name   HD2 ) ( resid  27 and name   HB1 )  3.70  1.00  1.00 ! 281
assign (resid  27 and name   HB1 ) ( resid  28 and name   HD2 )  3.70  1.00  1.00 ! 73
assign (resid  27 and name   HB2 ) ( resid  28 and name   HD2 )  3.70  1.00  1.00 ! 73
assign (resid  62 and name   HB1 ) ( resid   7 and name   HB1 )  3.70  1.00  1.00 ! 83
assign (resid   7 and name   HB1 ) ( resid  62 and name   HB1 )  3.70  1.00  1.00 ! 306
assign (resid   9 and name    HA ) ( resid  10 and name   HD2 )  2.50  1.00  1.00 ! 85
assign (resid  10 and name   HD2 ) ( resid   9 and name    HA )  2.50  1.00  1.00 ! 278
assign (resid  14 and name   HB2 ) ( resid   9 and name  HG2# )  3.70  1.00  1.00 ! 104 
assign (resid  14 and name   HB2 ) ( resid  22 and name  HD2# )  3.70  1.00  1.00 ! 104 
assign (resid  19 and name   HB1 ) ( resid  22 and name  HD1# )  3.70  1.00  1.00 ! 62  
assign (resid  60 and name   HG1 ) ( resid   5 and name   HD# )  5.00  1.00  2.00 ! 75
assign (resid   5 and name   HD# ) ( resid  60 and name   HG1 )  5.00  1.00  3.00 ! 51
assign (resid  60 and name   HG2 ) ( resid   5 and name   HD# )  3.70  1.00  2.00 ! 75
assign (resid   5 and name   HD# ) ( resid  60 and name   HG2 )  3.70  1.00  3.00 ! 51
assign (resid  60 and name   HD2 ) ( resid   5 and name   HD# )  3.70  1.00  2.00 ! 75
assign (resid   5 and name   HD# ) ( resid  60 and name   HD2 )  3.70  1.00  3.00 ! 51
assign (resid  60 and name   HD1 ) ( resid   5 and name   HD# )  3.70  1.00  2.00 ! 75
assign (resid   5 and name   HD# ) ( resid  60 and name   HD1 )  3.70  1.00  3.00 ! 51
assign (resid  13 and name    HA ) ( resid   9 and name  HG2# )  3.70  1.00  1.00 ! 307
assign (resid   9 and name  HG2# ) ( resid  13 and name    HA )  3.70  1.00  1.00 ! 85
assign (resid  16 and name   HB1 ) ( resid   5 and name   HB2 )  3.70  1.00  1.00 ! 70
assign (resid   5 and name   HB2 ) ( resid  16 and name   HB1 )  3.70  1.00  1.00 ! 51
assign (resid  16 and name    HA ) ( resid   5 and name   HB2 )  3.70  1.00  1.00 ! 70
assign (resid   5 and name   HB2 ) ( resid  16 and name    HA )  3.70  1.00  1.00 ! 51
assign (resid  16 and name   HB2 ) ( resid   5 and name   HB2 )  3.70  1.00  1.00 ! 70
assign (resid   5 and name   HB2 ) ( resid  16 and name   HB2 )  3.70  1.00  1.00 ! 51
assign (resid  40 and name   HB2 ) ( resid  79 and name    HA )  5.00  1.00  1.00 ! 38
assign (resid  79 and name    HA ) ( resid  40 and name   HB2 )  5.00  1.00  1.00 ! 9
assign (resid  40 and name   HB1 ) ( resid  79 and name    HA )  3.70  1.00  1.00 ! 38
assign (resid  79 and name    HA ) ( resid  40 and name   HB1 )  3.70  1.00  1.00 ! 9
assign (resid  55 and name   HB2 ) ( resid  53 and name   HE# )  5.00  1.00  2.00 ! 282
assign (resid  53 and name   HE# ) ( resid  55 and name   HB2 )  3.70  1.00  3.00 ! 65
assign (resid  53 and name   HD# ) ( resid  55 and name   HB2 )  3.70  1.00  3.00 ! 65
assign (resid  55 and name   HB2 ) ( resid  53 and name   HD# )  5.00  1.00  2.00 ! 282
assign (resid  53 and name   HD# ) ( resid  55 and name   HD2 )  3.70  1.00  3.00 ! 65
assign (resid  55 and name   HD2 ) ( resid  53 and name   HD# )  5.00  1.00  2.00 ! 282
assign (resid  55 and name    HA ) ( resid  53 and name   HE# )  5.00  1.00  2.00 ! 282
assign (resid  53 and name   HE# ) ( resid  55 and name    HA )  3.70  1.00  3.00 ! 65
assign (resid  53 and name   HD# ) ( resid  55 and name    HA )  3.70  1.00  3.00 ! 65
assign (resid  55 and name    HA ) ( resid  53 and name   HD# )  5.00  1.00  2.00 ! 282
assign (resid  53 and name   HD# ) ( resid  59 and name   HD2 )  3.70  1.00  3.00 ! 65
assign (resid  59 and name   HD2 ) ( resid  53 and name   HD# )  3.70  1.00  2.00 ! 44
assign (resid  59 and name   HE1 ) ( resid  53 and name   HE# )  3.70  1.00  2.00 ! 44
assign (resid  53 and name   HE# ) ( resid  59 and name   HE1 )  5.00  1.00  3.00 ! 65
assign (resid  23 and name   HB2 ) ( resid  63 and name    HA )  5.00  1.00  1.00 ! 47
assign (resid  63 and name    HA ) ( resid  23 and name   HB2 )  5.00  1.00  1.00 ! 4
assign (resid  63 and name    HA ) ( resid  23 and name   HB1 )  3.70  1.00  1.00 ! 4
assign (resid  23 and name   HB1 ) ( resid  63 and name    HA )  3.70  1.00  1.00 ! 47
assign (resid  23 and name   HB2 ) ( resid  63 and name   HB2 )  3.70  1.00  1.00 ! 47
assign (resid  63 and name   HB2 ) ( resid  23 and name   HB2 )  3.70  1.00  1.00 ! 4
assign (resid  63 and name   HB2 ) ( resid  23 and name   HB1 )  3.70  1.00  1.00 ! 4
assign (resid  23 and name   HB1 ) ( resid  63 and name   HB2 )  3.70  1.00  1.00 ! 47
assign (resid  66 and name   HD# ) ( resid  75 and name    HB )  3.70  1.00  3.00 ! 41
assign (resid  75 and name    HB ) ( resid  66 and name   HD# )  3.70  1.00  2.00 ! 87
assign (resid  53 and name   HB1 ) ( resid  17 and name   HB1 )  3.70  1.00  1.00 ! 65
assign (resid  17 and name   HB1 ) ( resid  53 and name   HB1 )  3.70  1.00  1.00 ! 58
assign (resid  74 and name  HG2# ) ( resid  73 and name   HE# )  5.00  1.00  2.00 ! 5
assign (resid  73 and name   HD# ) ( resid  74 and name  HG2# )  2.50  1.00  3.00 ! 7
assign (resid  74 and name  HG2# ) ( resid  73 and name   HD# )  2.50  1.00  2.00 ! 5
assign (resid  61 and name    HG ) ( resid  65 and name   HD2 )  3.70  1.00  1.00 ! 78
assign (resid  65 and name   HD2 ) ( resid  61 and name    HG )  3.70  1.00  1.00 ! 24
assign (resid  66 and name   HD# ) ( resid  78 and name    HA )  5.00  1.00  3.00 ! 41  

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           1HT      GLY   1   3.608  16.392   7.103
    2    H2   GLY   1           2HT      GLY   1   2.551  15.072   7.107
    3    H3   GLY   1           3HT      GLY   1   2.663  16.061   5.739
    4    HA2  GLY   1           1HA      GLY   1   5.167  14.891   6.587
    5    HA3  GLY   1           2HA      GLY   1   3.964  13.734   6.040
    6    H    SER   2           H        SER   2   4.937  13.156   4.140
    7    HA   SER   2           HA       SER   2   6.152  14.885   2.309
    8    HB2  SER   2           2HB      SER   2   4.822  12.574   1.086
    9    HB3  SER   2           1HB      SER   2   6.533  12.997   1.127
   10    HG   SER   2           HG       SER   2   6.353  11.173   2.327
   11    HA   PRO   3           HA       PRO   3   2.847  16.704   0.019
   12    HB2  PRO   3           2HB      PRO   3   3.584  16.532  -2.560
   13    HB3  PRO   3           1HB      PRO   3   4.477  17.519  -1.398
   14    HG2  PRO   3           2HG      PRO   3   5.109  14.786  -2.442
   15    HG3  PRO   3           1HG      PRO   3   6.196  16.161  -2.176
   16    HD2  PRO   3           2HD      PRO   3   5.940  14.064  -0.436
   17    HD3  PRO   3           1HD      PRO   3   6.432  15.696   0.055
   18    H    GLY   4           H        GLY   4   3.216  13.399  -0.113
   19    HA2  GLY   4           2HA      GLY   4   0.637  12.718  -0.581
   20    HA3  GLY   4           1HA      GLY   4   1.318  12.822  -2.198
   21    H    PHE   5           H        PHE   5   0.451  10.350  -1.786
   22    HA   PHE   5           HA       PHE   5   1.751   8.404  -2.324
   23    HB2  PHE   5           2HB      PHE   5   3.493   7.575  -1.010
   24    HB3  PHE   5           1HB      PHE   5   3.859   9.278  -1.253
   25    HD1  PHE   5           2HD      PHE   5   1.505   9.875   0.917
   26    HD2  PHE   5           1HD      PHE   5   5.149   7.685   0.846
   27    HE1  PHE   5           2HE      PHE   5   1.727  10.178   3.351
   28    HE2  PHE   5           1HE      PHE   5   5.380   7.979   3.280
   29    HZ   PHE   5           HZ       PHE   5   3.667   9.229   4.535
   30    H    THR   6           H        THR   6  -0.679   9.233  -1.087
   31    HA   THR   6           HA       THR   6  -1.161   7.451   1.061
   32    HB   THR   6           HB       THR   6  -2.375   9.783  -0.061
   33    HG1  THR   6           1HG      THR   6  -1.601   9.226   2.143
   34   HG21  THR   6          3HG2      THR   6  -4.662   8.947   1.064
   35   HG22  THR   6          1HG2      THR   6  -4.203   7.504   0.174
   36   HG23  THR   6          2HG2      THR   6  -4.387   9.039  -0.665
   37    H    CYS   7           H        CYS   7  -0.193   5.831  -0.641
   38    HA   CYS   7           HA       CYS   7  -0.521   3.774  -1.566
   39    HB2  CYS   7           2HB      CYS   7  -2.077   3.427   0.298
   40    HB3  CYS   7           1HB      CYS   7  -3.359   4.206  -0.618
   41    H    CYS   8           H        CYS   8  -0.243   3.909  -3.767
   42    HA   CYS   8           HA       CYS   8  -1.769   5.444  -5.512
   43    HB2  CYS   8           2HB      CYS   8   0.333   4.456  -6.217
   44    HB3  CYS   8           1HB      CYS   8  -0.348   2.842  -6.072
   45    HG   CYS   8           HG       CYS   8  -1.143   4.859  -8.302
   46    H    VAL   9           H        VAL   9  -3.804   5.109  -4.497
   47    HA   VAL   9           HA       VAL   9  -5.182   2.629  -4.735
   48    HB   VAL   9           HB       VAL   9  -5.979   5.364  -3.785
   49   HG11  VAL   9          1HG1      VAL   9  -8.139   4.874  -3.756
   50   HG12  VAL   9          2HG1      VAL   9  -7.822   3.317  -2.997
   51   HG13  VAL   9          3HG1      VAL   9  -7.784   3.465  -4.749
   52   HG21  VAL   9          3HG2      VAL   9  -4.895   4.621  -2.020
   53   HG22  VAL   9          1HG2      VAL   9  -4.864   2.971  -2.629
   54   HG23  VAL   9          2HG2      VAL   9  -6.283   3.570  -1.779
   55    HA   PRO  10           HA       PRO  10  -6.737   3.761  -8.842
   56    HB2  PRO  10           2HB      PRO  10  -7.344   1.262  -9.609
   57    HB3  PRO  10           1HB      PRO  10  -5.666   1.827  -9.615
   58    HG2  PRO  10           2HG      PRO  10  -7.101   0.191  -7.554
   59    HG3  PRO  10           1HG      PRO  10  -5.499  -0.081  -8.267
   60    HD2  PRO  10           2HD      PRO  10  -5.830   1.101  -5.843
   61    HD3  PRO  10           1HD      PRO  10  -4.501   1.517  -6.942
   62    H    GLY  11           H        GLY  11  -7.994   2.132  -6.060
   63    HA2  GLY  11           2HA      GLY  11 -10.593   3.229  -6.449
   64    HA3  GLY  11           1HA      GLY  11 -10.580   1.507  -6.758
   65    H    CYS  12           H        CYS  12  -8.319   1.666  -4.360
   66    HA   CYS  12           HA       CYS  12 -10.249   0.800  -2.471
   67    HB2  CYS  12           2HB      CYS  12  -8.209   0.857  -0.830
   68    HB3  CYS  12           1HB      CYS  12  -8.361  -0.380  -2.052
   69    H    TYR  13           H        TYR  13  -8.410   2.342  -0.276
   70    HA   TYR  13           HA       TYR  13 -10.518   4.045   0.462
   71    HB2  TYR  13           2HB      TYR  13  -8.590   2.871   1.844
   72    HB3  TYR  13           1HB      TYR  13  -7.890   4.466   1.729
   73    HD1  TYR  13           2HD      TYR  13 -11.523   3.774   1.919
   74    HD2  TYR  13           1HD      TYR  13  -8.076   5.096   4.038
   75    HE1  TYR  13           2HE      TYR  13 -12.951   4.533   3.766
   76    HE2  TYR  13           1HE      TYR  13  -9.497   5.859   5.884
   77    HH   TYR  13           HH       TYR  13 -11.995   5.081   6.726
   78    H    ASN  14           H        ASN  14  -7.321   5.350   0.525
   79    HA   ASN  14           HA       ASN  14  -8.012   7.684  -1.106
   80    HB2  ASN  14           2HB      ASN  14  -6.527   8.943   0.540
   81    HB3  ASN  14           1HB      ASN  14  -8.038   8.378   1.162
   82   HD21  ASN  14          1HD2      ASN  14  -8.084   6.170   2.050
   83   HD22  ASN  14          2HD2      ASN  14  -6.762   5.611   3.005
   84    H    ASN  15           H        ASN  15  -5.924   8.580  -2.325
   85    HA   ASN  15           HA       ASN  15  -4.172   6.289  -2.598
   86    HB2  ASN  15           2HB      ASN  15  -5.032   6.302  -4.704
   87    HB3  ASN  15           1HB      ASN  15  -5.508   7.981  -4.606
   88   HD21  ASN  15          1HD2      ASN  15  -3.529   9.507  -4.671
   89   HD22  ASN  15          2HD2      ASN  15  -2.387   9.156  -5.914
   90    H    SER  16           H        SER  16  -1.919   6.632  -3.766
   91    HA   SER  16           HA       SER  16  -0.320   7.815  -1.983
   92    HB2  SER  16           2HB      SER  16   0.062   5.973  -3.914
   93    HB3  SER  16           1HB      SER  16   0.838   7.340  -4.690
   94    HG   SER  16           HG       SER  16   2.458   6.904  -3.453
   95    H    HIS  17           H        HIS  17  -2.162   9.846  -3.370
   96    HA   HIS  17           HA       HIS  17  -0.560  12.062  -3.249
   97    HB2  HIS  17           2HB      HIS  17  -0.198  12.680  -5.626
   98    HB3  HIS  17           1HB      HIS  17   0.733  11.279  -5.119
   99    HD1  HIS  17           1HD      HIS  17  -2.580  11.950  -6.881
  100    HD2  HIS  17           2HD      HIS  17   0.569   9.236  -6.877
  101    HE1  HIS  17           1HE      HIS  17  -3.067  10.354  -8.761
  102    HE2  HIS  17           2HE      HIS  17  -1.115   8.759  -8.783
  103    H    ARG  18           H        ARG  18  -3.097  11.761  -2.416
  104    HA   ARG  18           HA       ARG  18  -4.398  13.956  -3.626
  105    HB2  ARG  18           2HB      ARG  18  -6.301  12.949  -4.656
  106    HB3  ARG  18           1HB      ARG  18  -4.858  12.232  -5.355
  107    HG2  ARG  18           2HG      ARG  18  -5.154  10.258  -3.949
  108    HG3  ARG  18           1HG      ARG  18  -6.596  10.982  -3.235
  109    HD2  ARG  18           2HD      ARG  18  -6.522  10.836  -6.185
  110    HD3  ARG  18           1HD      ARG  18  -6.662   9.301  -5.332
  111    HE   ARG  18           HE       ARG  18  -8.513  11.170  -4.301
  112   HH11  ARG  18          1HH1      ARG  18  -7.936   9.143  -7.080
  113   HH12  ARG  18          2HH1      ARG  18  -9.616   8.978  -7.468
  114   HH21  ARG  18          1HH2      ARG  18 -10.724  10.958  -4.806
  115   HH22  ARG  18          2HH2      ARG  18 -11.200  10.011  -6.176
  116    H    ASP  19           H        ASP  19  -3.768  12.552  -0.952
  117    HA   ASP  19           HA       ASP  19  -6.081  13.550   0.415
  118    HB2  ASP  19           2HB      ASP  19  -5.488  10.591   0.462
  119    HB3  ASP  19           1HB      ASP  19  -6.530  11.399   1.622
  120    H    LYS  20           H        LYS  20  -3.869  11.008   1.407
  121    HA   LYS  20           HA       LYS  20  -2.217  10.888   2.954
  122    HB2  LYS  20           2HB      LYS  20  -1.989  13.881   2.722
  123    HB3  LYS  20           1HB      LYS  20  -0.753  12.751   3.252
  124    HG2  LYS  20           2HG      LYS  20  -0.034  12.509   1.179
  125    HG3  LYS  20           1HG      LYS  20  -1.642  12.025   0.636
  126    HD2  LYS  20           2HD      LYS  20  -0.865  13.980  -0.598
  127    HD3  LYS  20           1HD      LYS  20  -2.266  14.383   0.396
  128    HE2  LYS  20           2HE      LYS  20  -0.370  15.008   2.144
  129    HE3  LYS  20           1HE      LYS  20   0.570  15.225   0.668
  130    HZ1  LYS  20           3HZ      LYS  20  -2.080  16.488   1.029
  131    HZ2  LYS  20           1HZ      LYS  20  -0.869  16.886  -0.085
  132    HZ3  LYS  20           2HZ      LYS  20  -0.656  17.234   1.556
  133    H    ALA  21           H        ALA  21  -5.138  11.914   3.648
  134    HA   ALA  21           HA       ALA  21  -4.410  12.585   6.439
  135    HB1  ALA  21           1HB      ALA  21  -5.544  14.364   4.962
  136    HB2  ALA  21           2HB      ALA  21  -6.115  14.121   6.613
  137    HB3  ALA  21           3HB      ALA  21  -7.014  13.435   5.260
  138    H    LEU  22           H        LEU  22  -5.263   9.831   5.103
  139    HA   LEU  22           HA       LEU  22  -7.396   9.297   7.046
  140    HB2  LEU  22           2HB      LEU  22  -7.024   7.595   4.566
  141    HB3  LEU  22           1HB      LEU  22  -8.459   7.784   5.564
  142    HG   LEU  22           HG       LEU  22  -7.674   9.245   3.176
  143   HD11  LEU  22          1HD1      LEU  22  -9.797   8.721   2.755
  144   HD12  LEU  22          2HD1      LEU  22 -10.311   9.812   4.039
  145   HD13  LEU  22          3HD1      LEU  22  -9.996   8.119   4.403
  146   HD21  LEU  22          3HD2      LEU  22  -8.284  10.765   5.660
  147   HD22  LEU  22          1HD2      LEU  22  -8.969  11.308   4.131
  148   HD23  LEU  22          2HD2      LEU  22  -7.223  11.180   4.312
  149    H    HIS  23           H        HIS  23  -6.898   6.202   6.841
  150    HA   HIS  23           HA       HIS  23  -4.542   6.291   8.525
  151    HB2  HIS  23           2HB      HIS  23  -7.029   4.961   8.623
  152    HB3  HIS  23           1HB      HIS  23  -5.819   3.702   8.398
  153    HD1  HIS  23           1HD      HIS  23  -5.167   2.757  10.575
  154    HD2  HIS  23           2HD      HIS  23  -5.907   6.838  10.846
  155    HE1  HIS  23           1HE      HIS  23  -4.730   3.361  12.977
  156    HE2  HIS  23           2HE      HIS  23  -5.109   5.850  13.099
  157    H    PHE  24           H        PHE  24  -2.611   4.884   8.124
  158    HA   PHE  24           HA       PHE  24  -2.821   3.314   5.708
  159    HB2  PHE  24           2HB      PHE  24  -0.664   5.283   6.316
  160    HB3  PHE  24           1HB      PHE  24  -0.356   3.903   5.263
  161    HD1  PHE  24           2HD      PHE  24  -2.906   6.565   5.733
  162    HD2  PHE  24           1HD      PHE  24  -0.665   4.263   2.907
  163    HE1  PHE  24           2HE      PHE  24  -3.989   7.723   3.866
  164    HE2  PHE  24           1HE      PHE  24  -1.761   5.363   1.123
  165    HZ   PHE  24           HZ       PHE  24  -3.424   7.078   1.539
  166    H    TYR  25           H        TYR  25  -1.844   1.194   5.756
  167    HA   TYR  25           HA       TYR  25  -0.909   0.304   8.336
  168    HB2  TYR  25           2HB      TYR  25  -1.511  -1.094   5.721
  169    HB3  TYR  25           1HB      TYR  25  -0.771  -1.936   7.077
  170    HD1  TYR  25           2HD      TYR  25  -3.204   0.644   7.881
  171    HD2  TYR  25           1HD      TYR  25  -2.702  -3.489   6.999
  172    HE1  TYR  25           2HE      TYR  25  -5.434   0.182   8.802
  173    HE2  TYR  25           1HE      TYR  25  -4.933  -3.962   7.915
  174    HH   TYR  25           HH       TYR  25  -7.220  -2.145   8.226
  175    H    THR  26           H        THR  26   1.302  -0.880   8.500
  176    HA   THR  26           HA       THR  26   3.145   0.451   6.647
  177    HB   THR  26           HB       THR  26   4.549   0.777   8.380
  178    HG1  THR  26           1HG      THR  26   5.507  -0.880   9.207
  179   HG21  THR  26          3HG2      THR  26   3.663   0.856  10.572
  180   HG22  THR  26          1HG2      THR  26   2.427  -0.341  10.186
  181   HG23  THR  26          2HG2      THR  26   2.355   1.267   9.463
  182    H    PHE  27           H        PHE  27   5.315  -0.825   6.355
  183    HA   PHE  27           HA       PHE  27   4.661  -3.082   4.855
  184    HB2  PHE  27           2HB      PHE  27   6.849  -1.332   5.214
  185    HB3  PHE  27           1HB      PHE  27   7.424  -2.959   4.999
  186    HD1  PHE  27           2HD      PHE  27   4.458  -2.833   3.206
  187    HD2  PHE  27           1HD      PHE  27   8.451  -1.360   3.091
  188    HE1  PHE  27           2HE      PHE  27   4.298  -2.553   0.773
  189    HE2  PHE  27           1HE      PHE  27   8.288  -1.099   0.666
  190    HZ   PHE  27           HZ       PHE  27   6.201  -1.687  -0.500
  191    HA   PRO  28           HA       PRO  28   5.215  -6.591   7.717
  192    HB2  PRO  28           2HB      PRO  28   6.559  -7.542   5.163
  193    HB3  PRO  28           1HB      PRO  28   5.594  -8.504   6.278
  194    HG2  PRO  28           2HG      PRO  28   4.460  -7.569   4.137
  195    HG3  PRO  28           1HG      PRO  28   3.609  -7.384   5.675
  196    HD2  PRO  28           2HD      PRO  28   4.977  -5.361   4.012
  197    HD3  PRO  28           1HD      PRO  28   3.614  -5.191   5.102
  198    H    LYS  29           H        LYS  29   7.159  -8.026   8.434
  199    HA   LYS  29           HA       LYS  29   9.466  -6.348   8.857
  200    HB2  LYS  29           2HB      LYS  29  10.247  -8.481  10.092
  201    HB3  LYS  29           1HB      LYS  29   8.923  -7.545  10.771
  202    HG2  LYS  29           2HG      LYS  29   7.964  -9.573   8.950
  203    HG3  LYS  29           1HG      LYS  29   8.968 -10.269  10.219
  204    HD2  LYS  29           2HD      LYS  29   6.830  -8.289  10.905
  205    HD3  LYS  29           1HD      LYS  29   6.415  -9.980  10.618
  206    HE2  LYS  29           2HE      LYS  29   8.703  -9.536  12.411
  207    HE3  LYS  29           1HE      LYS  29   7.152  -8.965  13.022
  208    HZ1  LYS  29           3HZ      LYS  29   7.054 -11.597  11.853
  209    HZ2  LYS  29           1HZ      LYS  29   6.427 -11.041  13.323
  210    HZ3  LYS  29           2HZ      LYS  29   8.051 -11.497  13.215
  211    H    ASP  30           H        ASP  30   8.638  -9.068   6.917
  212    HA   ASP  30           HA       ASP  30  11.342  -9.812   6.251
  213    HB2  ASP  30           2HB      ASP  30   9.346 -10.766   4.387
  214    HB3  ASP  30           1HB      ASP  30  10.335 -11.713   5.484
  215    H    ALA  31           H        ALA  31  12.583  -8.575   4.891
  216    HA   ALA  31           HA       ALA  31  11.838  -6.448   3.435
  217    HB1  ALA  31           1HB      ALA  31  14.072  -6.604   3.588
  218    HB2  ALA  31           2HB      ALA  31  13.902  -7.160   1.931
  219    HB3  ALA  31           3HB      ALA  31  14.121  -8.327   3.239
  220    H    GLU  32           H        GLU  32  12.303  -9.637   1.668
  221    HA   GLU  32           HA       GLU  32  11.238  -8.752  -0.750
  222    HB2  GLU  32           2HB      GLU  32  12.319 -10.833  -0.715
  223    HB3  GLU  32           1HB      GLU  32  11.318 -11.519   0.499
  224    HG2  GLU  32           2HG      GLU  32  10.227 -10.736  -2.183
  225    HG3  GLU  32           1HG      GLU  32  11.019 -12.287  -1.918
  226    H    LEU  33           H        LEU  33   9.140 -10.628   1.627
  227    HA   LEU  33           HA       LEU  33   6.859 -10.349   0.231
  228    HB2  LEU  33           2HB      LEU  33   7.223 -11.116   2.687
  229    HB3  LEU  33           1HB      LEU  33   6.912  -9.454   3.107
  230    HG   LEU  33           HG       LEU  33   4.726  -9.748   2.988
  231   HD11  LEU  33          1HD1      LEU  33   4.764  -9.497   0.562
  232   HD12  LEU  33          2HD1      LEU  33   3.559 -10.690   1.042
  233   HD13  LEU  33          3HD1      LEU  33   5.104 -11.213   0.379
  234   HD21  LEU  33          3HD2      LEU  33   3.942 -12.172   2.737
  235   HD22  LEU  33          1HD2      LEU  33   4.974 -11.742   4.097
  236   HD23  LEU  33          2HD2      LEU  33   5.661 -12.551   2.688
  237    H    ARG  34           H        ARG  34   8.614  -7.877   1.857
  238    HA   ARG  34           HA       ARG  34   6.836  -5.719   1.653
  239    HB2  ARG  34           2HB      ARG  34   8.458  -4.442   2.581
  240    HB3  ARG  34           1HB      ARG  34   9.247  -5.980   2.848
  241    HG2  ARG  34           2HG      ARG  34  10.999  -4.954   1.910
  242    HG3  ARG  34           1HG      ARG  34  10.202  -5.315   0.392
  243    HD2  ARG  34           2HD      ARG  34  10.421  -3.120   0.034
  244    HD3  ARG  34           1HD      ARG  34   8.979  -3.019   1.035
  245    HE   ARG  34           HE       ARG  34  10.231  -1.885   2.555
  246   HH11  ARG  34          1HH1      ARG  34  12.370  -3.935   0.712
  247   HH12  ARG  34          2HH1      ARG  34  13.797  -3.389   1.527
  248   HH21  ARG  34          1HH2      ARG  34  12.107  -1.165   3.627
  249   HH22  ARG  34          2HH2      ARG  34  13.648  -1.817   3.182
  250    H    ARG  35           H        ARG  35   9.569  -6.496  -0.457
  251    HA   ARG  35           HA       ARG  35   8.962  -4.527  -2.321
  252    HB2  ARG  35           2HB      ARG  35  10.281  -5.801  -3.959
  253    HB3  ARG  35           1HB      ARG  35  11.111  -5.638  -2.426
  254    HG2  ARG  35           2HG      ARG  35  11.569  -7.797  -3.044
  255    HG3  ARG  35           1HG      ARG  35  10.227  -7.999  -1.937
  256    HD2  ARG  35           2HD      ARG  35   9.849  -9.409  -3.831
  257    HD3  ARG  35           1HD      ARG  35   8.705  -8.077  -3.923
  258    HE   ARG  35           HE       ARG  35   9.755  -7.327  -5.824
  259   HH11  ARG  35          1HH1      ARG  35  11.712  -9.789  -4.309
  260   HH12  ARG  35          2HH1      ARG  35  12.783  -9.944  -5.660
  261   HH21  ARG  35          1HH2      ARG  35  11.164  -7.529  -7.600
  262   HH22  ARG  35          2HH2      ARG  35  12.474  -8.661  -7.528
  263    H    LEU  36           H        LEU  36   7.607  -7.740  -1.736
  264    HA   LEU  36           HA       LEU  36   6.190  -7.863  -4.242
  265    HB2  LEU  36           2HB      LEU  36   5.439  -9.001  -1.545
  266    HB3  LEU  36           1HB      LEU  36   4.504  -9.263  -2.994
  267    HG   LEU  36           HG       LEU  36   7.295 -10.229  -2.412
  268   HD11  LEU  36          1HD1      LEU  36   6.168 -12.420  -3.002
  269   HD12  LEU  36          2HD1      LEU  36   4.638 -11.550  -2.890
  270   HD13  LEU  36          3HD1      LEU  36   5.686 -11.674  -1.478
  271   HD21  LEU  36          3HD2      LEU  36   7.423  -9.544  -4.665
  272   HD22  LEU  36          1HD2      LEU  36   5.793 -10.121  -5.014
  273   HD23  LEU  36          2HD2      LEU  36   7.092 -11.277  -4.715
  274    H    TRP  37           H        TRP  37   5.304  -6.358  -1.146
  275    HA   TRP  37           HA       TRP  37   2.803  -5.502  -2.100
  276    HB2  TRP  37           2HB      TRP  37   4.624  -4.539   0.088
  277    HB3  TRP  37           1HB      TRP  37   3.154  -3.660  -0.317
  278    HD1  TRP  37           HD       TRP  37   3.291  -7.449  -0.478
  279    HE1  TRP  37           1HE      TRP  37   1.792  -8.442   1.388
  280    HE3  TRP  37           3HE      TRP  37   2.018  -3.125   1.897
  281    HZ2  TRP  37           2HZ      TRP  37   0.231  -7.468   3.552
  282    HZ3  TRP  37           3HZ      TRP  37   0.540  -3.224   3.831
  283    HH2  TRP  37           HH       TRP  37  -0.356  -5.341   4.638
  284    H    LEU  38           H        LEU  38   6.117  -4.101  -2.309
  285    HA   LEU  38           HA       LEU  38   5.738  -1.540  -3.113
  286    HB2  LEU  38           2HB      LEU  38   7.514  -3.696  -4.238
  287    HB3  LEU  38           1HB      LEU  38   7.482  -2.138  -4.971
  288    HG   LEU  38           HG       LEU  38   8.456  -2.864  -2.246
  289   HD11  LEU  38          1HD1      LEU  38  10.480  -2.137  -2.983
  290   HD12  LEU  38          2HD1      LEU  38   9.776  -0.936  -4.068
  291   HD13  LEU  38          3HD1      LEU  38   9.792  -2.640  -4.527
  292   HD21  LEU  38          3HD2      LEU  38   6.896  -0.944  -2.012
  293   HD22  LEU  38          1HD2      LEU  38   7.880  -0.056  -3.171
  294   HD23  LEU  38          2HD2      LEU  38   8.566  -0.554  -1.624
  295    H    LYS  39           H        LYS  39   5.225  -4.569  -5.093
  296    HA   LYS  39           HA       LYS  39   4.425  -3.469  -7.476
  297    HB2  LYS  39           2HB      LYS  39   4.185  -5.990  -6.021
  298    HB3  LYS  39           1HB      LYS  39   2.919  -5.765  -7.196
  299    HG2  LYS  39           2HG      LYS  39   5.170  -6.965  -7.781
  300    HG3  LYS  39           1HG      LYS  39   4.348  -5.942  -8.965
  301    HD2  LYS  39           2HD      LYS  39   6.261  -4.561  -7.192
  302    HD3  LYS  39           1HD      LYS  39   6.968  -5.729  -8.310
  303    HE2  LYS  39           2HE      LYS  39   6.481  -4.483 -10.131
  304    HE3  LYS  39           1HE      LYS  39   4.959  -3.904  -9.459
  305    HZ1  LYS  39           3HZ      LYS  39   6.098  -2.291  -8.174
  306    HZ2  LYS  39           1HZ      LYS  39   6.710  -2.175  -9.748
  307    HZ3  LYS  39           2HZ      LYS  39   7.612  -2.948  -8.543
  308    H    ASN  40           H        ASN  40   2.215  -4.542  -4.907
  309    HA   ASN  40           HA       ASN  40  -0.144  -3.678  -6.135
  310    HB2  ASN  40           2HB      ASN  40  -0.351  -3.501  -3.242
  311    HB3  ASN  40           1HB      ASN  40  -1.157  -4.582  -4.359
  312   HD21  ASN  40          1HD2      ASN  40  -0.246  -5.237  -1.777
  313   HD22  ASN  40          2HD2      ASN  40   0.944  -6.474  -1.943
  314    H    VAL  41           H        VAL  41   2.195  -1.900  -4.406
  315    HA   VAL  41           HA       VAL  41   0.479   0.260  -3.729
  316    HB   VAL  41           HB       VAL  41   2.871  -0.535  -2.720
  317   HG11  VAL  41          1HG1      VAL  41   4.084   0.481  -4.627
  318   HG12  VAL  41          2HG1      VAL  41   4.496   1.213  -3.078
  319   HG13  VAL  41          3HG1      VAL  41   3.406   2.045  -4.186
  320   HG21  VAL  41          3HG2      VAL  41   0.862   1.168  -2.062
  321   HG22  VAL  41          1HG2      VAL  41   2.219   2.285  -2.222
  322   HG23  VAL  41          2HG2      VAL  41   2.325   0.926  -1.104
  323    H    SER  42           H        SER  42   2.338  -0.423  -6.621
  324    HA   SER  42           HA       SER  42   1.225   1.328  -8.277
  325    HB2  SER  42           2HB      SER  42   1.424   3.412  -7.333
  326    HB3  SER  42           1HB      SER  42   2.817   2.945  -6.348
  327    HG   SER  42           HG       SER  42   2.908   4.436  -8.429
  328    H    ARG  43           H        ARG  43   4.772   2.170  -8.014
  329    HA   ARG  43           HA       ARG  43   6.326   0.400  -8.938
  330    HB2  ARG  43           2HB      ARG  43   6.007  -0.187 -11.281
  331    HB3  ARG  43           1HB      ARG  43   4.606  -0.680 -10.351
  332    HG2  ARG  43           2HG      ARG  43   3.403   0.329 -11.930
  333    HG3  ARG  43           1HG      ARG  43   3.917   1.844 -11.185
  334    HD2  ARG  43           2HD      ARG  43   5.317   2.346 -12.875
  335    HD3  ARG  43           1HD      ARG  43   5.846   0.675 -13.066
  336    HE   ARG  43           HE       ARG  43   3.168   1.146 -13.992
  337   HH11  ARG  43          1HH1      ARG  43   6.549   1.262 -14.849
  338   HH12  ARG  43          2HH1      ARG  43   6.251   1.120 -16.549
  339   HH21  ARG  43          1HH2      ARG  43   2.774   0.958 -16.227
  340   HH22  ARG  43          2HH2      ARG  43   4.109   0.948 -17.332
  341    H    ALA  44           H        ALA  44   7.130   1.198 -11.623
  342    HA   ALA  44           HA       ALA  44   8.619   3.505 -11.011
  343    HB1  ALA  44           1HB      ALA  44   8.072   2.769 -13.856
  344    HB2  ALA  44           2HB      ALA  44   8.925   1.620 -12.823
  345    HB3  ALA  44           3HB      ALA  44   9.589   3.233 -13.079
  346    H    GLY  45           H        GLY  45   6.490   4.839 -10.225
  347    HA2  GLY  45           2HA      GLY  45   5.169   6.660 -10.623
  348    HA3  GLY  45           1HA      GLY  45   6.058   6.877 -12.116
  349    H    VAL  46           H        VAL  46   4.569   3.832 -11.819
  350    HA   VAL  46           HA       VAL  46   2.888   2.844 -12.985
  351    HB   VAL  46           HB       VAL  46   1.081   5.133 -13.121
  352   HG11  VAL  46          1HG1      VAL  46   1.100   2.344 -12.105
  353   HG12  VAL  46          2HG1      VAL  46   0.030   3.114 -13.277
  354   HG13  VAL  46          3HG1      VAL  46  -0.164   3.442 -11.555
  355   HG21  VAL  46          3HG2      VAL  46   2.012   6.088 -11.227
  356   HG22  VAL  46          1HG2      VAL  46   2.473   4.530 -10.540
  357   HG23  VAL  46          2HG2      VAL  46   0.782   5.029 -10.539
  358    H    SER  47           H        SER  47   4.884   4.612 -14.413
  359    HA   SER  47           HA       SER  47   3.970   4.205 -17.045
  360    HB2  SER  47           2HB      SER  47   3.176   6.274 -17.757
  361    HB3  SER  47           1HB      SER  47   2.536   6.246 -16.114
  362    HG   SER  47           HG       SER  47   4.036   8.091 -17.155
  363    H    GLY  48           H        GLY  48   5.884   6.872 -15.229
  364    HA2  GLY  48           2HA      GLY  48   8.167   6.032 -16.922
  365    HA3  GLY  48           1HA      GLY  48   7.873   7.696 -16.436
  366    H    CYS  49           H        CYS  49  10.168   5.820 -15.971
  367    HA   CYS  49           HA       CYS  49  10.163   5.263 -13.152
  368    HB2  CYS  49           2HB      CYS  49  11.447   4.001 -14.969
  369    HB3  CYS  49           1HB      CYS  49  12.590   5.340 -14.938
  370    HG   CYS  49           HG       CYS  49  12.109   3.900 -12.258
  371    H    PHE  50           H        PHE  50   9.514   7.831 -13.113
  372    HA   PHE  50           HA       PHE  50  11.666   9.680 -13.219
  373    HB2  PHE  50           2HB      PHE  50   9.027  10.012 -13.116
  374    HB3  PHE  50           1HB      PHE  50   9.327  10.137 -11.388
  375    HD1  PHE  50           2HD      PHE  50  11.813  11.567 -11.192
  376    HD2  PHE  50           1HD      PHE  50   8.601  12.119 -13.929
  377    HE1  PHE  50           2HE      PHE  50  12.464  13.923 -11.476
  378    HE2  PHE  50           1HE      PHE  50   9.247  14.475 -14.218
  379    HZ   PHE  50           HZ       PHE  50  11.181  15.380 -12.990
  380    H    SER  51           H        SER  51   9.861   8.689 -10.169
  381    HA   SER  51           HA       SER  51  11.548   7.517  -8.582
  382    HB2  SER  51           2HB      SER  51  13.530   8.680  -9.009
  383    HB3  SER  51           1HB      SER  51  12.719  10.245  -9.049
  384    HG   SER  51           HG       SER  51  13.356   8.649  -6.803
  385    H    THR  52           H        THR  52   9.274   9.975  -8.981
  386    HA   THR  52           HA       THR  52   8.925  11.150  -6.554
  387    HB   THR  52           HB       THR  52   6.668  11.551  -7.142
  388    HG1  THR  52           1HG      THR  52   5.429  10.162  -8.215
  389   HG21  THR  52          3HG2      THR  52   8.603  11.859  -9.095
  390   HG22  THR  52          1HG2      THR  52   7.001  12.598  -9.071
  391   HG23  THR  52          2HG2      THR  52   7.260  11.081  -9.933
  392    H    PHE  53           H        PHE  53   7.095  10.626  -4.866
  393    HA   PHE  53           HA       PHE  53   6.754   9.322  -3.018
  394    HB2  PHE  53           2HB      PHE  53   5.160   7.530  -3.467
  395    HB3  PHE  53           1HB      PHE  53   4.781   8.960  -4.420
  396    HD1  PHE  53           1HD      PHE  53   6.146   5.530  -4.554
  397    HD2  PHE  53           2HD      PHE  53   4.823   8.910  -6.784
  398    HE1  PHE  53           1HE      PHE  53   6.108   4.166  -6.594
  399    HE2  PHE  53           2HE      PHE  53   4.787   7.546  -8.831
  400    HZ   PHE  53           HZ       PHE  53   5.425   5.172  -8.734
  401    H    GLN  54           H        GLN  54   9.400   8.865  -4.057
  402    HA   GLN  54           HA       GLN  54  10.237   6.299  -4.418
  403    HB2  GLN  54           2HB      GLN  54  11.614   8.453  -4.230
  404    HB3  GLN  54           1HB      GLN  54  11.652   8.144  -2.502
  405    HG2  GLN  54           2HG      GLN  54  12.588   5.838  -3.162
  406    HG3  GLN  54           1HG      GLN  54  12.905   6.587  -4.726
  407   HE21  GLN  54          1HE2      GLN  54  13.782   9.010  -4.214
  408   HE22  GLN  54          2HE2      GLN  54  15.201   8.992  -3.230
  409    HA   PRO  55           HA       PRO  55   8.712   4.370  -0.665
  410    HB2  PRO  55           2HB      PRO  55   9.960   1.900  -1.493
  411    HB3  PRO  55           1HB      PRO  55   8.249   2.317  -1.425
  412    HG2  PRO  55           2HG      PRO  55   9.652   1.931  -3.754
  413    HG3  PRO  55           1HG      PRO  55   8.163   2.880  -3.620
  414    HD2  PRO  55           2HD      PRO  55  10.988   3.796  -3.821
  415    HD3  PRO  55           1HD      PRO  55   9.503   4.542  -4.449
  416    H    THR  56           H        THR  56  10.860   5.882  -0.135
  417    HA   THR  56           HA       THR  56  12.751   4.063   1.246
  418    HB   THR  56           HB       THR  56  13.907   6.576   1.311
  419    HG1  THR  56           1HG      THR  56  12.695   6.258  -1.232
  420   HG21  THR  56          3HG2      THR  56  14.290   4.534  -0.865
  421   HG22  THR  56          1HG2      THR  56  15.053   4.496   0.724
  422   HG23  THR  56          2HG2      THR  56  15.425   5.802  -0.402
  423    H    THR  57           H        THR  57  10.916   7.215   1.513
  424    HA   THR  57           HA       THR  57  11.473   7.698   4.205
  425    HB   THR  57           HB       THR  57  10.478   9.382   2.770
  426    HG1  THR  57           1HG      THR  57   9.998   9.561   4.976
  427   HG21  THR  57          3HG2      THR  57   7.835   7.991   2.848
  428   HG22  THR  57          1HG2      THR  57   8.982   7.673   1.547
  429   HG23  THR  57          2HG2      THR  57   8.378   9.309   1.809
  430    H    GLY  58           H        GLY  58   9.469   5.292   2.760
  431    HA2  GLY  58           2HA      GLY  58   8.900   3.468   4.401
  432    HA3  GLY  58           1HA      GLY  58   8.277   4.757   5.402
  433    H    HIS  59           H        HIS  59   7.589   3.036   2.257
  434    HA   HIS  59           HA       HIS  59   5.099   4.451   2.045
  435    HB2  HIS  59           2HB      HIS  59   6.652   2.653   0.370
  436    HB3  HIS  59           1HB      HIS  59   4.936   2.251   0.343
  437    HD1  HIS  59           1HD      HIS  59   6.758   5.595   0.321
  438    HD2  HIS  59           2HD      HIS  59   3.869   3.502  -1.825
  439    HE1  HIS  59           1HE      HIS  59   5.988   7.170  -1.479
  440    HE2  HIS  59           2HE      HIS  59   4.185   5.911  -2.714
  441    H    ARG  60           H        ARG  60   3.243   3.951   2.815
  442    HA   ARG  60           HA       ARG  60   2.809   1.322   4.067
  443    HB2  ARG  60           2HB      ARG  60   1.434   2.566   5.752
  444    HB3  ARG  60           1HB      ARG  60   3.103   3.073   5.700
  445    HG2  ARG  60           2HG      ARG  60   1.116   4.597   4.094
  446    HG3  ARG  60           1HG      ARG  60   1.226   4.852   5.838
  447    HD2  ARG  60           2HD      ARG  60   3.859   4.868   4.998
  448    HD3  ARG  60           1HD      ARG  60   3.003   5.731   3.721
  449    HE   ARG  60           HE       ARG  60   2.018   6.936   5.866
  450   HH11  ARG  60          1HH1      ARG  60   5.319   6.084   5.109
  451   HH12  ARG  60          2HH1      ARG  60   5.995   7.391   6.021
  452   HH21  ARG  60          1HH2      ARG  60   2.910   8.655   7.062
  453   HH22  ARG  60          2HH2      ARG  60   4.629   8.848   7.128
  454    H    LEU  61           H        LEU  61   0.249   0.823   4.140
  455    HA   LEU  61           HA       LEU  61  -0.855   1.601   1.524
  456    HB2  LEU  61           2HB      LEU  61  -0.782  -0.988   2.994
  457    HB3  LEU  61           1HB      LEU  61  -2.135  -0.689   1.933
  458    HG   LEU  61           HG       LEU  61   0.042  -1.941   1.093
  459   HD11  LEU  61          1HD1      LEU  61  -1.884  -0.197  -0.274
  460   HD12  LEU  61          2HD1      LEU  61  -1.448  -1.882  -0.577
  461   HD13  LEU  61          3HD1      LEU  61  -0.426  -0.584  -1.182
  462   HD21  LEU  61          3HD2      LEU  61   1.475   0.016   1.699
  463   HD22  LEU  61          1HD2      LEU  61   0.694   0.895   0.382
  464   HD23  LEU  61          2HD2      LEU  61   1.630  -0.559   0.036
  465    H    CYS  62           H        CYS  62  -3.453   1.573   1.348
  466    HA   CYS  62           HA       CYS  62  -4.464   2.623   3.865
  467    HB2  CYS  62           2HB      CYS  62  -5.844   4.141   2.656
  468    HB3  CYS  62           1HB      CYS  62  -4.288   4.145   1.899
  469    H    SER  63           H        SER  63  -6.661   2.461   4.468
  470    HA   SER  63           HA       SER  63  -7.497   0.345   5.522
  471    HB2  SER  63           2HB      SER  63  -8.634   2.815   4.728
  472    HB3  SER  63           1HB      SER  63  -9.879   1.593   4.536
  473    HG   SER  63           HG       SER  63 -10.091   1.882   6.621
  474    H    VAL  64           H        VAL  64  -9.646   1.127   3.037
  475    HA   VAL  64           HA       VAL  64 -11.038  -1.167   2.876
  476    HB   VAL  64           HB       VAL  64 -11.946  -0.230   0.736
  477   HG11  VAL  64          1HG1      VAL  64 -13.026   1.552   1.857
  478   HG12  VAL  64          2HG1      VAL  64 -11.631   1.841   2.901
  479   HG13  VAL  64          3HG1      VAL  64 -12.620   0.394   3.124
  480   HG21  VAL  64          3HG2      VAL  64 -10.010   0.790  -0.189
  481   HG22  VAL  64          1HG2      VAL  64  -9.715   1.727   1.278
  482   HG23  VAL  64          2HG2      VAL  64 -11.105   2.099   0.256
  483    H    HIS  65           H        HIS  65  -8.273  -2.045   2.315
  484    HA   HIS  65           HA       HIS  65  -8.666  -3.200  -0.385
  485    HB2  HIS  65           2HB      HIS  65  -6.179  -3.712   1.165
  486    HB3  HIS  65           1HB      HIS  65  -6.415  -3.614  -0.572
  487    HD1  HIS  65           1HD      HIS  65  -8.055  -0.767   0.201
  488    HD2  HIS  65           2HD      HIS  65  -4.121  -1.867   0.624
  489    HE1  HIS  65           1HE      HIS  65  -6.835   1.357   0.587
  490    H    PHE  66           H        PHE  66  -7.685  -4.501   2.880
  491    HA   PHE  66           HA       PHE  66  -7.866  -7.150   2.006
  492    HB2  PHE  66           2HB      PHE  66  -8.189  -6.336   4.894
  493    HB3  PHE  66           1HB      PHE  66  -7.365  -7.745   4.237
  494    HD1  PHE  66           2HD      PHE  66  -7.095  -4.127   4.874
  495    HD2  PHE  66           1HD      PHE  66  -5.092  -7.627   3.496
  496    HE1  PHE  66           2HE      PHE  66  -4.942  -2.944   5.002
  497    HE2  PHE  66           1HE      PHE  66  -2.936  -6.448   3.629
  498    HZ   PHE  66           HZ       PHE  66  -2.855  -4.097   4.371
  499    H    GLN  67           H        GLN  67  -9.548  -8.787   3.158
  500    HA   GLN  67           HA       GLN  67 -12.143  -7.557   2.771
  501    HB2  GLN  67           2HB      GLN  67 -11.548  -9.683   1.583
  502    HB3  GLN  67           1HB      GLN  67 -11.486 -10.495   3.140
  503    HG2  GLN  67           2HG      GLN  67 -13.968  -9.027   2.517
  504    HG3  GLN  67           1HG      GLN  67 -13.645 -10.480   1.572
  505   HE21  GLN  67          1HE2      GLN  67 -15.205 -11.758   2.431
  506   HE22  GLN  67          2HE2      GLN  67 -15.231 -12.274   4.079
  507    H    GLY  68           H        GLY  68 -13.863  -7.795   4.688
  508    HA2  GLY  68           2HA      GLY  68 -14.396  -7.863   6.895
  509    HA3  GLY  68           1HA      GLY  68 -13.299  -9.225   7.015
  510    H    GLY  69           H        GLY  69 -10.835  -8.514   7.163
  511    HA2  GLY  69           2HA      GLY  69  -9.707  -6.223   7.747
  512    HA3  GLY  69           1HA      GLY  69 -10.739  -6.376   9.159
  513    H    ARG  70           H        ARG  70  -7.741  -6.405   8.707
  514    HA   ARG  70           HA       ARG  70  -6.023  -7.249   9.946
  515    HB2  ARG  70           2HB      ARG  70  -6.470  -8.390  11.825
  516    HB3  ARG  70           1HB      ARG  70  -8.154  -8.166  11.383
  517    HG2  ARG  70           2HG      ARG  70  -8.024 -10.393  10.206
  518    HG3  ARG  70           1HG      ARG  70  -6.444 -10.603  10.959
  519    HD2  ARG  70           2HD      ARG  70  -8.195  -9.803  13.007
  520    HD3  ARG  70           1HD      ARG  70  -9.051 -11.028  12.072
  521    HE   ARG  70           HE       ARG  70  -6.564 -12.081  12.462
  522   HH11  ARG  70          1HH1      ARG  70  -9.070 -10.861  14.561
  523   HH12  ARG  70          2HH1      ARG  70  -8.653 -11.907  15.875
  524   HH21  ARG  70          1HH2      ARG  70  -6.012 -13.456  14.189
  525   HH22  ARG  70          2HH2      ARG  70  -6.915 -13.381  15.665
  526    H    LYS  71           H        LYS  71  -7.099  -8.223   7.219
  527    HA   LYS  71           HA       LYS  71  -6.365  -9.599   5.559
  528    HB2  LYS  71           2HB      LYS  71  -4.084  -9.696   7.498
  529    HB3  LYS  71           1HB      LYS  71  -4.077 -10.757   6.097
  530    HG2  LYS  71           2HG      LYS  71  -3.999  -8.964   4.595
  531    HG3  LYS  71           1HG      LYS  71  -4.479  -7.803   5.833
  532    HD2  LYS  71           2HD      LYS  71  -1.942  -9.358   6.135
  533    HD3  LYS  71           1HD      LYS  71  -1.991  -7.933   5.094
  534    HE2  LYS  71           2HE      LYS  71  -3.255  -7.409   7.639
  535    HE3  LYS  71           1HE      LYS  71  -1.606  -7.998   7.857
  536    HZ1  LYS  71           3HZ      LYS  71  -0.829  -6.272   6.355
  537    HZ2  LYS  71           1HZ      LYS  71  -1.666  -5.594   7.660
  538    HZ3  LYS  71           2HZ      LYS  71  -2.409  -5.707   6.145
  539    H    THR  72           H        THR  72  -7.457 -11.403   5.122
  540    HA   THR  72           HA       THR  72  -6.864 -13.902   6.259
  541    HB   THR  72           HB       THR  72  -8.020 -12.927   8.224
  542    HG1  THR  72           1HG      THR  72  -8.206 -15.114   8.048
  543   HG21  THR  72          3HG2      THR  72  -9.922 -12.076   6.273
  544   HG22  THR  72          1HG2      THR  72  -9.838 -11.695   7.995
  545   HG23  THR  72          2HG2      THR  72 -10.708 -13.129   7.451
  546    H    TYR  73           H        TYR  73  -9.066 -15.363   5.923
  547    HA   TYR  73           HA       TYR  73 -10.509 -16.294   4.446
  548    HB2  TYR  73           2HB      TYR  73 -10.785 -13.473   3.941
  549    HB3  TYR  73           1HB      TYR  73 -10.948 -14.374   2.437
  550    HD1  TYR  73           1HD      TYR  73 -12.664 -16.212   2.303
  551    HD2  TYR  73           2HD      TYR  73 -12.529 -13.444   5.532
  552    HE1  TYR  73           1HE      TYR  73 -14.984 -16.786   2.883
  553    HE2  TYR  73           2HE      TYR  73 -14.849 -14.011   6.122
  554    HH   TYR  73           HH       TYR  73 -16.923 -14.998   4.696
  555    H    THR  74           H        THR  74  -8.293 -14.192   2.611
  556    HA   THR  74           HA       THR  74  -6.900 -16.344   1.424
  557    HB   THR  74           HB       THR  74  -8.151 -15.158  -0.871
  558    HG1  THR  74           1HG      THR  74 -10.046 -16.576   0.645
  559   HG21  THR  74          3HG2      THR  74  -8.104 -17.240  -1.668
  560   HG22  THR  74          1HG2      THR  74  -8.883 -17.917  -0.237
  561   HG23  THR  74          2HG2      THR  74  -7.147 -17.601  -0.232
  562    H    VAL  75           H        VAL  75  -7.868 -13.001   1.374
  563    HA   VAL  75           HA       VAL  75  -5.768 -12.188  -0.390
  564    HB   VAL  75           HB       VAL  75  -7.012 -10.074   1.247
  565   HG11  VAL  75          1HG1      VAL  75  -7.332  -9.103  -1.007
  566   HG12  VAL  75          2HG1      VAL  75  -6.705 -10.597  -1.710
  567   HG13  VAL  75          3HG1      VAL  75  -5.662  -9.585  -0.707
  568   HG21  VAL  75          3HG2      VAL  75  -8.986 -11.313   1.222
  569   HG22  VAL  75          1HG2      VAL  75  -8.659 -11.986  -0.375
  570   HG23  VAL  75          2HG2      VAL  75  -9.127 -10.293  -0.211
  571    H    ARG  76           H        ARG  76  -3.708 -11.919   0.146
  572    HA   ARG  76           HA       ARG  76  -3.054 -11.255   2.943
  573    HB2  ARG  76           2HB      ARG  76  -0.676 -12.099   1.877
  574    HB3  ARG  76           1HB      ARG  76  -1.774 -13.102   2.810
  575    HG2  ARG  76           2HG      ARG  76  -2.445 -14.296   1.001
  576    HG3  ARG  76           1HG      ARG  76  -2.245 -12.938  -0.110
  577    HD2  ARG  76           2HD      ARG  76   0.322 -13.503   0.825
  578    HD3  ARG  76           1HD      ARG  76  -0.417 -15.076   0.528
  579    HE   ARG  76           HE       ARG  76  -1.018 -13.709  -1.714
  580   HH11  ARG  76          1HH1      ARG  76   1.978 -14.221   0.002
  581   HH12  ARG  76          2HH1      ARG  76   2.957 -14.118  -1.423
  582   HH21  ARG  76          1HH2      ARG  76   0.268 -13.574  -3.588
  583   HH22  ARG  76          2HH2      ARG  76   1.987 -13.750  -3.461
  584    H    VAL  77           H        VAL  77  -2.181 -10.596  -0.437
  585    HA   VAL  77           HA       VAL  77  -0.677  -8.234   0.400
  586    HB   VAL  77           HB       VAL  77   0.496  -8.371  -1.586
  587   HG11  VAL  77          1HG1      VAL  77   1.114 -10.518  -1.984
  588   HG12  VAL  77          2HG1      VAL  77  -0.544 -11.116  -2.002
  589   HG13  VAL  77          3HG1      VAL  77   0.241 -10.738  -0.469
  590   HG21  VAL  77          3HG2      VAL  77  -1.340  -7.767  -3.015
  591   HG22  VAL  77          1HG2      VAL  77  -2.002  -9.399  -2.919
  592   HG23  VAL  77          2HG2      VAL  77  -0.459  -9.117  -3.727
  593    HA   PRO  78           HA       PRO  78  -4.340  -5.679  -0.097
  594    HB2  PRO  78           2HB      PRO  78  -2.203  -3.683  -0.679
  595    HB3  PRO  78           1HB      PRO  78  -3.628  -3.525   0.348
  596    HG2  PRO  78           2HG      PRO  78  -1.333  -3.943   1.512
  597    HG3  PRO  78           1HG      PRO  78  -2.696  -4.977   1.996
  598    HD2  PRO  78           2HD      PRO  78  -0.475  -5.569   0.082
  599    HD3  PRO  78           1HD      PRO  78  -1.079  -6.582   1.410
  600    H    THR  79           H        THR  79  -3.642  -7.062  -2.701
  601    HA   THR  79           HA       THR  79  -4.056  -4.607  -4.262
  602    HB   THR  79           HB       THR  79  -3.933  -6.907  -5.971
  603    HG1  THR  79           1HG      THR  79  -2.784  -8.088  -4.598
  604   HG21  THR  79          3HG2      THR  79  -2.464  -4.409  -5.605
  605   HG22  THR  79          1HG2      THR  79  -3.013  -5.204  -7.080
  606   HG23  THR  79          2HG2      THR  79  -1.523  -5.729  -6.293
  607    H    ILE  80           H        ILE  80  -6.058  -4.096  -4.262
  608    HA   ILE  80           HA       ILE  80  -8.043  -6.069  -5.165
  609    HB   ILE  80           HB       ILE  80  -8.082  -4.628  -2.671
  610   HG12  ILE  80          2HG1      ILE  80 -10.493  -5.924  -2.815
  611   HG13  ILE  80          1HG1      ILE  80  -9.537  -6.800  -4.008
  612   HG21  ILE  80          1HG2      ILE  80  -9.210  -2.783  -3.538
  613   HG22  ILE  80          2HG2      ILE  80 -10.481  -3.796  -2.854
  614   HG23  ILE  80          3HG2      ILE  80 -10.213  -3.774  -4.598
  615   HD11  ILE  80          3HD1      ILE  80  -8.005  -6.405  -1.619
  616   HD12  ILE  80          1HD1      ILE  80  -8.490  -7.907  -2.407
  617   HD13  ILE  80          2HD1      ILE  80  -9.564  -7.140  -1.234
  618    H    PHE  81           H        PHE  81  -7.984  -5.347  -7.379
  619    HA   PHE  81           HA       PHE  81  -9.207  -2.798  -7.852
  620    HB2  PHE  81           2HB      PHE  81  -6.525  -2.915  -9.171
  621    HB3  PHE  81           1HB      PHE  81  -7.485  -1.519  -8.723
  622    HD1  PHE  81           2HD      PHE  81  -7.685  -1.203  -6.033
  623    HD2  PHE  81           1HD      PHE  81  -4.536  -3.233  -8.060
  624    HE1  PHE  81           2HE      PHE  81  -6.237  -0.887  -4.088
  625    HE2  PHE  81           1HE      PHE  81  -3.071  -2.881  -6.113
  626    HZ   PHE  81           HZ       PHE  81  -3.932  -1.731  -4.093
  Start of MODEL    2
    1    H1   GLY   1           1HT      GLY   1  11.477  16.287  -4.036
    2    H2   GLY   1           2HT      GLY   1  10.553  16.357  -2.621
    3    H3   GLY   1           3HT      GLY   1  11.136  17.783  -3.321
    4    HA2  GLY   1           1HA      GLY   1   9.511  17.898  -4.841
    5    HA3  GLY   1           2HA      GLY   1   9.518  16.156  -5.080
    6    H    SER   2           H        SER   2   7.377  15.717  -4.913
    7    HA   SER   2           HA       SER   2   5.794  16.834  -2.766
    8    HB2  SER   2           2HB      SER   2   3.967  15.421  -3.782
    9    HB3  SER   2           1HB      SER   2   4.684  16.602  -4.878
   10    HG   SER   2           HG       SER   2   5.336  13.842  -4.739
   11    HA   PRO   3           HA       PRO   3   6.958  13.291  -0.208
   12    HB2  PRO   3           2HB      PRO   3   6.042  14.280   2.122
   13    HB3  PRO   3           1HB      PRO   3   7.549  14.843   1.391
   14    HG2  PRO   3           2HG      PRO   3   4.835  16.104   1.344
   15    HG3  PRO   3           1HG      PRO   3   6.416  16.863   1.600
   16    HD2  PRO   3           2HD      PRO   3   5.106  16.901  -0.792
   17    HD3  PRO   3           1HD      PRO   3   6.874  16.957  -0.646
   18    H    GLY   4           H        GLY   4   4.865  12.669  -1.767
   19    HA2  GLY   4           2HA      GLY   4   2.732  11.938   0.133
   20    HA3  GLY   4           1HA      GLY   4   2.425  12.322  -1.557
   21    H    PHE   5           H        PHE   5   1.328   9.984  -1.042
   22    HA   PHE   5           HA       PHE   5   2.274   8.156  -2.666
   23    HB2  PHE   5           2HB      PHE   5   3.490   6.489  -1.478
   24    HB3  PHE   5           1HB      PHE   5   4.396   7.994  -1.554
   25    HD1  PHE   5           1HD      PHE   5   2.157   6.045   0.665
   26    HD2  PHE   5           2HD      PHE   5   5.256   8.938   0.374
   27    HE1  PHE   5           1HE      PHE   5   2.410   6.019   3.118
   28    HE2  PHE   5           2HE      PHE   5   5.519   8.921   2.821
   29    HZ   PHE   5           HZ       PHE   5   4.092   7.457   4.197
   30    H    THR   6           H        THR   6   0.057   9.086  -0.654
   31    HA   THR   6           HA       THR   6  -1.205   7.268   0.802
   32    HB   THR   6           HB       THR   6  -2.979   8.157  -1.270
   33    HG1  THR   6           1HG      THR   6  -2.609  10.331  -1.020
   34   HG21  THR   6          3HG2      THR   6  -4.346   8.829   0.352
   35   HG22  THR   6          1HG2      THR   6  -3.039   9.451   1.349
   36   HG23  THR   6          2HG2      THR   6  -3.364   7.719   1.310
   37    H    CYS   7           H        CYS   7   0.112   5.381  -0.091
   38    HA   CYS   7           HA       CYS   7   0.125   3.320  -1.049
   39    HB2  CYS   7           2HB      CYS   7  -1.683   2.844   0.337
   40    HB3  CYS   7           1HB      CYS   7  -2.742   3.962  -0.501
   41    H    CYS   8           H        CYS   8  -0.230   5.862  -2.840
   42    HA   CYS   8           HA       CYS   8  -1.013   6.352  -5.009
   43    HB2  CYS   8           2HB      CYS   8   1.429   5.545  -4.977
   44    HB3  CYS   8           1HB      CYS   8   0.799   4.057  -5.656
   45    HG   CYS   8           HG       CYS   8   1.292   6.597  -7.182
   46    H    VAL   9           H        VAL   9  -3.066   5.458  -4.301
   47    HA   VAL   9           HA       VAL   9  -3.786   2.924  -5.522
   48    HB   VAL   9           HB       VAL   9  -5.084   2.673  -3.749
   49   HG11  VAL   9          1HG1      VAL   9  -4.645   3.865  -1.819
   50   HG12  VAL   9          2HG1      VAL   9  -4.236   5.313  -2.723
   51   HG13  VAL   9          3HG1      VAL   9  -3.179   3.923  -2.781
   52   HG21  VAL   9          3HG2      VAL   9  -6.866   4.217  -3.083
   53   HG22  VAL   9          1HG2      VAL   9  -6.898   3.879  -4.811
   54   HG23  VAL   9          2HG2      VAL   9  -6.238   5.405  -4.226
   55    HA   PRO  10           HA       PRO  10  -6.030   5.115  -8.682
   56    HB2  PRO  10           2HB      PRO  10  -6.649   3.016 -10.198
   57    HB3  PRO  10           1HB      PRO  10  -4.973   3.560 -10.050
   58    HG2  PRO  10           2HG      PRO  10  -6.330   1.229  -8.781
   59    HG3  PRO  10           1HG      PRO  10  -4.664   1.380  -9.366
   60    HD2  PRO  10           2HD      PRO  10  -5.525   1.640  -6.701
   61    HD3  PRO  10           1HD      PRO  10  -3.938   2.105  -7.345
   62    H    GLY  11           H        GLY  11  -7.290   3.105  -6.265
   63    HA2  GLY  11           2HA      GLY  11  -9.974   3.976  -6.934
   64    HA3  GLY  11           1HA      GLY  11  -9.724   2.247  -6.966
   65    H    CYS  12           H        CYS  12  -7.915   2.292  -4.513
   66    HA   CYS  12           HA       CYS  12 -10.017   1.929  -2.719
   67    HB2  CYS  12           2HB      CYS  12  -7.952   2.225  -0.949
   68    HB3  CYS  12           1HB      CYS  12  -8.453   0.736  -1.714
   69    H    TYR  13           H        TYR  13  -9.449   2.988  -0.298
   70    HA   TYR  13           HA       TYR  13 -10.947   5.254  -0.232
   71    HB2  TYR  13           2HB      TYR  13  -9.910   3.530   1.604
   72    HB3  TYR  13           1HB      TYR  13  -9.165   5.062   2.035
   73    HD1  TYR  13           1HD      TYR  13 -12.545   3.808   1.035
   74    HD2  TYR  13           2HD      TYR  13 -10.270   6.348   3.582
   75    HE1  TYR  13           1HE      TYR  13 -14.607   4.500   2.182
   76    HE2  TYR  13           2HE      TYR  13 -12.327   7.045   4.734
   77    HH   TYR  13           HH       TYR  13 -15.059   7.029   3.796
   78    H    ASN  14           H        ASN  14  -7.443   5.045  -0.107
   79    HA   ASN  14           HA       ASN  14  -7.226   7.960  -0.355
   80    HB2  ASN  14           2HB      ASN  14  -4.822   7.040   0.553
   81    HB3  ASN  14           1HB      ASN  14  -5.948   8.048   1.413
   82   HD21  ASN  14          1HD2      ASN  14  -7.727   5.449   1.466
   83   HD22  ASN  14          2HD2      ASN  14  -7.035   4.512   2.729
   84    H    ASN  15           H        ASN  15  -5.102   8.821  -1.491
   85    HA   ASN  15           HA       ASN  15  -4.005   6.694  -3.091
   86    HB2  ASN  15           2HB      ASN  15  -5.765   7.451  -4.520
   87    HB3  ASN  15           1HB      ASN  15  -5.249   9.127  -4.354
   88   HD21  ASN  15          1HD2      ASN  15  -5.475   8.704  -6.789
   89   HD22  ASN  15          2HD2      ASN  15  -4.020   8.258  -7.607
   90    H    SER  16           H        SER  16  -1.562   6.930  -3.376
   91    HA   SER  16           HA       SER  16   0.033   8.175  -2.109
   92    HB2  SER  16           2HB      SER  16   1.171   6.862  -3.608
   93    HB3  SER  16           1HB      SER  16   0.250   7.454  -4.941
   94    HG   SER  16           HG       SER  16   2.171   8.346  -5.283
   95    H    HIS  17           H        HIS  17   0.793   9.930  -4.908
   96    HA   HIS  17           HA       HIS  17   1.042  12.319  -3.416
   97    HB2  HIS  17           2HB      HIS  17   1.872  13.297  -5.461
   98    HB3  HIS  17           1HB      HIS  17   2.535  11.669  -5.293
   99    HD1  HIS  17           1HD      HIS  17  -0.491  10.635  -6.362
  100    HD2  HIS  17           2HD      HIS  17   2.393  12.935  -8.272
  101    HE1  HIS  17           1HE      HIS  17  -0.940  10.368  -8.821
  102    HE2  HIS  17           2HE      HIS  17   0.847  11.731  -9.960
  103    H    ARG  18           H        ARG  18  -1.536  11.790  -3.004
  104    HA   ARG  18           HA       ARG  18  -2.880  13.915  -4.473
  105    HB2  ARG  18           2HB      ARG  18  -3.249  11.629  -5.537
  106    HB3  ARG  18           1HB      ARG  18  -4.191  11.239  -4.105
  107    HG2  ARG  18           2HG      ARG  18  -5.831  12.791  -4.612
  108    HG3  ARG  18           1HG      ARG  18  -4.793  13.667  -5.742
  109    HD2  ARG  18           2HD      ARG  18  -4.909  11.031  -6.691
  110    HD3  ARG  18           1HD      ARG  18  -6.564  11.451  -6.237
  111    HE   ARG  18           HE       ARG  18  -6.625  12.990  -7.950
  112   HH11  ARG  18          1HH1      ARG  18  -3.352  11.848  -7.521
  113   HH12  ARG  18          2HH1      ARG  18  -2.781  12.555  -8.995
  114   HH21  ARG  18          1HH2      ARG  18  -5.872  13.922  -9.884
  115   HH22  ARG  18          2HH2      ARG  18  -4.210  13.732 -10.336
  116    H    ASP  19           H        ASP  19  -2.214  12.539  -1.493
  117    HA   ASP  19           HA       ASP  19  -4.116  14.223  -0.206
  118    HB2  ASP  19           2HB      ASP  19  -5.826  12.779  -0.301
  119    HB3  ASP  19           1HB      ASP  19  -4.792  11.403  -0.625
  120    H    LYS  20           H        LYS  20  -2.549  11.193   0.787
  121    HA   LYS  20           HA       LYS  20  -1.042  10.698   2.428
  122    HB2  LYS  20           2HB      LYS  20  -0.554  13.676   2.411
  123    HB3  LYS  20           1HB      LYS  20   0.400  12.516   3.324
  124    HG2  LYS  20           2HG      LYS  20   1.573  11.902   1.542
  125    HG3  LYS  20           1HG      LYS  20   0.146  11.836   0.505
  126    HD2  LYS  20           2HD      LYS  20   0.730  14.565   1.175
  127    HD3  LYS  20           1HD      LYS  20   2.180  13.790   0.535
  128    HE2  LYS  20           2HE      LYS  20   1.314  14.276  -1.474
  129    HE3  LYS  20           1HE      LYS  20   0.261  12.891  -1.183
  130    HZ1  LYS  20           3HZ      LYS  20  -1.287  14.466  -1.639
  131    HZ2  LYS  20           1HZ      LYS  20  -0.347  15.748  -1.057
  132    HZ3  LYS  20           2HZ      LYS  20  -1.154  14.730   0.026
  133    H    ALA  21           H        ALA  21  -3.870  11.957   2.976
  134    HA   ALA  21           HA       ALA  21  -3.536  12.465   5.838
  135    HB1  ALA  21           1HB      ALA  21  -6.189  12.930   4.689
  136    HB2  ALA  21           2HB      ALA  21  -4.887  13.913   4.017
  137    HB3  ALA  21           3HB      ALA  21  -5.206  13.938   5.752
  138    H    LEU  22           H        LEU  22  -5.591  10.341   3.732
  139    HA   LEU  22           HA       LEU  22  -7.219   9.307   5.693
  140    HB2  LEU  22           2HB      LEU  22  -6.336   7.652   3.338
  141    HB3  LEU  22           1HB      LEU  22  -7.955   7.811   4.025
  142    HG   LEU  22           HG       LEU  22  -6.625   9.455   1.972
  143   HD11  LEU  22          1HD1      LEU  22  -9.265   8.250   2.529
  144   HD12  LEU  22          2HD1      LEU  22  -8.352   8.356   1.026
  145   HD13  LEU  22          3HD1      LEU  22  -9.248   9.751   1.607
  146   HD21  LEU  22          3HD2      LEU  22  -8.553  11.160   2.756
  147   HD22  LEU  22          1HD2      LEU  22  -6.843  11.329   3.129
  148   HD23  LEU  22          2HD2      LEU  22  -7.928  10.607   4.308
  149    H    HIS  23           H        HIS  23  -6.671   6.301   5.627
  150    HA   HIS  23           HA       HIS  23  -4.609   6.392   7.635
  151    HB2  HIS  23           2HB      HIS  23  -7.096   5.175   7.453
  152    HB3  HIS  23           1HB      HIS  23  -5.976   3.841   7.242
  153    HD1  HIS  23           1HD      HIS  23  -3.865   4.152   9.214
  154    HD2  HIS  23           2HD      HIS  23  -7.749   5.361  10.058
  155    HE1  HIS  23           1HE      HIS  23  -4.022   4.203  11.723
  156    HE2  HIS  23           2HE      HIS  23  -6.414   4.829  12.208
  157    H    PHE  24           H        PHE  24  -2.650   5.039   7.530
  158    HA   PHE  24           HA       PHE  24  -2.353   3.493   5.061
  159    HB2  PHE  24           2HB      PHE  24  -0.219   5.215   6.369
  160    HB3  PHE  24           1HB      PHE  24   0.016   4.197   4.965
  161    HD1  PHE  24           2HD      PHE  24  -2.676   6.707   5.759
  162    HD2  PHE  24           1HD      PHE  24   0.527   5.611   3.156
  163    HE1  PHE  24           2HE      PHE  24  -3.192   8.599   4.279
  164    HE2  PHE  24           1HE      PHE  24   0.026   7.477   1.728
  165    HZ   PHE  24           HZ       PHE  24  -1.865   8.970   2.194
  166    H    TYR  25           H        TYR  25  -1.782   1.245   5.592
  167    HA   TYR  25           HA       TYR  25  -1.010   0.544   8.292
  168    HB2  TYR  25           2HB      TYR  25  -1.544  -1.110   5.796
  169    HB3  TYR  25           1HB      TYR  25  -0.905  -1.819   7.265
  170    HD1  TYR  25           1HD      TYR  25  -3.589   0.719   6.784
  171    HD2  TYR  25           2HD      TYR  25  -2.542  -3.171   8.131
  172    HE1  TYR  25           1HE      TYR  25  -5.880   0.406   7.636
  173    HE2  TYR  25           2HE      TYR  25  -4.821  -3.507   8.987
  174    HH   TYR  25           HH       TYR  25  -7.253  -2.329   8.252
  175    H    THR  26           H        THR  26   1.120  -0.758   8.683
  176    HA   THR  26           HA       THR  26   3.115   0.259   6.788
  177    HB   THR  26           HB       THR  26   4.532   0.547   8.539
  178    HG1  THR  26           1HG      THR  26   5.160  -1.066   9.750
  179   HG21  THR  26          3HG2      THR  26   3.558   0.901  10.699
  180   HG22  THR  26          1HG2      THR  26   2.143  -0.057  10.261
  181   HG23  THR  26          2HG2      THR  26   2.448   1.484   9.458
  182    H    PHE  27           H        PHE  27   5.178  -1.243   6.639
  183    HA   PHE  27           HA       PHE  27   4.148  -3.615   5.480
  184    HB2  PHE  27           2HB      PHE  27   6.584  -2.029   5.241
  185    HB3  PHE  27           1HB      PHE  27   6.701  -3.705   4.765
  186    HD1  PHE  27           1HD      PHE  27   3.815  -1.415   4.329
  187    HD2  PHE  27           2HD      PHE  27   6.997  -3.543   2.488
  188    HE1  PHE  27           1HE      PHE  27   2.912  -0.860   2.111
  189    HE2  PHE  27           2HE      PHE  27   6.106  -3.048   0.325
  190    HZ   PHE  27           HZ       PHE  27   4.060  -1.691   0.084
  191    HA   PRO  28           HA       PRO  28   5.568  -7.069   8.039
  192    HB2  PRO  28           2HB      PRO  28   6.893  -7.712   5.380
  193    HB3  PRO  28           1HB      PRO  28   6.126  -8.845   6.490
  194    HG2  PRO  28           2HG      PRO  28   4.799  -7.994   4.417
  195    HG3  PRO  28           1HG      PRO  28   3.984  -8.038   5.982
  196    HD2  PRO  28           2HD      PRO  28   4.939  -5.741   4.392
  197    HD3  PRO  28           1HD      PRO  28   3.594  -5.872   5.529
  198    H    LYS  29           H        LYS  29   7.797  -8.197   8.535
  199    HA   LYS  29           HA       LYS  29   9.849  -6.132   8.644
  200    HB2  LYS  29           2HB      LYS  29  10.666  -8.608   9.871
  201    HB3  LYS  29           1HB      LYS  29  10.411  -7.035  10.609
  202    HG2  LYS  29           2HG      LYS  29   8.021  -7.547  10.841
  203    HG3  LYS  29           1HG      LYS  29   8.309  -9.139  10.135
  204    HD2  LYS  29           2HD      LYS  29  10.133  -9.228  12.070
  205    HD3  LYS  29           1HD      LYS  29   9.011  -8.091  12.820
  206    HE2  LYS  29           2HE      LYS  29   7.634  -9.747  13.364
  207    HE3  LYS  29           1HE      LYS  29   7.540 -10.266  11.681
  208    HZ1  LYS  29           3HZ      LYS  29   9.956 -11.002  13.125
  209    HZ2  LYS  29           1HZ      LYS  29   9.050 -11.889  12.004
  210    HZ3  LYS  29           2HZ      LYS  29   8.535 -11.780  13.611
  211    H    ASP  30           H        ASP  30   9.087  -8.806   6.737
  212    HA   ASP  30           HA       ASP  30  11.825  -9.484   6.039
  213    HB2  ASP  30           2HB      ASP  30   9.915 -10.611   4.222
  214    HB3  ASP  30           1HB      ASP  30  10.890 -11.454   5.417
  215    H    ALA  31           H        ALA  31  12.957  -8.205   4.644
  216    HA   ALA  31           HA       ALA  31  12.088  -6.091   3.262
  217    HB1  ALA  31           1HB      ALA  31  14.405  -7.897   2.913
  218    HB2  ALA  31           2HB      ALA  31  14.329  -6.182   3.293
  219    HB3  ALA  31           3HB      ALA  31  14.089  -6.715   1.637
  220    H    GLU  32           H        GLU  32  12.560  -9.204   1.389
  221    HA   GLU  32           HA       GLU  32  11.302  -8.271  -0.937
  222    HB2  GLU  32           2HB      GLU  32  12.545 -10.250  -1.091
  223    HB3  GLU  32           1HB      GLU  32  11.700 -11.077   0.152
  224    HG2  GLU  32           2HG      GLU  32  10.352 -10.264  -2.400
  225    HG3  GLU  32           1HG      GLU  32  11.282 -11.755  -2.274
  226    H    LEU  33           H        LEU  33   9.544 -10.429   1.470
  227    HA   LEU  33           HA       LEU  33   7.154 -10.297   0.247
  228    HB2  LEU  33           2HB      LEU  33   7.768 -11.118   2.647
  229    HB3  LEU  33           1HB      LEU  33   7.322  -9.511   3.144
  230    HG   LEU  33           HG       LEU  33   5.211 -10.094   3.254
  231   HD11  LEU  33          1HD1      LEU  33   5.425 -11.076   0.418
  232   HD12  LEU  33          2HD1      LEU  33   4.919  -9.473   0.937
  233   HD13  LEU  33          3HD1      LEU  33   3.922 -10.876   1.314
  234   HD21  LEU  33          3HD2      LEU  33   6.424 -12.681   2.528
  235   HD22  LEU  33          1HD2      LEU  33   4.670 -12.557   2.592
  236   HD23  LEU  33          2HD2      LEU  33   5.629 -12.179   4.021
  237    H    ARG  34           H        ARG  34   8.809  -7.743   1.882
  238    HA   ARG  34           HA       ARG  34   6.793  -5.782   1.886
  239    HB2  ARG  34           2HB      ARG  34   8.356  -4.640   3.017
  240    HB3  ARG  34           1HB      ARG  34   9.489  -5.916   2.682
  241    HG2  ARG  34           2HG      ARG  34   9.935  -4.641   0.483
  242    HG3  ARG  34           1HG      ARG  34   9.106  -3.304   1.273
  243    HD2  ARG  34           2HD      ARG  34  11.658  -4.671   2.044
  244    HD3  ARG  34           1HD      ARG  34  11.386  -2.965   1.698
  245    HE   ARG  34           HE       ARG  34   9.861  -3.762   3.942
  246   HH11  ARG  34          1HH1      ARG  34  13.138  -3.056   2.975
  247   HH12  ARG  34          2HH1      ARG  34  13.634  -2.567   4.560
  248   HH21  ARG  34          1HH2      ARG  34  10.512  -3.118   6.029
  249   HH22  ARG  34          2HH2      ARG  34  12.143  -2.602   6.294
  250    H    ARG  35           H        ARG  35   9.516  -6.183  -0.324
  251    HA   ARG  35           HA       ARG  35   8.705  -4.242  -2.126
  252    HB2  ARG  35           2HB      ARG  35  10.278  -5.049  -3.636
  253    HB3  ARG  35           1HB      ARG  35  10.942  -5.491  -2.076
  254    HG2  ARG  35           2HG      ARG  35  11.307  -7.286  -3.575
  255    HG3  ARG  35           1HG      ARG  35  10.066  -7.803  -2.446
  256    HD2  ARG  35           2HD      ARG  35   8.553  -8.058  -4.084
  257    HD3  ARG  35           1HD      ARG  35   8.973  -6.509  -4.813
  258    HE   ARG  35           HE       ARG  35  10.477  -7.584  -6.209
  259   HH11  ARG  35          1HH1      ARG  35   9.155  -9.839  -3.891
  260   HH12  ARG  35          2HH1      ARG  35   9.747 -11.233  -4.728
  261   HH21  ARG  35          1HH2      ARG  35  11.251  -9.419  -7.306
  262   HH22  ARG  35          2HH2      ARG  35  10.935 -10.997  -6.664
  263    H    LEU  36           H        LEU  36   7.564  -7.551  -1.624
  264    HA   LEU  36           HA       LEU  36   6.157  -7.724  -4.135
  265    HB2  LEU  36           2HB      LEU  36   5.604  -8.967  -1.447
  266    HB3  LEU  36           1HB      LEU  36   4.530  -9.200  -2.805
  267    HG   LEU  36           HG       LEU  36   7.412 -10.060  -2.607
  268   HD11  LEU  36          1HD1      LEU  36   4.793 -11.533  -2.700
  269   HD12  LEU  36          2HD1      LEU  36   6.019 -11.569  -1.434
  270   HD13  LEU  36          3HD1      LEU  36   6.348 -12.309  -3.002
  271   HD21  LEU  36          3HD2      LEU  36   5.517 -10.063  -4.943
  272   HD22  LEU  36          1HD2      LEU  36   6.931 -11.113  -4.853
  273   HD23  LEU  36          2HD2      LEU  36   7.132  -9.361  -4.848
  274    H    TRP  37           H        TRP  37   5.206  -6.351  -1.026
  275    HA   TRP  37           HA       TRP  37   2.630  -5.619  -1.835
  276    HB2  TRP  37           2HB      TRP  37   4.552  -4.583   0.218
  277    HB3  TRP  37           1HB      TRP  37   3.008  -3.779  -0.057
  278    HD1  TRP  37           HD       TRP  37   3.352  -7.576  -0.271
  279    HE1  TRP  37           1HE      TRP  37   2.019  -8.625   1.703
  280    HE3  TRP  37           3HE      TRP  37   2.057  -3.315   2.140
  281    HZ2  TRP  37           2HZ      TRP  37   0.562  -7.683   3.982
  282    HZ3  TRP  37           3HZ      TRP  37   0.716  -3.438   4.190
  283    HH2  TRP  37           HH       TRP  37  -0.028  -5.537   5.065
  284    H    LEU  38           H        LEU  38   5.834  -3.998  -2.168
  285    HA   LEU  38           HA       LEU  38   5.257  -1.439  -2.973
  286    HB2  LEU  38           2HB      LEU  38   7.181  -3.499  -4.002
  287    HB3  LEU  38           1HB      LEU  38   7.059  -1.976  -4.800
  288    HG   LEU  38           HG       LEU  38   7.712  -0.775  -2.847
  289   HD11  LEU  38          1HD1      LEU  38   8.396  -2.116  -0.796
  290   HD12  LEU  38          2HD1      LEU  38   7.311  -3.344  -1.439
  291   HD13  LEU  38          3HD1      LEU  38   6.693  -1.741  -1.056
  292   HD21  LEU  38          3HD2      LEU  38   9.708  -1.268  -3.742
  293   HD22  LEU  38          1HD2      LEU  38   9.360  -2.996  -3.817
  294   HD23  LEU  38          2HD2      LEU  38   9.878  -2.267  -2.296
  295    H    LYS  39           H        LYS  39   4.932  -4.510  -4.918
  296    HA   LYS  39           HA       LYS  39   4.035  -3.470  -7.299
  297    HB2  LYS  39           2HB      LYS  39   3.959  -5.994  -5.828
  298    HB3  LYS  39           1HB      LYS  39   2.668  -5.848  -6.988
  299    HG2  LYS  39           2HG      LYS  39   4.914  -6.946  -7.638
  300    HG3  LYS  39           1HG      LYS  39   4.116  -5.859  -8.783
  301    HD2  LYS  39           2HD      LYS  39   5.953  -4.528  -6.920
  302    HD3  LYS  39           1HD      LYS  39   6.729  -5.694  -7.992
  303    HE2  LYS  39           2HE      LYS  39   5.103  -4.378  -9.726
  304    HE3  LYS  39           1HE      LYS  39   5.512  -3.091  -8.594
  305    HZ1  LYS  39           3HZ      LYS  39   7.345  -2.881  -9.823
  306    HZ2  LYS  39           1HZ      LYS  39   7.160  -4.394 -10.560
  307    HZ3  LYS  39           2HZ      LYS  39   7.899  -4.275  -9.043
  308    H    ASN  40           H        ASN  40   1.941  -4.655  -4.679
  309    HA   ASN  40           HA       ASN  40  -0.501  -3.995  -5.830
  310    HB2  ASN  40           2HB      ASN  40  -0.641  -3.707  -2.943
  311    HB3  ASN  40           1HB      ASN  40  -1.392  -4.900  -3.996
  312   HD21  ASN  40          1HD2      ASN  40   0.404  -6.486  -4.905
  313   HD22  ASN  40          2HD2      ASN  40   1.402  -7.172  -3.674
  314    H    VAL  41           H        VAL  41   1.728  -1.918  -4.278
  315    HA   VAL  41           HA       VAL  41  -0.176   0.079  -3.589
  316    HB   VAL  41           HB       VAL  41   2.207  -0.401  -2.561
  317   HG11  VAL  41          1HG1      VAL  41   3.479   0.275  -4.529
  318   HG12  VAL  41          2HG1      VAL  41   3.806   1.338  -3.166
  319   HG13  VAL  41          3HG1      VAL  41   2.742   1.870  -4.464
  320   HG21  VAL  41          3HG2      VAL  41   0.595   0.997  -1.511
  321   HG22  VAL  41          1HG2      VAL  41   0.790   2.244  -2.741
  322   HG23  VAL  41          2HG2      VAL  41   2.097   1.919  -1.606
  323    H    SER  42           H        SER  42   1.620  -0.488  -6.545
  324    HA   SER  42           HA       SER  42   0.203   1.143  -8.140
  325    HB2  SER  42           2HB      SER  42   0.321   3.246  -7.230
  326    HB3  SER  42           1HB      SER  42   1.862   2.946  -6.405
  327    HG   SER  42           HG       SER  42   2.854   3.799  -8.058
  328    H    ARG  43           H        ARG  43   3.722   2.189  -8.151
  329    HA   ARG  43           HA       ARG  43   5.410   1.546  -9.509
  330    HB2  ARG  43           2HB      ARG  43   4.933  -0.781  -8.931
  331    HB3  ARG  43           1HB      ARG  43   3.682  -0.848 -10.161
  332    HG2  ARG  43           2HG      ARG  43   5.889  -1.899 -10.757
  333    HG3  ARG  43           1HG      ARG  43   5.244  -0.736 -11.914
  334    HD2  ARG  43           2HD      ARG  43   7.735  -0.593 -11.340
  335    HD3  ARG  43           1HD      ARG  43   6.799   0.901 -11.314
  336    HE   ARG  43           HE       ARG  43   6.963  -0.396  -8.757
  337   HH11  ARG  43          1HH1      ARG  43   8.553   1.805 -10.949
  338   HH12  ARG  43          2HH1      ARG  43   9.434   2.613  -9.696
  339   HH21  ARG  43          1HH2      ARG  43   8.125   0.664  -7.108
  340   HH22  ARG  43          2HH2      ARG  43   9.193   1.966  -7.518
  341    H    ALA  44           H        ALA  44   2.486   2.611 -10.451
  342    HA   ALA  44           HA       ALA  44   2.487   2.254 -13.260
  343    HB1  ALA  44           1HB      ALA  44   0.633   3.076 -11.584
  344    HB2  ALA  44           2HB      ALA  44   0.631   3.615 -13.263
  345    HB3  ALA  44           3HB      ALA  44   1.262   4.672 -11.998
  346    H    GLY  45           H        GLY  45   5.040   2.792 -13.485
  347    HA2  GLY  45           2HA      GLY  45   5.822   5.513 -13.178
  348    HA3  GLY  45           1HA      GLY  45   6.690   4.265 -14.045
  349    H    VAL  46           H        VAL  46   3.553   5.843 -14.511
  350    HA   VAL  46           HA       VAL  46   4.061   6.048 -17.365
  351    HB   VAL  46           HB       VAL  46   1.880   5.252 -16.708
  352   HG11  VAL  46          1HG1      VAL  46   1.602   6.152 -14.535
  353   HG12  VAL  46          2HG1      VAL  46   0.302   6.816 -15.524
  354   HG13  VAL  46          3HG1      VAL  46   1.705   7.809 -15.132
  355   HG21  VAL  46          3HG2      VAL  46   0.650   6.456 -18.212
  356   HG22  VAL  46          1HG2      VAL  46   2.267   7.029 -18.625
  357   HG23  VAL  46          2HG2      VAL  46   1.218   8.010 -17.601
  358    H    SER  47           H        SER  47   5.889   7.708 -16.340
  359    HA   SER  47           HA       SER  47   4.811  10.339 -17.060
  360    HB2  SER  47           2HB      SER  47   5.393  11.434 -15.057
  361    HB3  SER  47           1HB      SER  47   4.641   9.934 -14.508
  362    HG   SER  47           HG       SER  47   6.851  10.739 -13.653
  363    H    GLY  48           H        GLY  48   7.935   8.760 -15.678
  364    HA2  GLY  48           2HA      GLY  48   9.359   9.203 -18.051
  365    HA3  GLY  48           1HA      GLY  48   9.588  10.611 -17.027
  366    H    CYS  49           H        CYS  49  11.863   9.879 -17.187
  367    HA   CYS  49           HA       CYS  49  12.498   7.590 -15.478
  368    HB2  CYS  49           2HB      CYS  49  14.435   9.267 -17.074
  369    HB3  CYS  49           1HB      CYS  49  14.700   7.661 -16.402
  370    HG   CYS  49           HG       CYS  49  12.603   7.150 -18.274
  371    H    PHE  50           H        PHE  50  11.433   9.908 -14.243
  372    HA   PHE  50           HA       PHE  50  13.739  11.222 -12.982
  373    HB2  PHE  50           2HB      PHE  50  11.148  12.077 -13.682
  374    HB3  PHE  50           1HB      PHE  50  11.131  11.993 -11.924
  375    HD1  PHE  50           2HD      PHE  50  13.913  12.734 -11.291
  376    HD2  PHE  50           1HD      PHE  50  11.201  14.344 -14.148
  377    HE1  PHE  50           2HE      PHE  50  15.082  14.896 -11.177
  378    HE2  PHE  50           1HE      PHE  50  12.366  16.509 -14.040
  379    HZ   PHE  50           HZ       PHE  50  14.308  16.787 -12.552
  380    H    SER  51           H        SER  51  10.570   9.901 -11.656
  381    HA   SER  51           HA       SER  51  11.763   8.001  -9.984
  382    HB2  SER  51           2HB      SER  51  11.977   9.028  -7.895
  383    HB3  SER  51           1HB      SER  51  12.603  10.263  -8.985
  384    HG   SER  51           HG       SER  51  10.238  10.210  -7.517
  385    H    THR  52           H        THR  52  10.108   7.816  -7.870
  386    HA   THR  52           HA       THR  52   7.399   8.479  -8.435
  387    HB   THR  52           HB       THR  52   7.652   6.803 -10.174
  388    HG1  THR  52           1HG      THR  52   5.704   6.297  -9.642
  389   HG21  THR  52          3HG2      THR  52   8.807   5.162  -7.988
  390   HG22  THR  52          1HG2      THR  52   9.289   5.301  -9.678
  391   HG23  THR  52          2HG2      THR  52   7.861   4.361  -9.242
  392    H    PHE  53           H        PHE  53   8.504   8.995  -6.103
  393    HA   PHE  53           HA       PHE  53   8.650   8.526  -3.856
  394    HB2  PHE  53           2HB      PHE  53   6.466   7.696  -2.940
  395    HB3  PHE  53           1HB      PHE  53   6.297   9.052  -4.060
  396    HD1  PHE  53           1HD      PHE  53   6.069   5.322  -3.860
  397    HD2  PHE  53           2HD      PHE  53   4.951   8.892  -5.917
  398    HE1  PHE  53           1HE      PHE  53   4.506   4.044  -5.241
  399    HE2  PHE  53           2HE      PHE  53   3.386   7.604  -7.301
  400    HZ   PHE  53           HZ       PHE  53   3.165   5.181  -6.969
  401    H    GLN  54           H        GLN  54   9.834   6.439  -5.543
  402    HA   GLN  54           HA       GLN  54   9.363   3.880  -5.221
  403    HB2  GLN  54           2HB      GLN  54  12.015   5.118  -4.540
  404    HB3  GLN  54           1HB      GLN  54  11.784   3.426  -4.919
  405    HG2  GLN  54           2HG      GLN  54  11.239   3.884  -7.152
  406    HG3  GLN  54           1HG      GLN  54  11.000   5.599  -6.830
  407   HE21  GLN  54          1HE2      GLN  54  12.952   3.601  -8.370
  408   HE22  GLN  54          2HE2      GLN  54  14.466   4.417  -8.210
  409    HA   PRO  55           HA       PRO  55   8.538   3.271  -0.829
  410    HB2  PRO  55           2HB      PRO  55   8.473   0.424  -1.612
  411    HB3  PRO  55           1HB      PRO  55   7.236   1.405  -0.835
  412    HG2  PRO  55           2HG      PRO  55   6.960   0.679  -3.378
  413    HG3  PRO  55           1HG      PRO  55   6.477   2.296  -2.839
  414    HD2  PRO  55           2HD      PRO  55   8.990   1.450  -4.254
  415    HD3  PRO  55           1HD      PRO  55   7.918   2.839  -4.580
  416    H    THR  56           H        THR  56  11.124   3.795  -1.074
  417    HA   THR  56           HA       THR  56  12.679   1.416  -0.323
  418    HB   THR  56           HB       THR  56  13.872   4.165  -0.423
  419    HG1  THR  56           1HG      THR  56  13.504   4.435  -2.464
  420   HG21  THR  56          3HG2      THR  56  15.469   2.526  -0.022
  421   HG22  THR  56          1HG2      THR  56  15.596   2.835  -1.753
  422   HG23  THR  56          2HG2      THR  56  14.744   1.404  -1.174
  423    H    THR  57           H        THR  57  11.749   4.702   1.006
  424    HA   THR  57           HA       THR  57  13.119   4.324   3.456
  425    HB   THR  57           HB       THR  57  12.519   6.540   2.651
  426    HG1  THR  57           1HG      THR  57  12.518   7.005   4.682
  427   HG21  THR  57          3HG2      THR  57   9.669   6.191   3.394
  428   HG22  THR  57          1HG2      THR  57  10.198   5.664   1.796
  429   HG23  THR  57          2HG2      THR  57  10.422   7.342   2.290
  430    H    GLY  58           H        GLY  58   9.670   3.928   2.582
  431    HA2  GLY  58           2HA      GLY  58   9.128   1.708   4.103
  432    HA3  GLY  58           1HA      GLY  58   9.023   3.036   5.232
  433    H    HIS  59           H        HIS  59   7.594   1.985   2.045
  434    HA   HIS  59           HA       HIS  59   5.415   3.828   2.433
  435    HB2  HIS  59           2HB      HIS  59   6.273   1.954   0.312
  436    HB3  HIS  59           1HB      HIS  59   4.550   2.248   0.422
  437    HD1  HIS  59           1HD      HIS  59   7.023   4.992   1.096
  438    HD2  HIS  59           2HD      HIS  59   4.416   3.727  -1.877
  439    HE1  HIS  59           1HE      HIS  59   6.903   6.891  -0.560
  440    HE2  HIS  59           2HE      HIS  59   5.229   6.147  -2.270
  441    H    ARG  60           H        ARG  60   3.227   3.233   2.654
  442    HA   ARG  60           HA       ARG  60   2.763   0.680   4.069
  443    HB2  ARG  60           2HB      ARG  60   1.004   2.331   5.293
  444    HB3  ARG  60           1HB      ARG  60   2.649   2.086   5.835
  445    HG2  ARG  60           2HG      ARG  60   2.022   4.282   3.911
  446    HG3  ARG  60           1HG      ARG  60   1.758   4.485   5.644
  447    HD2  ARG  60           2HD      ARG  60   4.293   3.374   5.468
  448    HD3  ARG  60           1HD      ARG  60   4.229   4.519   4.129
  449    HE   ARG  60           HE       ARG  60   4.425   6.178   5.668
  450   HH11  ARG  60          1HH1      ARG  60   2.980   3.423   7.248
  451   HH12  ARG  60          2HH1      ARG  60   2.908   4.192   8.797
  452   HH21  ARG  60          1HH2      ARG  60   4.332   7.191   7.706
  453   HH22  ARG  60          2HH2      ARG  60   3.672   6.332   9.057
  454    H    LEU  61           H        LEU  61   0.188   0.183   4.150
  455    HA   LEU  61           HA       LEU  61  -0.880   0.745   1.455
  456    HB2  LEU  61           2HB      LEU  61  -1.197  -1.612   3.306
  457    HB3  LEU  61           1HB      LEU  61  -2.356  -1.334   2.030
  458    HG   LEU  61           HG       LEU  61   0.407  -2.296   1.883
  459   HD11  LEU  61          1HD1      LEU  61  -0.478  -4.049   0.933
  460   HD12  LEU  61          2HD1      LEU  61  -1.357  -3.064  -0.232
  461   HD13  LEU  61          3HD1      LEU  61  -2.040  -3.367   1.369
  462   HD21  LEU  61          3HD2      LEU  61   0.717  -1.663  -0.408
  463   HD22  LEU  61          1HD2      LEU  61   0.564  -0.235   0.614
  464   HD23  LEU  61          2HD2      LEU  61  -0.799  -0.761  -0.371
  465    H    CYS  62           H        CYS  62  -3.448   1.016   1.338
  466    HA   CYS  62           HA       CYS  62  -4.318   2.132   3.891
  467    HB2  CYS  62           2HB      CYS  62  -5.103   4.055   2.787
  468    HB3  CYS  62           1HB      CYS  62  -3.640   3.642   2.012
  469    H    SER  63           H        SER  63  -6.865   2.543   3.874
  470    HA   SER  63           HA       SER  63  -8.213   0.748   4.905
  471    HB2  SER  63           2HB      SER  63  -8.809   3.179   3.542
  472    HB3  SER  63           1HB      SER  63 -10.132   2.062   3.254
  473    HG   SER  63           HG       SER  63 -10.266   1.747   5.522
  474    H    VAL  64           H        VAL  64  -9.553   1.259   1.820
  475    HA   VAL  64           HA       VAL  64 -10.983  -1.147   1.954
  476    HB   VAL  64           HB       VAL  64 -11.845  -0.571  -0.304
  477   HG11  VAL  64          1HG1      VAL  64 -13.224   0.266   1.308
  478   HG12  VAL  64          2HG1      VAL  64 -12.654   1.789   0.627
  479   HG13  VAL  64          3HG1      VAL  64 -11.929   1.159   2.107
  480   HG21  VAL  64          3HG2      VAL  64  -9.592   1.296  -0.091
  481   HG22  VAL  64          1HG2      VAL  64 -11.100   1.995  -0.688
  482   HG23  VAL  64          2HG2      VAL  64 -10.384   0.612  -1.517
  483    H    HIS  65           H        HIS  65  -8.249  -2.021   1.773
  484    HA   HIS  65           HA       HIS  65  -8.701  -3.799  -0.519
  485    HB2  HIS  65           2HB      HIS  65  -6.015  -3.591  -0.744
  486    HB3  HIS  65           1HB      HIS  65  -7.188  -2.726  -1.726
  487    HD1  HIS  65           1HD      HIS  65  -7.997  -0.443  -0.360
  488    HD2  HIS  65           2HD      HIS  65  -4.113  -1.856   0.083
  489    HE1  HIS  65           1HE      HIS  65  -6.676   1.492   0.432
  490    H    PHE  66           H        PHE  66  -9.199  -4.493   2.047
  491    HA   PHE  66           HA       PHE  66  -7.050  -6.444   2.538
  492    HB2  PHE  66           2HB      PHE  66  -8.238  -4.482   4.387
  493    HB3  PHE  66           1HB      PHE  66  -8.007  -6.111   5.029
  494    HD1  PHE  66           2HD      PHE  66  -5.639  -7.121   4.013
  495    HD2  PHE  66           1HD      PHE  66  -6.512  -3.068   4.965
  496    HE1  PHE  66           2HE      PHE  66  -3.239  -6.678   4.286
  497    HE2  PHE  66           1HE      PHE  66  -4.106  -2.613   5.235
  498    HZ   PHE  66           HZ       PHE  66  -2.468  -4.422   4.889
  499    H    GLN  67           H        GLN  67  -8.556  -8.084   1.291
  500    HA   GLN  67           HA       GLN  67 -11.195  -8.432   2.007
  501    HB2  GLN  67           2HB      GLN  67 -10.932 -10.733   1.018
  502    HB3  GLN  67           1HB      GLN  67 -10.385  -9.417  -0.015
  503    HG2  GLN  67           2HG      GLN  67  -8.255 -10.443   1.655
  504    HG3  GLN  67           1HG      GLN  67  -8.978 -11.700   0.654
  505   HE21  GLN  67          1HE2      GLN  67  -8.991 -11.413  -1.625
  506   HE22  GLN  67          2HE2      GLN  67  -7.816 -10.406  -2.391
  507    H    GLY  68           H        GLY  68 -12.188 -10.191   3.616
  508    HA2  GLY  68           2HA      GLY  68 -12.059 -11.609   5.411
  509    HA3  GLY  68           1HA      GLY  68 -10.327 -11.737   5.169
  510    H    GLY  69           H        GLY  69  -9.032  -9.659   5.920
  511    HA2  GLY  69           2HA      GLY  69  -8.978  -7.751   7.348
  512    HA3  GLY  69           1HA      GLY  69 -10.439  -8.331   8.131
  513    H    ARG  70           H        ARG  70  -7.608  -7.587   9.032
  514    HA   ARG  70           HA       ARG  70  -6.448  -8.138  10.934
  515    HB2  ARG  70           2HB      ARG  70  -7.707 -10.870  10.957
  516    HB3  ARG  70           1HB      ARG  70  -6.997  -9.982  12.297
  517    HG2  ARG  70           2HG      ARG  70  -8.929  -8.279  11.747
  518    HG3  ARG  70           1HG      ARG  70  -9.679  -9.718  11.053
  519    HD2  ARG  70           2HD      ARG  70  -8.503  -9.774  13.807
  520    HD3  ARG  70           1HD      ARG  70 -10.125  -9.142  13.533
  521    HE   ARG  70           HE       ARG  70 -10.157 -11.557  12.293
  522   HH11  ARG  70          1HH1      ARG  70  -9.322 -10.509  15.516
  523   HH12  ARG  70          2HH1      ARG  70  -9.809 -11.995  16.260
  524   HH21  ARG  70          1HH2      ARG  70 -10.798 -13.512  13.270
  525   HH22  ARG  70          2HH2      ARG  70 -10.647 -13.699  14.985
  526    H    LYS  71           H        LYS  71  -6.426  -9.713   7.983
  527    HA   LYS  71           HA       LYS  71  -4.893 -10.944   6.846
  528    HB2  LYS  71           2HB      LYS  71  -3.594  -8.871   8.130
  529    HB3  LYS  71           1HB      LYS  71  -2.603 -10.263   8.520
  530    HG2  LYS  71           2HG      LYS  71  -2.103 -10.697   6.289
  531    HG3  LYS  71           1HG      LYS  71  -3.456  -9.741   5.698
  532    HD2  LYS  71           2HD      LYS  71  -0.758  -8.875   6.598
  533    HD3  LYS  71           1HD      LYS  71  -1.729  -8.320   5.237
  534    HE2  LYS  71           2HE      LYS  71  -3.280  -7.366   7.127
  535    HE3  LYS  71           1HE      LYS  71  -1.811  -7.489   8.097
  536    HZ1  LYS  71           3HZ      LYS  71  -0.733  -5.928   6.833
  537    HZ2  LYS  71           1HZ      LYS  71  -2.314  -5.324   6.820
  538    HZ3  LYS  71           2HZ      LYS  71  -1.719  -6.164   5.479
  539    H    THR  72           H        THR  72  -5.804 -12.929   7.573
  540    HA   THR  72           HA       THR  72  -4.646 -14.250   9.867
  541    HB   THR  72           HB       THR  72  -6.146 -16.101   9.289
  542    HG1  THR  72           1HG      THR  72  -6.906 -16.297   7.357
  543   HG21  THR  72          3HG2      THR  72  -7.588 -13.475   9.020
  544   HG22  THR  72          1HG2      THR  72  -7.097 -14.215  10.543
  545   HG23  THR  72          2HG2      THR  72  -8.283 -15.019   9.515
  546    H    TYR  73           H        TYR  73  -5.068 -15.492   6.554
  547    HA   TYR  73           HA       TYR  73  -2.257 -16.031   6.276
  548    HB2  TYR  73           2HB      TYR  73  -3.328 -17.903   7.734
  549    HB3  TYR  73           1HB      TYR  73  -4.007 -18.467   6.212
  550    HD1  TYR  73           2HD      TYR  73  -0.863 -17.846   8.043
  551    HD2  TYR  73           1HD      TYR  73  -2.658 -19.594   4.603
  552    HE1  TYR  73           2HE      TYR  73   1.237 -19.027   7.554
  553    HE2  TYR  73           1HE      TYR  73  -0.561 -20.780   4.106
  554    HH   TYR  73           HH       TYR  73   2.048 -20.255   4.745
  555    H    THR  74           H        THR  74  -5.530 -16.577   5.072
  556    HA   THR  74           HA       THR  74  -4.867 -17.349   2.461
  557    HB   THR  74           HB       THR  74  -7.262 -15.877   2.300
  558    HG1  THR  74           1HG      THR  74  -7.379 -15.669   4.504
  559   HG21  THR  74          3HG2      THR  74  -7.550 -17.841   1.269
  560   HG22  THR  74          1HG2      THR  74  -8.150 -18.359   2.844
  561   HG23  THR  74          2HG2      THR  74  -6.484 -18.704   2.377
  562    H    VAL  75           H        VAL  75  -5.645 -14.144   3.773
  563    HA   VAL  75           HA       VAL  75  -5.036 -12.803   1.292
  564    HB   VAL  75           HB       VAL  75  -6.782 -12.132   3.037
  565   HG11  VAL  75          1HG1      VAL  75  -4.702 -10.622   4.500
  566   HG12  VAL  75          2HG1      VAL  75  -4.898 -12.337   4.862
  567   HG13  VAL  75          3HG1      VAL  75  -6.263 -11.236   5.043
  568   HG21  VAL  75          3HG2      VAL  75  -6.081 -10.591   1.202
  569   HG22  VAL  75          1HG2      VAL  75  -4.906  -9.878   2.314
  570   HG23  VAL  75          2HG2      VAL  75  -6.627  -9.780   2.663
  571    H    ARG  76           H        ARG  76  -2.779 -13.203   0.826
  572    HA   ARG  76           HA       ARG  76  -0.871 -12.563   2.920
  573    HB2  ARG  76           2HB      ARG  76  -0.808 -14.489   1.060
  574    HB3  ARG  76           1HB      ARG  76   0.064 -13.243   0.181
  575    HG2  ARG  76           2HG      ARG  76   1.490 -14.837   1.470
  576    HG3  ARG  76           1HG      ARG  76   1.757 -13.133   1.834
  577    HD2  ARG  76           2HD      ARG  76   0.715 -13.285   3.907
  578    HD3  ARG  76           1HD      ARG  76  -0.148 -14.759   3.474
  579    HE   ARG  76           HE       ARG  76   2.553 -14.550   4.482
  580   HH11  ARG  76          1HH1      ARG  76   0.215 -16.559   2.843
  581   HH12  ARG  76          2HH1      ARG  76   1.013 -18.038   3.258
  582   HH21  ARG  76          1HH2      ARG  76   3.602 -16.496   5.026
  583   HH22  ARG  76          2HH2      ARG  76   2.934 -18.004   4.496
  584    H    VAL  77           H        VAL  77  -1.711 -11.336  -0.337
  585    HA   VAL  77           HA       VAL  77  -0.320  -8.856   0.432
  586    HB   VAL  77           HB       VAL  77   0.717  -8.607  -1.645
  587   HG11  VAL  77          1HG1      VAL  77   0.513 -11.602  -1.421
  588   HG12  VAL  77          2HG1      VAL  77   1.633 -10.581  -0.519
  589   HG13  VAL  77          3HG1      VAL  77   1.759 -10.690  -2.275
  590   HG21  VAL  77          3HG2      VAL  77   0.015  -9.818  -3.691
  591   HG22  VAL  77          1HG2      VAL  77  -1.204  -8.714  -3.058
  592   HG23  VAL  77          2HG2      VAL  77  -1.368 -10.450  -2.795
  593    HA   PRO  78           HA       PRO  78  -4.456  -7.135  -0.034
  594    HB2  PRO  78           2HB      PRO  78  -2.758  -4.692  -0.266
  595    HB3  PRO  78           1HB      PRO  78  -4.216  -4.942   0.689
  596    HG2  PRO  78           2HG      PRO  78  -1.955  -5.028   1.963
  597    HG3  PRO  78           1HG      PRO  78  -3.056  -6.400   2.200
  598    HD2  PRO  78           2HD      PRO  78  -0.710  -6.191   0.324
  599    HD3  PRO  78           1HD      PRO  78  -1.057  -7.450   1.546
  600    H    THR  79           H        THR  79  -3.479  -8.116  -2.666
  601    HA   THR  79           HA       THR  79  -4.149  -5.611  -4.043
  602    HB   THR  79           HB       THR  79  -3.321  -8.067  -5.531
  603    HG1  THR  79           1HG      THR  79  -1.323  -7.917  -4.904
  604   HG21  THR  79          3HG2      THR  79  -2.483  -6.596  -7.150
  605   HG22  THR  79          1HG2      THR  79  -2.547  -5.217  -6.051
  606   HG23  THR  79          2HG2      THR  79  -4.042  -5.924  -6.668
  607    H    ILE  80           H        ILE  80  -6.113  -5.385  -4.168
  608    HA   ILE  80           HA       ILE  80  -7.873  -7.393  -5.383
  609    HB   ILE  80           HB       ILE  80  -8.420  -5.601  -3.023
  610   HG12  ILE  80          2HG1      ILE  80  -7.800  -8.173  -3.002
  611   HG13  ILE  80          1HG1      ILE  80  -8.984  -7.520  -1.886
  612   HG21  ILE  80          1HG2      ILE  80 -10.275  -4.929  -4.152
  613   HG22  ILE  80          2HG2      ILE  80 -10.894  -6.429  -3.461
  614   HG23  ILE  80          3HG2      ILE  80 -10.347  -6.391  -5.137
  615   HD11  ILE  80          3HD1      ILE  80 -10.655  -8.701  -2.769
  616   HD12  ILE  80          1HD1      ILE  80  -9.362  -9.701  -3.432
  617   HD13  ILE  80          2HD1      ILE  80 -10.101  -8.447  -4.426
  618    H    PHE  81           H        PHE  81  -7.786  -6.411  -7.531
  619    HA   PHE  81           HA       PHE  81  -9.417  -4.144  -7.884
  620    HB2  PHE  81           2HB      PHE  81  -6.759  -3.285  -8.875
  621    HB3  PHE  81           1HB      PHE  81  -8.067  -2.330  -8.208
  622    HD1  PHE  81           2HD      PHE  81  -8.268  -2.150  -5.657
  623    HD2  PHE  81           1HD      PHE  81  -4.872  -3.822  -7.623
  624    HE1  PHE  81           2HE      PHE  81  -6.955  -1.895  -3.599
  625    HE2  PHE  81           1HE      PHE  81  -3.540  -3.518  -5.578
  626    HZ   PHE  81           HZ       PHE  81  -4.599  -2.596  -3.518
  Start of MODEL    3
    1    H1   GLY   1           1HT      GLY   1   5.306  19.856  -0.701
    2    H2   GLY   1           2HT      GLY   1   4.116  20.433  -1.756
    3    H3   GLY   1           3HT      GLY   1   4.485  18.783  -1.720
    4    HA2  GLY   1           1HA      GLY   1   3.069  20.391   0.316
    5    HA3  GLY   1           2HA      GLY   1   2.489  18.969  -0.535
    6    H    SER   2           H        SER   2   2.534  17.129   0.560
    7    HA   SER   2           HA       SER   2   4.261  16.964   2.933
    8    HB2  SER   2           2HB      SER   2   2.521  14.860   3.163
    9    HB3  SER   2           1HB      SER   2   2.269  16.451   3.880
   10    HG   SER   2           HG       SER   2   0.732  15.261   2.148
   11    HA   PRO   3           HA       PRO   3   6.620  13.603   1.330
   12    HB2  PRO   3           2HB      PRO   3   6.686  11.789   3.348
   13    HB3  PRO   3           1HB      PRO   3   7.559  13.325   3.409
   14    HG2  PRO   3           2HG      PRO   3   4.923  12.594   4.632
   15    HG3  PRO   3           1HG      PRO   3   6.275  13.496   5.345
   16    HD2  PRO   3           2HD      PRO   3   4.081  14.721   4.353
   17    HD3  PRO   3           1HD      PRO   3   5.695  15.456   4.273
   18    H    GLY   4           H        GLY   4   4.269  13.386   0.077
   19    HA2  GLY   4           2HA      GLY   4   2.642  11.192   0.582
   20    HA3  GLY   4           1HA      GLY   4   2.898  11.911  -1.004
   21    H    PHE   5           H        PHE   5   2.520   9.315  -1.307
   22    HA   PHE   5           HA       PHE   5   5.154   8.271  -1.923
   23    HB2  PHE   5           2HB      PHE   5   3.302   6.741  -0.096
   24    HB3  PHE   5           1HB      PHE   5   4.853   6.186  -0.693
   25    HD1  PHE   5           1HD      PHE   5   6.907   7.647  -0.073
   26    HD2  PHE   5           2HD      PHE   5   3.157   7.811   1.935
   27    HE1  PHE   5           1HE      PHE   5   8.005   8.642   1.894
   28    HE2  PHE   5           2HE      PHE   5   4.248   8.807   3.902
   29    HZ   PHE   5           HZ       PHE   5   6.676   9.225   3.883
   30    H    THR   6           H        THR   6   1.666   7.751  -1.998
   31    HA   THR   6           HA       THR   6   0.347   7.233  -3.841
   32    HB   THR   6           HB       THR   6   2.657   5.834  -5.164
   33    HG1  THR   6           1HG      THR   6   2.047   8.568  -5.537
   34   HG21  THR   6          3HG2      THR   6   1.213   7.210  -7.054
   35   HG22  THR   6          1HG2      THR   6  -0.022   6.624  -5.940
   36   HG23  THR   6          2HG2      THR   6   1.091   5.487  -6.698
   37    H    CYS   7           H        CYS   7  -1.038   5.741  -3.110
   38    HA   CYS   7           HA       CYS   7  -0.075   3.125  -2.249
   39    HB2  CYS   7           2HB      CYS   7  -1.906   2.978  -0.886
   40    HB3  CYS   7           1HB      CYS   7  -2.020   4.713  -1.132
   41    H    CYS   8           H        CYS   8  -0.425   4.282  -5.121
   42    HA   CYS   8           HA       CYS   8  -1.169   3.583  -7.166
   43    HB2  CYS   8           2HB      CYS   8   0.447   1.867  -6.870
   44    HB3  CYS   8           1HB      CYS   8  -0.545   1.007  -5.708
   45    HG   CYS   8           HG       CYS   8  -1.787   1.053  -8.485
   46    H    VAL   9           H        VAL   9  -3.083   4.508  -5.727
   47    HA   VAL   9           HA       VAL   9  -5.217   2.647  -5.308
   48    HB   VAL   9           HB       VAL   9  -4.528   4.777  -3.944
   49   HG11  VAL   9          1HG1      VAL   9  -6.680   6.025  -5.558
   50   HG12  VAL   9          2HG1      VAL   9  -4.977   6.262  -5.954
   51   HG13  VAL   9          3HG1      VAL   9  -5.595   6.745  -4.373
   52   HG21  VAL   9          3HG2      VAL   9  -6.763   4.923  -3.055
   53   HG22  VAL   9          1HG2      VAL   9  -6.237   3.261  -3.325
   54   HG23  VAL   9          2HG2      VAL   9  -7.374   4.015  -4.446
   55    HA   PRO  10           HA       PRO  10  -6.785   3.513  -9.479
   56    HB2  PRO  10           2HB      PRO  10  -8.012   1.180  -9.859
   57    HB3  PRO  10           1HB      PRO  10  -6.246   1.280  -9.917
   58    HG2  PRO  10           2HG      PRO  10  -8.015   0.353  -7.682
   59    HG3  PRO  10           1HG      PRO  10  -6.519  -0.374  -8.297
   60    HD2  PRO  10           2HD      PRO  10  -6.645   1.245  -6.078
   61    HD3  PRO  10           1HD      PRO  10  -5.197   1.029  -7.081
   62    H    GLY  11           H        GLY  11  -8.495   2.079  -6.741
   63    HA2  GLY  11           2HA      GLY  11 -10.669   3.964  -7.044
   64    HA3  GLY  11           1HA      GLY  11 -11.108   2.285  -7.317
   65    H    CYS  12           H        CYS  12  -8.600   2.560  -5.037
   66    HA   CYS  12           HA       CYS  12 -10.186   1.526  -2.951
   67    HB2  CYS  12           2HB      CYS  12  -8.168   1.058  -2.050
   68    HB3  CYS  12           1HB      CYS  12  -7.421   1.888  -3.413
   69    H    TYR  13           H        TYR  13  -9.384   3.002  -0.675
   70    HA   TYR  13           HA       TYR  13 -11.304   5.123  -0.703
   71    HB2  TYR  13           2HB      TYR  13 -10.716   3.265   1.102
   72    HB3  TYR  13           1HB      TYR  13  -9.715   4.570   1.697
   73    HD1  TYR  13           2HD      TYR  13 -11.804   6.715   0.599
   74    HD2  TYR  13           1HD      TYR  13 -12.061   3.314   3.143
   75    HE1  TYR  13           2HE      TYR  13 -13.774   7.695   1.701
   76    HE2  TYR  13           1HE      TYR  13 -14.030   4.282   4.252
   77    HH   TYR  13           HH       TYR  13 -15.139   6.326   4.585
   78    H    ASN  14           H        ASN  14  -7.942   4.843   0.306
   79    HA   ASN  14           HA       ASN  14  -7.557   7.724  -0.100
   80    HB2  ASN  14           2HB      ASN  14  -5.627   6.617   1.701
   81    HB3  ASN  14           1HB      ASN  14  -6.776   7.919   1.983
   82   HD21  ASN  14          1HD2      ASN  14  -9.159   6.782   1.959
   83   HD22  ASN  14          2HD2      ASN  14  -9.303   5.503   3.114
   84    H    ASN  15           H        ASN  15  -5.248   8.433  -0.726
   85    HA   ASN  15           HA       ASN  15  -3.938   6.228  -2.167
   86    HB2  ASN  15           2HB      ASN  15  -4.813   8.316  -3.451
   87    HB3  ASN  15           1HB      ASN  15  -3.428   9.144  -2.747
   88   HD21  ASN  15          1HD2      ASN  15  -4.203   8.267  -5.543
   89   HD22  ASN  15          2HD2      ASN  15  -2.794   7.457  -6.128
   90    H    SER  16           H        SER  16  -1.329   6.574  -2.223
   91    HA   SER  16           HA       SER  16  -0.635   7.146   0.502
   92    HB2  SER  16           2HB      SER  16   0.024   4.961  -0.766
   93    HB3  SER  16           1HB      SER  16   1.219   5.912  -1.571
   94    HG   SER  16           HG       SER  16   1.587   6.534   0.895
   95    H    HIS  17           H        HIS  17  -0.887   9.172  -2.065
   96    HA   HIS  17           HA       HIS  17   1.117  10.954  -0.992
   97    HB2  HIS  17           2HB      HIS  17   2.457  11.244  -2.867
   98    HB3  HIS  17           1HB      HIS  17   2.185   9.510  -2.907
   99    HD1  HIS  17           1HD      HIS  17  -0.555   9.417  -4.284
  100    HD2  HIS  17           2HD      HIS  17   2.578  11.864  -5.496
  101    HE1  HIS  17           1HE      HIS  17  -0.993   9.920  -6.710
  102    HE2  HIS  17           2HE      HIS  17   0.874  11.463  -7.401
  103    H    ARG  18           H        ARG  18  -1.908  10.907  -1.394
  104    HA   ARG  18           HA       ARG  18  -2.020  13.560  -2.645
  105    HB2  ARG  18           2HB      ARG  18  -3.619  13.056  -4.196
  106    HB3  ARG  18           1HB      ARG  18  -2.753  11.530  -4.154
  107    HG2  ARG  18           2HG      ARG  18  -4.473  10.722  -2.505
  108    HG3  ARG  18           1HG      ARG  18  -5.382  12.192  -2.855
  109    HD2  ARG  18           2HD      ARG  18  -4.696   9.931  -4.711
  110    HD3  ARG  18           1HD      ARG  18  -6.291  10.534  -4.262
  111    HE   ARG  18           HE       ARG  18  -4.627  11.502  -6.359
  112   HH11  ARG  18          1HH1      ARG  18  -6.987  12.502  -3.991
  113   HH12  ARG  18          2HH1      ARG  18  -7.529  13.860  -4.920
  114   HH21  ARG  18          1HH2      ARG  18  -5.337  13.287  -7.582
  115   HH22  ARG  18          2HH2      ARG  18  -6.594  14.304  -6.959
  116    H    ASP  19           H        ASP  19  -2.432  12.124   0.106
  117    HA   ASP  19           HA       ASP  19  -4.350  13.999   1.091
  118    HB2  ASP  19           2HB      ASP  19  -5.124  11.107   1.320
  119    HB3  ASP  19           1HB      ASP  19  -5.993  12.493   1.954
  120    H    LYS  20           H        LYS  20  -3.279  10.819   2.195
  121    HA   LYS  20           HA       LYS  20  -2.052  10.198   3.999
  122    HB2  LYS  20           2HB      LYS  20  -0.142  11.346   4.163
  123    HB3  LYS  20           1HB      LYS  20  -0.845  12.535   3.084
  124    HG2  LYS  20           2HG      LYS  20  -1.807  13.619   5.195
  125    HG3  LYS  20           1HG      LYS  20  -0.661  12.606   6.076
  126    HD2  LYS  20           2HD      LYS  20   1.147  13.770   5.327
  127    HD3  LYS  20           1HD      LYS  20   0.388  14.164   3.782
  128    HE2  LYS  20           2HE      LYS  20  -0.102  16.187   4.557
  129    HE3  LYS  20           1HE      LYS  20  -1.120  15.451   5.794
  130    HZ1  LYS  20           3HZ      LYS  20   1.222  15.125   6.936
  131    HZ2  LYS  20           1HZ      LYS  20   0.336  16.555   7.114
  132    HZ3  LYS  20           2HZ      LYS  20   1.607  16.481   6.001
  133    H    ALA  21           H        ALA  21  -4.805  11.780   4.173
  134    HA   ALA  21           HA       ALA  21  -4.688  12.161   7.095
  135    HB1  ALA  21           1HB      ALA  21  -5.490  14.163   6.396
  136    HB2  ALA  21           2HB      ALA  21  -7.020  13.292   6.511
  137    HB3  ALA  21           3HB      ALA  21  -6.232  13.487   4.945
  138    H    LEU  22           H        LEU  22  -5.173   9.577   5.446
  139    HA   LEU  22           HA       LEU  22  -7.673   8.875   6.816
  140    HB2  LEU  22           2HB      LEU  22  -6.822   7.890   4.076
  141    HB3  LEU  22           1HB      LEU  22  -8.262   7.344   4.948
  142    HG   LEU  22           HG       LEU  22  -8.839   8.949   3.258
  143   HD11  LEU  22          1HD1      LEU  22  -9.685   8.951   5.857
  144   HD12  LEU  22          2HD1      LEU  22 -10.432   9.858   4.541
  145   HD13  LEU  22          3HD1      LEU  22  -9.262  10.643   5.600
  146   HD21  LEU  22          3HD2      LEU  22  -7.829  10.852   2.877
  147   HD22  LEU  22          1HD2      LEU  22  -6.499  10.167   3.811
  148   HD23  LEU  22          2HD2      LEU  22  -7.664  11.249   4.585
  149    H    HIS  23           H        HIS  23  -6.343   5.822   5.624
  150    HA   HIS  23           HA       HIS  23  -5.010   5.579   8.205
  151    HB2  HIS  23           2HB      HIS  23  -7.340   4.395   7.479
  152    HB3  HIS  23           1HB      HIS  23  -6.187   3.154   6.996
  153    HD1  HIS  23           1HD      HIS  23  -8.311   3.349   9.536
  154    HD2  HIS  23           2HD      HIS  23  -4.156   3.373   9.578
  155    HE1  HIS  23           1HE      HIS  23  -7.659   2.573  11.837
  156    HE2  HIS  23           2HE      HIS  23  -5.139   2.592  11.840
  157    H    PHE  24           H        PHE  24  -2.884   4.465   8.154
  158    HA   PHE  24           HA       PHE  24  -2.168   3.360   5.539
  159    HB2  PHE  24           2HB      PHE  24  -0.463   5.154   7.267
  160    HB3  PHE  24           1HB      PHE  24   0.106   4.318   5.837
  161    HD1  PHE  24           2HD      PHE  24  -2.635   6.600   6.903
  162    HD2  PHE  24           1HD      PHE  24   0.027   5.453   3.783
  163    HE1  PHE  24           2HE      PHE  24  -3.503   8.406   5.469
  164    HE2  PHE  24           1HE      PHE  24  -0.835   7.233   2.370
  165    HZ   PHE  24           HZ       PHE  24  -2.600   8.707   3.192
  166    H    TYR  25           H        TYR  25  -1.647   1.084   5.836
  167    HA   TYR  25           HA       TYR  25  -0.827   0.192   8.456
  168    HB2  TYR  25           2HB      TYR  25  -1.121  -1.491   5.932
  169    HB3  TYR  25           1HB      TYR  25  -0.994  -2.070   7.586
  170    HD1  TYR  25           1HD      TYR  25  -3.181   0.227   5.583
  171    HD2  TYR  25           2HD      TYR  25  -2.916  -2.712   8.647
  172    HE1  TYR  25           1HE      TYR  25  -5.626   0.253   5.811
  173    HE2  TYR  25           2HE      TYR  25  -5.362  -2.694   8.882
  174    HH   TYR  25           HH       TYR  25  -7.383  -1.966   7.033
  175    H    THR  26           H        THR  26   1.272  -1.128   8.730
  176    HA   THR  26           HA       THR  26   3.301   0.020   6.941
  177    HB   THR  26           HB       THR  26   4.669   0.256   8.741
  178    HG1  THR  26           1HG      THR  26   3.756  -2.277   9.608
  179   HG21  THR  26          3HG2      THR  26   2.221  -0.437  10.344
  180   HG22  THR  26          1HG2      THR  26   2.601   1.151   9.676
  181   HG23  THR  26          2HG2      THR  26   3.635   0.446  10.919
  182    H    PHE  27           H        PHE  27   5.392  -1.487   6.823
  183    HA   PHE  27           HA       PHE  27   4.359  -3.818   5.567
  184    HB2  PHE  27           2HB      PHE  27   6.746  -2.188   5.323
  185    HB3  PHE  27           1HB      PHE  27   6.914  -3.858   4.834
  186    HD1  PHE  27           2HD      PHE  27   3.869  -1.833   4.543
  187    HD2  PHE  27           1HD      PHE  27   7.198  -3.530   2.515
  188    HE1  PHE  27           2HE      PHE  27   2.809  -1.337   2.399
  189    HE2  PHE  27           1HE      PHE  27   6.150  -3.134   0.416
  190    HZ   PHE  27           HZ       PHE  27   3.942  -1.995   0.288
  191    HA   PRO  28           HA       PRO  28   5.749  -7.339   8.036
  192    HB2  PRO  28           2HB      PRO  28   7.011  -7.937   5.336
  193    HB3  PRO  28           1HB      PRO  28   6.256  -9.090   6.433
  194    HG2  PRO  28           2HG      PRO  28   4.887  -8.171   4.417
  195    HG3  PRO  28           1HG      PRO  28   4.108  -8.246   5.999
  196    HD2  PRO  28           2HD      PRO  28   5.031  -5.923   4.442
  197    HD3  PRO  28           1HD      PRO  28   3.745  -6.066   5.634
  198    H    LYS  29           H        LYS  29   7.957  -8.522   8.466
  199    HA   LYS  29           HA       LYS  29  10.039  -6.508   8.682
  200    HB2  LYS  29           2HB      LYS  29  11.143  -8.741   9.765
  201    HB3  LYS  29           1HB      LYS  29  10.193  -7.568  10.664
  202    HG2  LYS  29           2HG      LYS  29   9.337  -9.653  11.274
  203    HG3  LYS  29           1HG      LYS  29   8.182  -9.029  10.097
  204    HD2  LYS  29           2HD      LYS  29   8.605 -11.341   9.605
  205    HD3  LYS  29           1HD      LYS  29   9.338 -10.353   8.341
  206    HE2  LYS  29           2HE      LYS  29  11.151 -10.867  10.558
  207    HE3  LYS  29           1HE      LYS  29  10.584 -12.347   9.787
  208    HZ1  LYS  29           3HZ      LYS  29  12.523 -11.684   8.652
  209    HZ2  LYS  29           1HZ      LYS  29  12.009 -10.079   8.522
  210    HZ3  LYS  29           2HZ      LYS  29  11.238 -11.289   7.626
  211    H    ASP  30           H        ASP  30   9.285  -9.189   6.731
  212    HA   ASP  30           HA       ASP  30  11.990  -9.737   5.866
  213    HB2  ASP  30           2HB      ASP  30  10.009 -10.763   4.046
  214    HB3  ASP  30           1HB      ASP  30  11.056 -11.674   5.125
  215    H    ALA  31           H        ALA  31  13.064  -8.360   4.543
  216    HA   ALA  31           HA       ALA  31  12.150  -6.171   3.325
  217    HB1  ALA  31           1HB      ALA  31  14.390  -6.235   3.332
  218    HB2  ALA  31           2HB      ALA  31  14.141  -6.640   1.643
  219    HB3  ALA  31           3HB      ALA  31  14.486  -7.914   2.820
  220    H    GLU  32           H        GLU  32  12.634  -9.132   1.225
  221    HA   GLU  32           HA       GLU  32  11.328  -8.011  -0.996
  222    HB2  GLU  32           2HB      GLU  32  12.680  -9.981  -1.206
  223    HB3  GLU  32           1HB      GLU  32  11.643 -10.948  -0.241
  224    HG2  GLU  32           2HG      GLU  32  10.392  -9.674  -2.578
  225    HG3  GLU  32           1HG      GLU  32  11.601 -10.911  -2.920
  226    H    LEU  33           H        LEU  33   9.658 -10.356   1.307
  227    HA   LEU  33           HA       LEU  33   7.261 -10.228   0.108
  228    HB2  LEU  33           2HB      LEU  33   7.867 -11.160   2.458
  229    HB3  LEU  33           1HB      LEU  33   7.414  -9.581   3.038
  230    HG   LEU  33           HG       LEU  33   5.311 -10.210   3.133
  231   HD11  LEU  33          1HD1      LEU  33   4.030 -10.836   1.114
  232   HD12  LEU  33          2HD1      LEU  33   5.538 -10.861   0.206
  233   HD13  LEU  33          3HD1      LEU  33   4.965  -9.359   0.923
  234   HD21  LEU  33          3HD2      LEU  33   4.756 -12.596   2.246
  235   HD22  LEU  33          1HD2      LEU  33   5.754 -12.369   3.683
  236   HD23  LEU  33          2HD2      LEU  33   6.513 -12.713   2.128
  237    H    ARG  34           H        ARG  34   8.857  -7.722   1.853
  238    HA   ARG  34           HA       ARG  34   6.818  -5.803   1.991
  239    HB2  ARG  34           2HB      ARG  34   8.435  -4.744   3.145
  240    HB3  ARG  34           1HB      ARG  34   9.593  -5.915   2.592
  241    HG2  ARG  34           2HG      ARG  34   9.773  -4.413   0.495
  242    HG3  ARG  34           1HG      ARG  34   8.973  -3.205   1.492
  243    HD2  ARG  34           2HD      ARG  34  11.388  -4.670   2.459
  244    HD3  ARG  34           1HD      ARG  34  11.548  -3.273   1.401
  245    HE   ARG  34           HE       ARG  34  10.824  -1.892   3.116
  246   HH11  ARG  34          1HH1      ARG  34  10.594  -5.240   4.096
  247   HH12  ARG  34          2HH1      ARG  34  10.364  -4.858   5.768
  248   HH21  ARG  34          1HH2      ARG  34  10.520  -1.400   5.311
  249   HH22  ARG  34          2HH2      ARG  34  10.320  -2.683   6.457
  250    H    ARG  35           H        ARG  35   9.501  -5.991  -0.285
  251    HA   ARG  35           HA       ARG  35   8.572  -4.017  -1.959
  252    HB2  ARG  35           2HB      ARG  35  10.038  -4.785  -3.660
  253    HB3  ARG  35           1HB      ARG  35  10.839  -5.037  -2.124
  254    HG2  ARG  35           2HG      ARG  35  11.360  -6.910  -3.375
  255    HG3  ARG  35           1HG      ARG  35  10.076  -7.468  -2.326
  256    HD2  ARG  35           2HD      ARG  35   8.468  -7.234  -4.145
  257    HD3  ARG  35           1HD      ARG  35   9.722  -6.563  -5.180
  258    HE   ARG  35           HE       ARG  35   9.273  -9.334  -4.563
  259   HH11  ARG  35          1HH1      ARG  35  11.634  -6.982  -5.603
  260   HH12  ARG  35          2HH1      ARG  35  12.628  -8.152  -6.405
  261   HH21  ARG  35          1HH2      ARG  35  10.579 -10.871  -5.618
  262   HH22  ARG  35          2HH2      ARG  35  12.028 -10.360  -6.414
  263    H    LEU  36           H        LEU  36   7.545  -7.378  -1.628
  264    HA   LEU  36           HA       LEU  36   6.090  -7.462  -4.106
  265    HB2  LEU  36           2HB      LEU  36   5.724  -8.893  -1.506
  266    HB3  LEU  36           1HB      LEU  36   4.491  -9.002  -2.737
  267    HG   LEU  36           HG       LEU  36   7.331  -9.623  -3.430
  268   HD11  LEU  36          1HD1      LEU  36   6.486 -12.072  -2.956
  269   HD12  LEU  36          2HD1      LEU  36   5.491 -11.250  -1.755
  270   HD13  LEU  36          3HD1      LEU  36   7.247 -11.104  -1.694
  271   HD21  LEU  36          3HD2      LEU  36   6.461 -10.525  -5.303
  272   HD22  LEU  36          1HD2      LEU  36   5.095  -9.473  -4.929
  273   HD23  LEU  36          2HD2      LEU  36   5.051 -11.173  -4.465
  274    H    TRP  37           H        TRP  37   5.021  -6.388  -0.900
  275    HA   TRP  37           HA       TRP  37   2.446  -5.677  -1.714
  276    HB2  TRP  37           2HB      TRP  37   4.303  -4.668   0.429
  277    HB3  TRP  37           1HB      TRP  37   2.723  -3.932   0.179
  278    HD1  TRP  37           HD       TRP  37   3.188  -7.680  -0.266
  279    HE1  TRP  37           1HE      TRP  37   1.895  -8.892   1.652
  280    HE3  TRP  37           3HE      TRP  37   1.877  -3.645   2.483
  281    HZ2  TRP  37           2HZ      TRP  37   0.476  -8.134   4.035
  282    HZ3  TRP  37           3HZ      TRP  37   0.611  -3.924   4.547
  283    HH2  TRP  37           HH       TRP  37  -0.111  -6.082   5.290
  284    H    LEU  38           H        LEU  38   5.585  -3.902  -1.891
  285    HA   LEU  38           HA       LEU  38   4.834  -1.357  -2.577
  286    HB2  LEU  38           2HB      LEU  38   6.945  -3.195  -3.520
  287    HB3  LEU  38           1HB      LEU  38   6.650  -1.812  -4.502
  288    HG   LEU  38           HG       LEU  38   8.401  -1.349  -2.867
  289   HD11  LEU  38          1HD1      LEU  38   7.509   0.685  -3.238
  290   HD12  LEU  38          2HD1      LEU  38   6.830   0.505  -1.624
  291   HD13  LEU  38          3HD1      LEU  38   5.860   0.108  -3.040
  292   HD21  LEU  38          3HD2      LEU  38   8.180  -1.618  -0.614
  293   HD22  LEU  38          1HD2      LEU  38   7.181  -2.955  -1.186
  294   HD23  LEU  38          2HD2      LEU  38   6.424  -1.453  -0.656
  295    H    LYS  39           H        LYS  39   4.977  -4.210  -4.841
  296    HA   LYS  39           HA       LYS  39   3.942  -3.196  -7.074
  297    HB2  LYS  39           2HB      LYS  39   3.841  -5.797  -5.687
  298    HB3  LYS  39           1HB      LYS  39   2.667  -5.600  -6.967
  299    HG2  LYS  39           2HG      LYS  39   4.808  -6.683  -7.597
  300    HG3  LYS  39           1HG      LYS  39   4.398  -5.260  -8.567
  301    HD2  LYS  39           2HD      LYS  39   5.935  -3.913  -7.239
  302    HD3  LYS  39           1HD      LYS  39   6.290  -5.301  -6.214
  303    HE2  LYS  39           2HE      LYS  39   6.822  -5.169  -9.178
  304    HE3  LYS  39           1HE      LYS  39   8.029  -4.881  -7.925
  305    HZ1  LYS  39           3HZ      LYS  39   6.898  -7.372  -8.868
  306    HZ2  LYS  39           1HZ      LYS  39   7.049  -7.257  -7.187
  307    HZ3  LYS  39           2HZ      LYS  39   8.409  -7.063  -8.175
  308    H    ASN  40           H        ASN  40   1.742  -4.618  -4.643
  309    HA   ASN  40           HA       ASN  40  -0.617  -3.821  -5.819
  310    HB2  ASN  40           2HB      ASN  40  -0.861  -3.804  -2.916
  311    HB3  ASN  40           1HB      ASN  40  -1.566  -4.889  -4.099
  312   HD21  ASN  40          1HD2      ASN  40  -0.779  -5.713  -1.606
  313   HD22  ASN  40          2HD2      ASN  40   0.563  -6.785  -1.761
  314    H    VAL  41           H        VAL  41   1.195  -2.165  -3.332
  315    HA   VAL  41           HA       VAL  41  -0.636   0.020  -3.274
  316    HB   VAL  41           HB       VAL  41   1.039  -0.943  -1.369
  317   HG11  VAL  41          1HG1      VAL  41   2.114   1.792  -1.737
  318   HG12  VAL  41          2HG1      VAL  41   2.820   0.515  -2.717
  319   HG13  VAL  41          3HG1      VAL  41   2.840   0.387  -0.959
  320   HG21  VAL  41          3HG2      VAL  41  -1.087   0.550  -1.382
  321   HG22  VAL  41          1HG2      VAL  41   0.064   1.875  -1.246
  322   HG23  VAL  41          2HG2      VAL  41   0.019   0.626  -0.016
  323    H    SER  42           H        SER  42   2.205  -0.563  -5.176
  324    HA   SER  42           HA       SER  42   1.972   1.635  -6.764
  325    HB2  SER  42           2HB      SER  42   2.344   3.522  -5.541
  326    HB3  SER  42           1HB      SER  42   2.709   2.566  -4.092
  327    HG   SER  42           HG       SER  42   4.719   3.064  -4.378
  328    H    ARG  43           H        ARG  43   5.335   1.460  -5.275
  329    HA   ARG  43           HA       ARG  43   7.126   0.223  -5.912
  330    HB2  ARG  43           2HB      ARG  43   6.967  -1.775  -7.032
  331    HB3  ARG  43           1HB      ARG  43   5.344  -1.601  -6.394
  332    HG2  ARG  43           2HG      ARG  43   4.542  -1.892  -8.434
  333    HG3  ARG  43           1HG      ARG  43   5.333  -0.407  -8.952
  334    HD2  ARG  43           2HD      ARG  43   7.355  -1.663  -9.491
  335    HD3  ARG  43           1HD      ARG  43   6.589  -3.147  -8.932
  336    HE   ARG  43           HE       ARG  43   5.091  -1.840 -10.988
  337   HH11  ARG  43          1HH1      ARG  43   7.785  -3.981 -10.389
  338   HH12  ARG  43          2HH1      ARG  43   7.673  -4.752 -11.935
  339   HH21  ARG  43          1HH2      ARG  43   4.951  -2.853 -13.021
  340   HH22  ARG  43          2HH2      ARG  43   6.068  -4.111 -13.430
  341    H    ALA  44           H        ALA  44   7.076   2.743  -6.822
  342    HA   ALA  44           HA       ALA  44   7.271   3.000  -9.651
  343    HB1  ALA  44           1HB      ALA  44   8.052   4.698  -7.311
  344    HB2  ALA  44           2HB      ALA  44   6.876   5.013  -8.585
  345    HB3  ALA  44           3HB      ALA  44   8.601   5.137  -8.930
  346    H    GLY  45           H        GLY  45   8.772   0.838  -9.813
  347    HA2  GLY  45           2HA      GLY  45  11.553   1.796  -9.676
  348    HA3  GLY  45           1HA      GLY  45  11.142   0.193  -9.145
  349    H    VAL  46           H        VAL  46  10.007  -1.152 -10.960
  350    HA   VAL  46           HA       VAL  46  11.755  -1.313 -13.160
  351    HB   VAL  46           HB       VAL  46   8.998  -2.502 -13.230
  352   HG11  VAL  46          1HG1      VAL  46  11.639  -3.042 -14.467
  353   HG12  VAL  46          2HG1      VAL  46  10.021  -3.125 -15.161
  354   HG13  VAL  46          3HG1      VAL  46  10.598  -4.422 -14.114
  355   HG21  VAL  46          3HG2      VAL  46  10.240  -4.496 -12.068
  356   HG22  VAL  46          1HG2      VAL  46   9.489  -3.220 -11.112
  357   HG23  VAL  46          2HG2      VAL  46  11.231  -3.207 -11.389
  358    H    SER  47           H        SER  47   9.222   0.848 -12.617
  359    HA   SER  47           HA       SER  47   9.421   1.895 -15.277
  360    HB2  SER  47           2HB      SER  47   7.683   0.849 -16.257
  361    HB3  SER  47           1HB      SER  47   7.533  -0.193 -14.838
  362    HG   SER  47           HG       SER  47   6.225   2.295 -15.282
  363    H    GLY  48           H        GLY  48   6.640   1.819 -12.770
  364    HA2  GLY  48           2HA      GLY  48   5.558   3.626 -11.856
  365    HA3  GLY  48           1HA      GLY  48   7.182   4.037 -11.332
  366    H    CYS  49           H        CYS  49   8.240   5.729 -12.252
  367    HA   CYS  49           HA       CYS  49   8.658   7.525 -13.601
  368    HB2  CYS  49           2HB      CYS  49   7.507   6.016 -15.403
  369    HB3  CYS  49           1HB      CYS  49   6.147   7.114 -15.179
  370    HG   CYS  49           HG       CYS  49   7.938   9.056 -15.844
  371    H    PHE  50           H        PHE  50   6.637   7.335 -11.263
  372    HA   PHE  50           HA       PHE  50   5.053   9.745 -11.843
  373    HB2  PHE  50           2HB      PHE  50   4.930   8.524  -9.126
  374    HB3  PHE  50           1HB      PHE  50   3.643   9.143 -10.149
  375    HD1  PHE  50           1HD      PHE  50   2.762   7.706 -12.002
  376    HD2  PHE  50           2HD      PHE  50   5.432   6.241  -9.033
  377    HE1  PHE  50           1HE      PHE  50   2.097   5.400 -12.547
  378    HE2  PHE  50           2HE      PHE  50   4.775   3.933  -9.572
  379    HZ   PHE  50           HZ       PHE  50   3.105   3.510 -11.331
  380    H    SER  51           H        SER  51   6.907   8.689  -8.842
  381    HA   SER  51           HA       SER  51   8.515  11.085  -8.995
  382    HB2  SER  51           2HB      SER  51   7.770  12.039  -6.877
  383    HB3  SER  51           1HB      SER  51   6.414  11.934  -8.001
  384    HG   SER  51           HG       SER  51   6.996  10.059  -5.949
  385    H    THR  52           H        THR  52   8.643   8.045  -8.682
  386    HA   THR  52           HA       THR  52  10.067   6.559  -7.764
  387    HB   THR  52           HB       THR  52  11.662   8.245  -6.053
  388    HG1  THR  52           1HG      THR  52  11.314   9.119  -8.728
  389   HG21  THR  52          3HG2      THR  52  12.100   6.131  -7.754
  390   HG22  THR  52          1HG2      THR  52  13.340   7.095  -6.952
  391   HG23  THR  52          2HG2      THR  52  12.840   7.492  -8.596
  392    H    PHE  53           H        PHE  53   9.409   9.008  -5.283
  393    HA   PHE  53           HA       PHE  53   9.071   8.760  -3.018
  394    HB2  PHE  53           2HB      PHE  53   6.920   7.469  -2.596
  395    HB3  PHE  53           1HB      PHE  53   6.807   8.791  -3.752
  396    HD1  PHE  53           2HD      PHE  53   7.550   5.132  -3.719
  397    HD2  PHE  53           1HD      PHE  53   5.654   8.391  -5.686
  398    HE1  PHE  53           2HE      PHE  53   6.616   3.578  -5.365
  399    HE2  PHE  53           1HE      PHE  53   4.712   6.843  -7.348
  400    HZ   PHE  53           HZ       PHE  53   5.192   4.432  -7.192
  401    H    GLN  54           H        GLN  54  11.100   6.980  -3.919
  402    HA   GLN  54           HA       GLN  54  11.553   4.536  -3.613
  403    HB2  GLN  54           2HB      GLN  54  12.702   6.716  -2.011
  404    HB3  GLN  54           1HB      GLN  54  13.044   5.105  -1.406
  405    HG2  GLN  54           2HG      GLN  54  14.193   4.496  -3.342
  406    HG3  GLN  54           1HG      GLN  54  13.496   5.815  -4.280
  407   HE21  GLN  54          1HE2      GLN  54  13.961   8.029  -3.060
  408   HE22  GLN  54          2HE2      GLN  54  15.635   8.282  -2.713
  409    HA   PRO  55           HA       PRO  55   8.934   2.704  -0.490
  410    HB2  PRO  55           2HB      PRO  55  10.327   0.195  -0.754
  411    HB3  PRO  55           1HB      PRO  55   8.731   0.628  -1.340
  412    HG2  PRO  55           2HG      PRO  55  10.930   0.153  -2.953
  413    HG3  PRO  55           1HG      PRO  55   9.484   1.051  -3.441
  414    HD2  PRO  55           2HD      PRO  55  12.169   2.066  -2.649
  415    HD3  PRO  55           1HD      PRO  55  10.996   2.745  -3.795
  416    H    THR  56           H        THR  56  12.427   2.491  -0.515
  417    HA   THR  56           HA       THR  56  13.005   1.326   1.927
  418    HB   THR  56           HB       THR  56  14.430   3.848   1.068
  419    HG1  THR  56           1HG      THR  56  14.385   1.369  -0.280
  420   HG21  THR  56          3HG2      THR  56  15.237   2.564   3.027
  421   HG22  THR  56          1HG2      THR  56  16.409   2.687   1.715
  422   HG23  THR  56          2HG2      THR  56  15.511   1.188   1.957
  423    H    THR  57           H        THR  57  12.065   4.803   1.250
  424    HA   THR  57           HA       THR  57  12.326   5.803   3.809
  425    HB   THR  57           HB       THR  57  11.723   7.130   1.793
  426    HG1  THR  57           1HG      THR  57  10.876   8.598   3.041
  427   HG21  THR  57          3HG2      THR  57   9.845   6.906   0.634
  428   HG22  THR  57          1HG2      THR  57   8.856   6.832   2.093
  429   HG23  THR  57          2HG2      THR  57   9.631   5.372   1.478
  430    H    GLY  58           H        GLY  58   9.888   3.655   2.498
  431    HA2  GLY  58           2HA      GLY  58   8.972   2.210   4.385
  432    HA3  GLY  58           1HA      GLY  58   8.523   3.737   5.105
  433    H    HIS  59           H        HIS  59   7.812   1.733   2.122
  434    HA   HIS  59           HA       HIS  59   5.438   3.327   1.721
  435    HB2  HIS  59           2HB      HIS  59   6.862   1.298   0.170
  436    HB3  HIS  59           1HB      HIS  59   5.124   1.075   0.133
  437    HD1  HIS  59           1HD      HIS  59   7.255   4.198  -0.070
  438    HD2  HIS  59           2HD      HIS  59   4.175   2.265  -2.130
  439    HE1  HIS  59           1HE      HIS  59   6.637   5.728  -1.956
  440    HE2  HIS  59           2HE      HIS  59   4.723   4.591  -3.126
  441    H    ARG  60           H        ARG  60   3.552   2.977   2.457
  442    HA   ARG  60           HA       ARG  60   2.980   0.645   4.181
  443    HB2  ARG  60           2HB      ARG  60   1.595   2.205   5.443
  444    HB3  ARG  60           1HB      ARG  60   3.173   2.909   5.207
  445    HG2  ARG  60           2HG      ARG  60   1.696   3.754   3.013
  446    HG3  ARG  60           1HG      ARG  60   0.616   3.903   4.394
  447    HD2  ARG  60           2HD      ARG  60   3.407   5.034   4.220
  448    HD3  ARG  60           1HD      ARG  60   1.922   5.953   4.000
  449    HE   ARG  60           HE       ARG  60   1.479   5.754   6.303
  450   HH11  ARG  60          1HH1      ARG  60   4.532   4.294   5.418
  451   HH12  ARG  60          2HH1      ARG  60   5.122   4.260   7.042
  452   HH21  ARG  60          1HH2      ARG  60   2.263   5.708   8.433
  453   HH22  ARG  60          2HH2      ARG  60   3.837   5.060   8.754
  454    H    LEU  61           H        LEU  61   0.396   0.286   4.294
  455    HA   LEU  61           HA       LEU  61  -0.666   0.353   1.543
  456    HB2  LEU  61           2HB      LEU  61  -0.392  -1.726   3.445
  457    HB3  LEU  61           1HB      LEU  61  -2.094  -1.362   3.417
  458    HG   LEU  61           HG       LEU  61  -0.832  -3.167   1.824
  459   HD11  LEU  61          1HD1      LEU  61  -3.453  -1.814   1.709
  460   HD12  LEU  61          2HD1      LEU  61  -3.046  -3.461   2.175
  461   HD13  LEU  61          3HD1      LEU  61  -3.004  -2.998   0.479
  462   HD21  LEU  61          3HD2      LEU  61  -1.303  -0.749   0.150
  463   HD22  LEU  61          1HD2      LEU  61  -0.965  -2.370  -0.450
  464   HD23  LEU  61          2HD2      LEU  61   0.251  -1.503   0.486
  465    H    CYS  62           H        CYS  62  -3.213   0.851   1.474
  466    HA   CYS  62           HA       CYS  62  -3.941   2.172   3.948
  467    HB2  CYS  62           2HB      CYS  62  -3.975   4.196   3.127
  468    HB3  CYS  62           1HB      CYS  62  -3.070   3.544   1.788
  469    H    SER  63           H        SER  63  -6.343   3.047   3.701
  470    HA   SER  63           HA       SER  63  -7.942   1.575   4.790
  471    HB2  SER  63           2HB      SER  63  -8.407   3.736   2.886
  472    HB3  SER  63           1HB      SER  63  -9.818   2.718   3.137
  473    HG   SER  63           HG       SER  63  -9.592   3.082   5.379
  474    H    VAL  64           H        VAL  64  -9.130   1.752   1.645
  475    HA   VAL  64           HA       VAL  64 -10.460  -0.767   2.202
  476    HB   VAL  64           HB       VAL  64 -11.915  -0.346   0.327
  477   HG11  VAL  64          1HG1      VAL  64 -12.379   2.202   1.210
  478   HG12  VAL  64          2HG1      VAL  64 -11.456   1.503   2.541
  479   HG13  VAL  64          3HG1      VAL  64 -12.944   0.729   1.996
  480   HG21  VAL  64          3HG2      VAL  64 -11.227   2.270  -0.402
  481   HG22  VAL  64          1HG2      VAL  64 -11.186   0.821  -1.407
  482   HG23  VAL  64          2HG2      VAL  64  -9.745   1.314  -0.514
  483    H    HIS  65           H        HIS  65  -7.669  -1.214   1.324
  484    HA   HIS  65           HA       HIS  65  -8.426  -2.910  -0.971
  485    HB2  HIS  65           2HB      HIS  65  -5.637  -2.698  -1.089
  486    HB3  HIS  65           1HB      HIS  65  -6.816  -1.966  -2.158
  487    HD1  HIS  65           1HD      HIS  65  -7.884   0.207  -0.281
  488    HD2  HIS  65           2HD      HIS  65  -3.881  -0.599  -0.917
  489    HE1  HIS  65           1HE      HIS  65  -6.666   2.215   0.499
  490    H    PHE  66           H        PHE  66  -8.760  -3.580   1.755
  491    HA   PHE  66           HA       PHE  66  -6.860  -5.813   1.976
  492    HB2  PHE  66           2HB      PHE  66  -7.832  -3.851   3.984
  493    HB3  PHE  66           1HB      PHE  66  -7.742  -5.512   4.543
  494    HD1  PHE  66           1HD      PHE  66  -5.466  -6.730   3.904
  495    HD2  PHE  66           2HD      PHE  66  -6.001  -2.511   4.267
  496    HE1  PHE  66           1HE      PHE  66  -3.053  -6.461   4.304
  497    HE2  PHE  66           2HE      PHE  66  -3.587  -2.242   4.662
  498    HZ   PHE  66           HZ       PHE  66  -2.104  -4.224   4.681
  499    H    GLN  67           H        GLN  67  -8.004  -7.766   3.313
  500    HA   GLN  67           HA       GLN  67 -10.664  -8.040   2.170
  501    HB2  GLN  67           2HB      GLN  67  -9.041 -10.117   3.626
  502    HB3  GLN  67           1HB      GLN  67 -10.413 -10.379   2.557
  503    HG2  GLN  67           2HG      GLN  67  -7.882  -9.098   1.591
  504    HG3  GLN  67           1HG      GLN  67  -8.082 -10.847   1.646
  505   HE21  GLN  67          1HE2      GLN  67  -9.065 -11.825   0.005
  506   HE22  GLN  67          2HE2      GLN  67  -9.900 -11.028  -1.279
  507    H    GLY  68           H        GLY  68 -12.356  -7.129   3.848
  508    HA2  GLY  68           2HA      GLY  68 -13.444  -7.047   5.827
  509    HA3  GLY  68           1HA      GLY  68 -12.729  -8.602   6.196
  510    H    GLY  69           H        GLY  69 -10.298  -8.413   6.991
  511    HA2  GLY  69           2HA      GLY  69  -9.039  -6.241   7.950
  512    HA3  GLY  69           1HA      GLY  69 -10.320  -6.464   9.134
  513    H    ARG  70           H        ARG  70  -7.371  -6.707   9.375
  514    HA   ARG  70           HA       ARG  70  -6.133  -7.938  10.899
  515    HB2  ARG  70           2HB      ARG  70  -8.146  -9.130  11.713
  516    HB3  ARG  70           1HB      ARG  70  -8.024 -10.234  10.353
  517    HG2  ARG  70           2HG      ARG  70  -6.760 -11.541  11.602
  518    HG3  ARG  70           1HG      ARG  70  -5.513 -10.295  11.566
  519    HD2  ARG  70           2HD      ARG  70  -7.626 -10.777  13.647
  520    HD3  ARG  70           1HD      ARG  70  -5.875 -10.754  13.847
  521    HE   ARG  70           HE       ARG  70  -7.656  -8.489  13.827
  522   HH11  ARG  70          1HH1      ARG  70  -4.365  -9.565  13.393
  523   HH12  ARG  70          2HH1      ARG  70  -3.680  -8.016  13.751
  524   HH21  ARG  70          1HH2      ARG  70  -6.758  -6.453  14.300
  525   HH22  ARG  70          2HH2      ARG  70  -5.038  -6.248  14.266
  526    H    LYS  71           H        LYS  71  -7.283  -9.341   7.894
  527    HA   LYS  71           HA       LYS  71  -6.258 -10.576   6.277
  528    HB2  LYS  71           2HB      LYS  71  -5.350  -8.678   5.423
  529    HB3  LYS  71           1HB      LYS  71  -4.552  -8.247   6.922
  530    HG2  LYS  71           2HG      LYS  71  -3.234 -10.543   5.933
  531    HG3  LYS  71           1HG      LYS  71  -3.470  -9.453   4.572
  532    HD2  LYS  71           2HD      LYS  71  -1.334  -9.094   5.774
  533    HD3  LYS  71           1HD      LYS  71  -2.364  -7.665   5.733
  534    HE2  LYS  71           2HE      LYS  71  -3.191  -8.532   8.048
  535    HE3  LYS  71           1HE      LYS  71  -1.698  -9.469   8.022
  536    HZ1  LYS  71           3HZ      LYS  71  -1.812  -7.047   9.018
  537    HZ2  LYS  71           1HZ      LYS  71  -1.506  -6.622   7.409
  538    HZ3  LYS  71           2HZ      LYS  71  -0.427  -7.623   8.239
  539    H    THR  72           H        THR  72  -5.984 -12.638   6.962
  540    HA   THR  72           HA       THR  72  -3.384 -13.289   8.181
  541    HB   THR  72           HB       THR  72  -5.117 -13.663   9.833
  542    HG1  THR  72           1HG      THR  72  -3.939 -15.327  10.272
  543   HG21  THR  72          3HG2      THR  72  -7.177 -14.116   9.127
  544   HG22  THR  72          1HG2      THR  72  -6.630 -15.790   9.043
  545   HG23  THR  72          2HG2      THR  72  -6.608 -14.783   7.596
  546    H    TYR  73           H        TYR  73  -4.799 -16.188   7.687
  547    HA   TYR  73           HA       TYR  73  -3.173 -16.931   5.570
  548    HB2  TYR  73           2HB      TYR  73  -5.652 -18.484   5.583
  549    HB3  TYR  73           1HB      TYR  73  -4.010 -19.000   5.949
  550    HD1  TYR  73           2HD      TYR  73  -3.144 -18.636   8.312
  551    HD2  TYR  73           1HD      TYR  73  -7.242 -18.181   7.264
  552    HE1  TYR  73           2HE      TYR  73  -3.768 -18.846  10.683
  553    HE2  TYR  73           1HE      TYR  73  -7.877 -18.389   9.631
  554    HH   TYR  73           HH       TYR  73  -6.854 -18.063  11.846
  555    H    THR  74           H        THR  74  -4.291 -17.948   3.394
  556    HA   THR  74           HA       THR  74  -5.195 -17.502   1.382
  557    HB   THR  74           HB       THR  74  -7.441 -15.988   1.688
  558    HG1  THR  74           1HG      THR  74  -7.184 -17.449   4.098
  559   HG21  THR  74          3HG2      THR  74  -7.133 -18.933   2.209
  560   HG22  THR  74          1HG2      THR  74  -7.501 -18.148   0.673
  561   HG23  THR  74          2HG2      THR  74  -8.678 -18.112   1.987
  562    H    VAL  75           H        VAL  75  -5.790 -14.462   3.206
  563    HA   VAL  75           HA       VAL  75  -5.118 -12.872   0.897
  564    HB   VAL  75           HB       VAL  75  -6.859 -12.155   2.469
  565   HG11  VAL  75          1HG1      VAL  75  -5.145 -11.332   4.658
  566   HG12  VAL  75          2HG1      VAL  75  -5.157 -13.078   4.419
  567   HG13  VAL  75          3HG1      VAL  75  -6.672 -12.214   4.676
  568   HG21  VAL  75          3HG2      VAL  75  -6.227  -9.854   2.922
  569   HG22  VAL  75          1HG2      VAL  75  -5.688 -10.325   1.315
  570   HG23  VAL  75          2HG2      VAL  75  -4.533 -10.228   2.651
  571    H    ARG  76           H        ARG  76  -2.866 -13.302   0.406
  572    HA   ARG  76           HA       ARG  76  -0.948 -12.875   2.557
  573    HB2  ARG  76           2HB      ARG  76  -0.719 -13.852  -0.276
  574    HB3  ARG  76           1HB      ARG  76   0.706 -13.348   0.613
  575    HG2  ARG  76           2HG      ARG  76  -0.362 -15.003   2.420
  576    HG3  ARG  76           1HG      ARG  76  -0.987 -15.739   0.944
  577    HD2  ARG  76           2HD      ARG  76   1.763 -15.083   0.556
  578    HD3  ARG  76           1HD      ARG  76   1.601 -15.972   2.068
  579    HE   ARG  76           HE       ARG  76   1.230 -16.991  -0.591
  580   HH11  ARG  76          1HH1      ARG  76   0.392 -17.425   2.769
  581   HH12  ARG  76          2HH1      ARG  76   0.066 -19.118   2.599
  582   HH21  ARG  76          1HH2      ARG  76   0.804 -19.216  -0.817
  583   HH22  ARG  76          2HH2      ARG  76   0.301 -20.135   0.563
  584    H    VAL  77           H        VAL  77  -1.756 -11.405  -0.605
  585    HA   VAL  77           HA       VAL  77  -0.438  -8.966   0.366
  586    HB   VAL  77           HB       VAL  77   0.573  -8.531  -1.743
  587   HG11  VAL  77          1HG1      VAL  77   2.182 -10.058  -1.593
  588   HG12  VAL  77          2HG1      VAL  77   1.085 -11.379  -1.996
  589   HG13  VAL  77          3HG1      VAL  77   1.198 -10.804  -0.333
  590   HG21  VAL  77          3HG2      VAL  77  -1.440 -10.451  -2.765
  591   HG22  VAL  77          1HG2      VAL  77   0.107 -10.348  -3.607
  592   HG23  VAL  77          2HG2      VAL  77  -0.893  -8.909  -3.426
  593    HA   PRO  78           HA       PRO  78  -4.550  -7.166  -0.176
  594    HB2  PRO  78           2HB      PRO  78  -2.754  -4.783  -0.380
  595    HB3  PRO  78           1HB      PRO  78  -4.281  -4.941   0.491
  596    HG2  PRO  78           2HG      PRO  78  -2.107  -5.120   1.896
  597    HG3  PRO  78           1HG      PRO  78  -3.269  -6.457   2.074
  598    HD2  PRO  78           2HD      PRO  78  -0.814  -6.326   0.363
  599    HD3  PRO  78           1HD      PRO  78  -1.274  -7.598   1.518
  600    H    THR  79           H        THR  79  -3.865  -8.184  -2.789
  601    HA   THR  79           HA       THR  79  -4.235  -5.602  -4.158
  602    HB   THR  79           HB       THR  79  -3.913  -7.823  -5.990
  603    HG1  THR  79           1HG      THR  79  -1.686  -7.374  -4.313
  604   HG21  THR  79          3HG2      THR  79  -3.202  -6.012  -7.078
  605   HG22  THR  79          1HG2      THR  79  -1.670  -6.310  -6.253
  606   HG23  THR  79          2HG2      THR  79  -2.818  -5.148  -5.589
  607    H    ILE  80           H        ILE  80  -6.191  -5.149  -4.179
  608    HA   ILE  80           HA       ILE  80  -8.167  -6.970  -5.366
  609    HB   ILE  80           HB       ILE  80  -8.751  -4.992  -3.155
  610   HG12  ILE  80          2HG1      ILE  80  -7.513  -7.067  -2.447
  611   HG13  ILE  80          1HG1      ILE  80  -9.093  -6.863  -1.699
  612   HG21  ILE  80          1HG2      ILE  80 -10.637  -5.129  -4.588
  613   HG22  ILE  80          2HG2      ILE  80 -10.993  -6.124  -3.175
  614   HG23  ILE  80          3HG2      ILE  80 -10.512  -6.886  -4.691
  615   HD11  ILE  80          3HD1      ILE  80  -8.129  -9.111  -3.015
  616   HD12  ILE  80          1HD1      ILE  80  -9.297  -8.400  -4.126
  617   HD13  ILE  80          2HD1      ILE  80  -9.784  -8.815  -2.483
  618    H    PHE  81           H        PHE  81  -8.144  -5.976  -7.479
  619    HA   PHE  81           HA       PHE  81  -9.644  -3.616  -7.737
  620    HB2  PHE  81           2HB      PHE  81  -6.986  -2.906  -8.841
  621    HB3  PHE  81           1HB      PHE  81  -8.212  -1.878  -8.126
  622    HD1  PHE  81           2HD      PHE  81  -8.259  -1.571  -5.609
  623    HD2  PHE  81           1HD      PHE  81  -5.137  -3.680  -7.612
  624    HE1  PHE  81           2HE      PHE  81  -6.859  -1.380  -3.623
  625    HE2  PHE  81           1HE      PHE  81  -3.721  -3.455  -5.620
  626    HZ   PHE  81           HZ       PHE  81  -4.593  -2.350  -3.575
  Start of MODEL    4
    1    H1   GLY   1           1HT      GLY   1  11.838  12.727   3.463
    2    H2   GLY   1           2HT      GLY   1  12.327  13.330   1.960
    3    H3   GLY   1           3HT      GLY   1  12.979  11.881   2.542
    4    HA2  GLY   1           1HA      GLY   1  11.454  11.007   1.131
    5    HA3  GLY   1           2HA      GLY   1  10.479  11.150   2.586
    6    H    SER   2           H        SER   2   9.391  11.068   0.006
    7    HA   SER   2           HA       SER   2   8.802  13.709  -0.920
    8    HB2  SER   2           2HB      SER   2   7.360  12.656  -2.516
    9    HB3  SER   2           1HB      SER   2   8.784  11.628  -2.351
   10    HG   SER   2           HG       SER   2   7.487  10.405  -0.797
   11    HA   PRO   3           HA       PRO   3   5.343  14.587   1.685
   12    HB2  PRO   3           2HB      PRO   3   4.125  16.503   0.276
   13    HB3  PRO   3           1HB      PRO   3   5.740  16.751   0.953
   14    HG2  PRO   3           2HG      PRO   3   4.943  16.068  -1.850
   15    HG3  PRO   3           1HG      PRO   3   6.170  17.216  -1.285
   16    HD2  PRO   3           2HD      PRO   3   6.716  14.660  -2.158
   17    HD3  PRO   3           1HD      PRO   3   7.754  15.585  -1.058
   18    H    GLY   4           H        GLY   4   4.827  12.179   0.408
   19    HA2  GLY   4           2HA      GLY   4   2.094  11.963   0.502
   20    HA3  GLY   4           1HA      GLY   4   2.460  12.317  -1.186
   21    H    PHE   5           H        PHE   5   1.238   9.982  -1.045
   22    HA   PHE   5           HA       PHE   5   2.280   8.061  -2.267
   23    HB2  PHE   5           2HB      PHE   5   3.639   6.553  -1.055
   24    HB3  PHE   5           1HB      PHE   5   4.427   8.124  -1.091
   25    HD1  PHE   5           2HD      PHE   5   1.951   8.692   1.156
   26    HD2  PHE   5           1HD      PHE   5   5.507   6.387   0.796
   27    HE1  PHE   5           2HE      PHE   5   2.167   8.649   3.608
   28    HE2  PHE   5           1HE      PHE   5   5.730   6.337   3.247
   29    HZ   PHE   5           HZ       PHE   5   4.058   7.470   4.655
   30    H    THR   6           H        THR   6   0.035   9.052  -0.675
   31    HA   THR   6           HA       THR   6  -1.063   7.247   1.060
   32    HB   THR   6           HB       THR   6  -2.019   9.399  -0.717
   33    HG1  THR   6           1HG      THR   6  -1.160   9.705   1.403
   34   HG21  THR   6          3HG2      THR   6  -4.142   8.799  -0.888
   35   HG22  THR   6          1HG2      THR   6  -4.237   8.804   0.862
   36   HG23  THR   6          2HG2      THR   6  -3.853   7.315   0.008
   37    H    CYS   7           H        CYS   7   0.034   5.404  -0.484
   38    HA   CYS   7           HA       CYS   7  -0.336   3.489  -1.678
   39    HB2  CYS   7           2HB      CYS   7  -1.837   3.091   0.228
   40    HB3  CYS   7           1HB      CYS   7  -3.115   3.972  -0.591
   41    H    CYS   8           H        CYS   8  -0.050   4.078  -3.862
   42    HA   CYS   8           HA       CYS   8  -1.709   5.617  -5.435
   43    HB2  CYS   8           2HB      CYS   8   0.443   4.790  -6.235
   44    HB3  CYS   8           1HB      CYS   8  -0.185   3.147  -6.269
   45    HG   CYS   8           HG       CYS   8  -0.603   5.263  -8.413
   46    H    VAL   9           H        VAL   9  -3.716   5.073  -4.443
   47    HA   VAL   9           HA       VAL   9  -5.003   2.596  -4.796
   48    HB   VAL   9           HB       VAL   9  -5.905   5.313  -3.912
   49   HG11  VAL   9          1HG1      VAL   9  -7.818   3.316  -3.234
   50   HG12  VAL   9          2HG1      VAL   9  -7.634   3.364  -4.982
   51   HG13  VAL   9          3HG1      VAL   9  -8.058   4.829  -4.102
   52   HG21  VAL   9          3HG2      VAL   9  -4.994   4.579  -2.067
   53   HG22  VAL   9          1HG2      VAL   9  -4.837   2.944  -2.696
   54   HG23  VAL   9          2HG2      VAL   9  -6.352   3.466  -1.962
   55    HA   PRO  10           HA       PRO  10  -6.554   3.577  -8.918
   56    HB2  PRO  10           2HB      PRO  10  -6.941   1.061  -9.716
   57    HB3  PRO  10           1HB      PRO  10  -5.301   1.717  -9.611
   58    HG2  PRO  10           2HG      PRO  10  -6.749  -0.079  -7.714
   59    HG3  PRO  10           1HG      PRO  10  -5.061  -0.145  -8.247
   60    HD2  PRO  10           2HD      PRO  10  -5.922   0.965  -5.859
   61    HD3  PRO  10           1HD      PRO  10  -4.391   1.356  -6.662
   62    H    GLY  11           H        GLY  11  -7.801   1.927  -6.153
   63    HA2  GLY  11           2HA      GLY  11 -10.459   2.810  -6.678
   64    HA3  GLY  11           1HA      GLY  11 -10.305   1.084  -6.922
   65    H    CYS  12           H        CYS  12  -8.145   1.587  -4.454
   66    HA   CYS  12           HA       CYS  12 -10.117   0.681  -2.579
   67    HB2  CYS  12           2HB      CYS  12  -8.087   0.725  -0.940
   68    HB3  CYS  12           1HB      CYS  12  -8.237  -0.518  -2.157
   69    H    TYR  13           H        TYR  13  -8.288   2.193  -0.384
   70    HA   TYR  13           HA       TYR  13 -10.336   3.947   0.339
   71    HB2  TYR  13           2HB      TYR  13  -8.384   2.811   1.719
   72    HB3  TYR  13           1HB      TYR  13  -7.667   4.392   1.526
   73    HD1  TYR  13           1HD      TYR  13 -11.315   3.916   1.775
   74    HD2  TYR  13           2HD      TYR  13  -7.764   4.953   3.879
   75    HE1  TYR  13           1HE      TYR  13 -12.669   4.767   3.634
   76    HE2  TYR  13           2HE      TYR  13  -9.113   5.808   5.742
   77    HH   TYR  13           HH       TYR  13 -11.630   6.770   5.905
   78    H    ASN  14           H        ASN  14  -7.194   5.339   0.404
   79    HA   ASN  14           HA       ASN  14  -7.924   7.514  -1.410
   80    HB2  ASN  14           2HB      ASN  14  -6.610   8.983   0.204
   81    HB3  ASN  14           1HB      ASN  14  -8.111   8.345   0.815
   82   HD21  ASN  14          1HD2      ASN  14  -7.972   6.140   1.791
   83   HD22  ASN  14          2HD2      ASN  14  -6.653   5.757   2.829
   84    H    ASN  15           H        ASN  15  -5.877   8.383  -2.622
   85    HA   ASN  15           HA       ASN  15  -3.936   6.233  -2.665
   86    HB2  ASN  15           2HB      ASN  15  -3.592   6.666  -5.054
   87    HB3  ASN  15           1HB      ASN  15  -5.306   6.513  -4.711
   88   HD21  ASN  15          1HD2      ASN  15  -3.628   7.915  -6.794
   89   HD22  ASN  15          2HD2      ASN  15  -4.309   9.497  -6.874
   90    H    SER  16           H        SER  16  -1.548   6.718  -3.416
   91    HA   SER  16           HA       SER  16  -0.298   8.223  -1.830
   92    HB2  SER  16           2HB      SER  16   1.073   6.714  -3.028
   93    HB3  SER  16           1HB      SER  16   0.352   7.141  -4.542
   94    HG   SER  16           HG       SER  16   1.841   8.554  -4.869
   95    H    HIS  17           H        HIS  17   1.330  10.121  -2.739
   96    HA   HIS  17           HA       HIS  17   1.212  12.453  -2.770
   97    HB2  HIS  17           2HB      HIS  17   1.286  13.051  -5.247
   98    HB3  HIS  17           1HB      HIS  17   2.458  11.877  -4.661
   99    HD1  HIS  17           1HD      HIS  17  -1.133  11.180  -5.659
  100    HD2  HIS  17           2HD      HIS  17   2.744  10.302  -6.870
  101    HE1  HIS  17           1HE      HIS  17  -1.373   9.483  -7.498
  102    HE2  HIS  17           2HE      HIS  17   0.984   9.012  -8.258
  103    H    ARG  18           H        ARG  18  -1.247  12.221  -1.763
  104    HA   ARG  18           HA       ARG  18  -2.696  14.216  -3.186
  105    HB2  ARG  18           2HB      ARG  18  -3.663  12.763  -4.615
  106    HB3  ARG  18           1HB      ARG  18  -3.405  11.386  -3.550
  107    HG2  ARG  18           2HG      ARG  18  -5.440  13.307  -2.636
  108    HG3  ARG  18           1HG      ARG  18  -5.816  12.439  -4.126
  109    HD2  ARG  18           2HD      ARG  18  -4.762  10.504  -2.434
  110    HD3  ARG  18           1HD      ARG  18  -5.787  11.493  -1.398
  111    HE   ARG  18           HE       ARG  18  -6.644   9.812  -3.599
  112   HH11  ARG  18          1HH1      ARG  18  -7.508  12.324  -1.331
  113   HH12  ARG  18          2HH1      ARG  18  -9.208  12.029  -1.465
  114   HH21  ARG  18          1HH2      ARG  18  -8.878   9.425  -3.771
  115   HH22  ARG  18          2HH2      ARG  18  -9.986  10.384  -2.848
  116    H    ASP  19           H        ASP  19  -3.637  11.583  -0.862
  117    HA   ASP  19           HA       ASP  19  -4.898  13.690   0.691
  118    HB2  ASP  19           2HB      ASP  19  -6.455  12.005   0.326
  119    HB3  ASP  19           1HB      ASP  19  -5.328  10.716   0.679
  120    H    LYS  20           H        LYS  20  -2.879  10.891   1.595
  121    HA   LYS  20           HA       LYS  20  -1.448  10.573   3.339
  122    HB2  LYS  20           2HB      LYS  20  -1.112  13.574   3.186
  123    HB3  LYS  20           1HB      LYS  20  -0.003  12.438   3.939
  124    HG2  LYS  20           2HG      LYS  20   1.089  12.405   2.018
  125    HG3  LYS  20           1HG      LYS  20  -0.267  11.485   1.361
  126    HD2  LYS  20           2HD      LYS  20   0.270  13.408  -0.053
  127    HD3  LYS  20           1HD      LYS  20  -1.340  13.561   0.653
  128    HE2  LYS  20           2HE      LYS  20   0.165  15.630   0.655
  129    HE3  LYS  20           1HE      LYS  20  -0.652  15.209   2.159
  130    HZ1  LYS  20           3HZ      LYS  20   1.284  14.605   3.154
  131    HZ2  LYS  20           1HZ      LYS  20   1.898  15.773   2.092
  132    HZ3  LYS  20           2HZ      LYS  20   2.029  14.131   1.712
  133    H    ALA  21           H        ALA  21  -4.324  11.617   3.758
  134    HA   ALA  21           HA       ALA  21  -4.050  12.486   6.547
  135    HB1  ALA  21           1HB      ALA  21  -5.464  14.077   6.012
  136    HB2  ALA  21           2HB      ALA  21  -6.718  12.859   5.796
  137    HB3  ALA  21           3HB      ALA  21  -5.735  13.369   4.422
  138    H    LEU  22           H        LEU  22  -6.207  10.200   4.679
  139    HA   LEU  22           HA       LEU  22  -7.518   9.263   6.948
  140    HB2  LEU  22           2HB      LEU  22  -7.172   7.539   4.492
  141    HB3  LEU  22           1HB      LEU  22  -8.601   7.762   5.497
  142    HG   LEU  22           HG       LEU  22  -7.716   9.296   3.146
  143   HD11  LEU  22          1HD1      LEU  22 -10.436   9.683   3.827
  144   HD12  LEU  22          2HD1      LEU  22 -10.060   7.989   4.114
  145   HD13  LEU  22          3HD1      LEU  22  -9.766   8.706   2.525
  146   HD21  LEU  22          3HD2      LEU  22  -8.407  10.636   5.674
  147   HD22  LEU  22          1HD2      LEU  22  -9.276  11.187   4.246
  148   HD23  LEU  22          2HD2      LEU  22  -7.520  11.229   4.277
  149    H    HIS  23           H        HIS  23  -6.993   6.232   6.821
  150    HA   HIS  23           HA       HIS  23  -4.585   6.393   8.418
  151    HB2  HIS  23           2HB      HIS  23  -7.044   5.030   8.630
  152    HB3  HIS  23           1HB      HIS  23  -5.821   3.782   8.414
  153    HD1  HIS  23           1HD      HIS  23  -7.492   5.348  11.036
  154    HD2  HIS  23           2HD      HIS  23  -3.474   4.573  10.315
  155    HE1  HIS  23           1HE      HIS  23  -6.375   5.442  13.288
  156    HE2  HIS  23           2HE      HIS  23  -3.933   5.040  12.818
  157    H    PHE  24           H        PHE  24  -2.680   4.961   8.057
  158    HA   PHE  24           HA       PHE  24  -2.879   3.386   5.644
  159    HB2  PHE  24           2HB      PHE  24  -0.761   5.385   6.285
  160    HB3  PHE  24           1HB      PHE  24  -0.417   4.024   5.220
  161    HD1  PHE  24           2HD      PHE  24  -2.997   6.666   5.704
  162    HD2  PHE  24           1HD      PHE  24  -0.755   4.390   2.854
  163    HE1  PHE  24           2HE      PHE  24  -4.095   7.831   3.843
  164    HE2  PHE  24           1HE      PHE  24  -1.878   5.490   1.083
  165    HZ   PHE  24           HZ       PHE  24  -3.531   7.214   1.507
  166    H    TYR  25           H        TYR  25  -1.895   1.269   5.708
  167    HA   TYR  25           HA       TYR  25  -0.992   0.374   8.293
  168    HB2  TYR  25           2HB      TYR  25  -1.696  -0.968   5.696
  169    HB3  TYR  25           1HB      TYR  25  -0.784  -1.853   6.912
  170    HD1  TYR  25           2HD      TYR  25  -3.490   0.616   7.521
  171    HD2  TYR  25           1HD      TYR  25  -2.356  -3.485   7.563
  172    HE1  TYR  25           2HE      TYR  25  -5.590   0.051   8.669
  173    HE2  TYR  25           1HE      TYR  25  -4.460  -4.065   8.709
  174    HH   TYR  25           HH       TYR  25  -6.676  -3.174   9.040
  175    H    THR  26           H        THR  26   1.193  -0.858   8.491
  176    HA   THR  26           HA       THR  26   3.107   0.495   6.736
  177    HB   THR  26           HB       THR  26   4.422   0.799   8.532
  178    HG1  THR  26           1HG      THR  26   3.904  -1.855   9.381
  179   HG21  THR  26          3HG2      THR  26   2.278  -0.451  10.223
  180   HG22  THR  26          1HG2      THR  26   2.188   1.183   9.570
  181   HG23  THR  26          2HG2      THR  26   3.471   0.756  10.700
  182    H    PHE  27           H        PHE  27   5.289  -0.762   6.513
  183    HA   PHE  27           HA       PHE  27   4.699  -3.012   4.942
  184    HB2  PHE  27           2HB      PHE  27   6.681  -1.088   5.176
  185    HB3  PHE  27           1HB      PHE  27   7.488  -2.631   5.185
  186    HD1  PHE  27           2HD      PHE  27   4.435  -2.616   3.298
  187    HD2  PHE  27           1HD      PHE  27   8.579  -1.650   3.114
  188    HE1  PHE  27           2HE      PHE  27   4.341  -2.629   0.848
  189    HE2  PHE  27           1HE      PHE  27   8.474  -1.672   0.663
  190    HZ   PHE  27           HZ       PHE  27   6.352  -2.163  -0.474
  191    HA   PRO  28           HA       PRO  28   5.480  -6.501   7.808
  192    HB2  PRO  28           2HB      PRO  28   6.713  -7.457   5.207
  193    HB3  PRO  28           1HB      PRO  28   5.795  -8.412   6.362
  194    HG2  PRO  28           2HG      PRO  28   4.595  -7.496   4.235
  195    HG3  PRO  28           1HG      PRO  28   3.777  -7.349   5.796
  196    HD2  PRO  28           2HD      PRO  28   5.025  -5.275   4.106
  197    HD3  PRO  28           1HD      PRO  28   3.700  -5.149   5.251
  198    H    LYS  29           H        LYS  29   7.540  -7.872   8.412
  199    HA   LYS  29           HA       LYS  29   9.821  -6.061   8.487
  200    HB2  LYS  29           2HB      LYS  29  10.225  -8.604   9.835
  201    HB3  LYS  29           1HB      LYS  29  10.300  -6.972  10.476
  202    HG2  LYS  29           2HG      LYS  29   7.826  -6.994  10.670
  203    HG3  LYS  29           1HG      LYS  29   7.844  -8.683  10.159
  204    HD2  LYS  29           2HD      LYS  29   7.716  -8.461  12.603
  205    HD3  LYS  29           1HD      LYS  29   9.196  -9.277  12.090
  206    HE2  LYS  29           2HE      LYS  29   9.227  -6.321  12.491
  207    HE3  LYS  29           1HE      LYS  29   9.259  -7.377  13.903
  208    HZ1  LYS  29           3HZ      LYS  29  11.366  -6.705  12.154
  209    HZ2  LYS  29           1HZ      LYS  29  11.122  -8.380  12.106
  210    HZ3  LYS  29           2HZ      LYS  29  11.424  -7.610  13.581
  211    H    ASP  30           H        ASP  30   8.809  -8.815   6.775
  212    HA   ASP  30           HA       ASP  30  11.459  -9.805   6.154
  213    HB2  ASP  30           2HB      ASP  30   9.446 -10.738   4.334
  214    HB3  ASP  30           1HB      ASP  30  10.313 -11.670   5.544
  215    H    ALA  31           H        ALA  31  12.764  -8.719   4.739
  216    HA   ALA  31           HA       ALA  31  12.169  -6.582   3.262
  217    HB1  ALA  31           1HB      ALA  31  14.385  -6.936   3.353
  218    HB2  ALA  31           2HB      ALA  31  14.114  -7.480   1.707
  219    HB3  ALA  31           3HB      ALA  31  14.267  -8.659   3.016
  220    H    GLU  32           H        GLU  32  12.303  -9.793   1.496
  221    HA   GLU  32           HA       GLU  32  11.189  -8.755  -0.863
  222    HB2  GLU  32           2HB      GLU  32  12.242 -10.880  -0.892
  223    HB3  GLU  32           1HB      GLU  32  11.165 -11.595   0.235
  224    HG2  GLU  32           2HG      GLU  32  10.060 -10.528  -2.310
  225    HG3  GLU  32           1HG      GLU  32  10.965 -12.040  -2.342
  226    H    LEU  33           H        LEU  33   9.163 -10.629   1.575
  227    HA   LEU  33           HA       LEU  33   6.837 -10.291   0.293
  228    HB2  LEU  33           2HB      LEU  33   7.287 -11.066   2.740
  229    HB3  LEU  33           1HB      LEU  33   6.992  -9.399   3.158
  230    HG   LEU  33           HG       LEU  33   4.804  -9.679   3.098
  231   HD11  LEU  33          1HD1      LEU  33   3.582 -10.634   1.191
  232   HD12  LEU  33          2HD1      LEU  33   5.104 -11.186   0.498
  233   HD13  LEU  33          3HD1      LEU  33   4.788  -9.463   0.662
  234   HD21  LEU  33          3HD2      LEU  33   5.718 -12.490   2.820
  235   HD22  LEU  33          1HD2      LEU  33   4.001 -12.110   2.869
  236   HD23  LEU  33          2HD2      LEU  33   5.035 -11.661   4.221
  237    H    ARG  34           H        ARG  34   8.701  -7.849   1.854
  238    HA   ARG  34           HA       ARG  34   6.949  -5.660   1.745
  239    HB2  ARG  34           2HB      ARG  34   8.708  -4.992   3.008
  240    HB3  ARG  34           1HB      ARG  34   9.792  -6.076   2.203
  241    HG2  ARG  34           2HG      ARG  34   9.056  -3.750   0.595
  242    HG3  ARG  34           1HG      ARG  34   9.889  -3.370   2.100
  243    HD2  ARG  34           2HD      ARG  34  11.485  -5.309   1.298
  244    HD3  ARG  34           1HD      ARG  34  10.867  -4.845  -0.286
  245    HE   ARG  34           HE       ARG  34  12.574  -3.279   1.471
  246   HH11  ARG  34          1HH1      ARG  34  10.590  -3.334  -1.405
  247   HH12  ARG  34          2HH1      ARG  34  11.359  -1.948  -2.101
  248   HH21  ARG  34          1HH2      ARG  34  13.574  -1.459   0.548
  249   HH22  ARG  34          2HH2      ARG  34  13.043  -0.883  -0.997
  250    H    ARG  35           H        ARG  35   9.595  -6.434  -0.459
  251    HA   ARG  35           HA       ARG  35   8.923  -4.482  -2.305
  252    HB2  ARG  35           2HB      ARG  35  10.186  -5.755  -3.983
  253    HB3  ARG  35           1HB      ARG  35  11.061  -5.605  -2.472
  254    HG2  ARG  35           2HG      ARG  35  11.475  -7.769  -3.131
  255    HG3  ARG  35           1HG      ARG  35  10.185  -7.955  -1.962
  256    HD2  ARG  35           2HD      ARG  35   9.769  -9.358  -3.886
  257    HD3  ARG  35           1HD      ARG  35   8.559  -8.088  -3.812
  258    HE   ARG  35           HE       ARG  35  10.734  -7.306  -5.447
  259   HH11  ARG  35          1HH1      ARG  35   7.906  -9.351  -5.411
  260   HH12  ARG  35          2HH1      ARG  35   7.696  -9.305  -7.129
  261   HH21  ARG  35          1HH2      ARG  35  10.461  -7.245  -7.708
  262   HH22  ARG  35          2HH2      ARG  35   9.148  -8.111  -8.434
  263    H    LEU  36           H        LEU  36   7.558  -7.693  -1.710
  264    HA   LEU  36           HA       LEU  36   6.099  -7.787  -4.196
  265    HB2  LEU  36           2HB      LEU  36   5.489  -8.964  -1.499
  266    HB3  LEU  36           1HB      LEU  36   4.374  -9.112  -2.831
  267    HG   LEU  36           HG       LEU  36   7.227 -10.071  -2.971
  268   HD11  LEU  36          1HD1      LEU  36   6.421 -11.478  -1.344
  269   HD12  LEU  36          2HD1      LEU  36   5.967 -12.350  -2.808
  270   HD13  LEU  36          3HD1      LEU  36   4.764 -11.398  -1.940
  271   HD21  LEU  36          3HD2      LEU  36   5.948  -9.567  -5.087
  272   HD22  LEU  36          1HD2      LEU  36   4.847 -10.867  -4.632
  273   HD23  LEU  36          2HD2      LEU  36   6.550 -11.217  -4.930
  274    H    TRP  37           H        TRP  37   5.225  -6.330  -1.082
  275    HA   TRP  37           HA       TRP  37   2.728  -5.438  -2.007
  276    HB2  TRP  37           2HB      TRP  37   4.594  -4.481   0.151
  277    HB3  TRP  37           1HB      TRP  37   3.105  -3.622  -0.217
  278    HD1  TRP  37           HD       TRP  37   3.282  -7.420  -0.349
  279    HE1  TRP  37           1HE      TRP  37   1.833  -8.399   1.583
  280    HE3  TRP  37           3HE      TRP  37   2.046  -3.070   1.995
  281    HZ2  TRP  37           2HZ      TRP  37   0.317  -7.382   3.798
  282    HZ3  TRP  37           3HZ      TRP  37   0.627  -3.135   3.976
  283    HH2  TRP  37           HH       TRP  37  -0.234  -5.235   4.853
  284    H    LEU  38           H        LEU  38   6.050  -4.058  -2.231
  285    HA   LEU  38           HA       LEU  38   5.676  -1.490  -3.001
  286    HB2  LEU  38           2HB      LEU  38   7.429  -3.647  -4.142
  287    HB3  LEU  38           1HB      LEU  38   7.361  -2.121  -4.936
  288    HG   LEU  38           HG       LEU  38   8.402  -2.722  -2.204
  289   HD11  LEU  38          1HD1      LEU  38  10.214  -2.778  -3.555
  290   HD12  LEU  38          2HD1      LEU  38  10.127  -1.025  -3.361
  291   HD13  LEU  38          3HD1      LEU  38   9.451  -1.788  -4.800
  292   HD21  LEU  38          3HD2      LEU  38   7.352  -0.840  -1.523
  293   HD22  LEU  38          1HD2      LEU  38   7.141  -0.233  -3.165
  294   HD23  LEU  38          2HD2      LEU  38   8.694  -0.059  -2.356
  295    H    LYS  39           H        LYS  39   5.177  -4.472  -5.049
  296    HA   LYS  39           HA       LYS  39   4.348  -3.339  -7.388
  297    HB2  LYS  39           2HB      LYS  39   4.110  -5.881  -5.969
  298    HB3  LYS  39           1HB      LYS  39   2.854  -5.640  -7.149
  299    HG2  LYS  39           2HG      LYS  39   5.114  -6.825  -7.731
  300    HG3  LYS  39           1HG      LYS  39   4.297  -5.791  -8.908
  301    HD2  LYS  39           2HD      LYS  39   6.187  -4.418  -7.106
  302    HD3  LYS  39           1HD      LYS  39   6.913  -5.575  -8.222
  303    HE2  LYS  39           2HE      LYS  39   6.531  -4.272 -10.008
  304    HE3  LYS  39           1HE      LYS  39   4.916  -3.827  -9.454
  305    HZ1  LYS  39           3HZ      LYS  39   6.405  -2.484  -7.719
  306    HZ2  LYS  39           1HZ      LYS  39   5.899  -1.833  -9.197
  307    HZ3  LYS  39           2HZ      LYS  39   7.457  -2.475  -9.042
  308    H    ASN  40           H        ASN  40   2.128  -4.467  -4.844
  309    HA   ASN  40           HA       ASN  40  -0.211  -3.578  -6.089
  310    HB2  ASN  40           2HB      ASN  40  -0.481  -3.463  -3.206
  311    HB3  ASN  40           1HB      ASN  40  -1.237  -4.549  -4.359
  312   HD21  ASN  40          1HD2      ASN  40  -0.237  -5.075  -1.692
  313   HD22  ASN  40          2HD2      ASN  40   0.954  -6.314  -1.848
  314    H    VAL  41           H        VAL  41   2.067  -1.849  -4.202
  315    HA   VAL  41           HA       VAL  41   0.298   0.308  -3.604
  316    HB   VAL  41           HB       VAL  41   2.598  -0.548  -2.427
  317   HG11  VAL  41          1HG1      VAL  41   3.959   0.526  -4.178
  318   HG12  VAL  41          2HG1      VAL  41   4.231   1.226  -2.586
  319   HG13  VAL  41          3HG1      VAL  41   3.234   2.076  -3.765
  320   HG21  VAL  41          3HG2      VAL  41   1.559   2.248  -2.087
  321   HG22  VAL  41          1HG2      VAL  41   2.195   1.148  -0.864
  322   HG23  VAL  41          2HG2      VAL  41   0.621   0.836  -1.597
  323    H    SER  42           H        SER  42   2.410  -0.315  -6.342
  324    HA   SER  42           HA       SER  42   1.650   1.327  -8.178
  325    HB2  SER  42           2HB      SER  42   1.366   3.444  -7.344
  326    HB3  SER  42           1HB      SER  42   2.470   3.193  -5.983
  327    HG   SER  42           HG       SER  42   2.961   4.625  -8.045
  328    H    ARG  43           H        ARG  43   4.882   2.519  -6.895
  329    HA   ARG  43           HA       ARG  43   6.263   0.425  -8.273
  330    HB2  ARG  43           2HB      ARG  43   5.468   2.601  -9.826
  331    HB3  ARG  43           1HB      ARG  43   7.149   2.945  -9.443
  332    HG2  ARG  43           2HG      ARG  43   6.518   0.204 -10.358
  333    HG3  ARG  43           1HG      ARG  43   6.406   1.499 -11.551
  334    HD2  ARG  43           2HD      ARG  43   8.609   1.329 -11.811
  335    HD3  ARG  43           1HD      ARG  43   8.781   1.994 -10.188
  336    HE   ARG  43           HE       ARG  43   8.380  -0.676  -9.793
  337   HH11  ARG  43          1HH1      ARG  43  10.670   1.222 -11.617
  338   HH12  ARG  43          2HH1      ARG  43  11.947   0.063 -11.461
  339   HH21  ARG  43          1HH2      ARG  43  10.057  -2.204  -9.586
  340   HH22  ARG  43          2HH2      ARG  43  11.599  -1.882 -10.308
  341    H    ALA  44           H        ALA  44   8.797   1.141  -8.340
  342    HA   ALA  44           HA       ALA  44   9.426   1.786  -5.614
  343    HB1  ALA  44           1HB      ALA  44  11.526   1.693  -7.737
  344    HB2  ALA  44           2HB      ALA  44  10.630   0.223  -7.353
  345    HB3  ALA  44           3HB      ALA  44  11.549   1.047  -6.093
  346    H    GLY  45           H        GLY  45   8.267   4.145  -5.879
  347    HA2  GLY  45           2HA      GLY  45   8.685   6.390  -5.760
  348    HA3  GLY  45           1HA      GLY  45  10.394   6.035  -5.944
  349    H    VAL  46           H        VAL  46   9.154   4.575  -8.552
  350    HA   VAL  46           HA       VAL  46   9.361   5.056 -10.769
  351    HB   VAL  46           HB       VAL  46   7.066   6.100  -9.812
  352   HG11  VAL  46          1HG1      VAL  46   6.659   8.299 -10.467
  353   HG12  VAL  46          2HG1      VAL  46   8.116   8.371 -11.461
  354   HG13  VAL  46          3HG1      VAL  46   8.246   8.380  -9.701
  355   HG21  VAL  46          3HG2      VAL  46   6.627   6.583 -12.349
  356   HG22  VAL  46          1HG2      VAL  46   6.919   4.941 -11.776
  357   HG23  VAL  46          2HG2      VAL  46   8.222   5.854 -12.541
  358    H    SER  47           H        SER  47  11.744   5.759  -9.867
  359    HA   SER  47           HA       SER  47  13.248   7.665  -9.552
  360    HB2  SER  47           2HB      SER  47  14.052   6.045 -11.119
  361    HB3  SER  47           1HB      SER  47  12.927   6.600 -12.370
  362    HG   SER  47           HG       SER  47  14.908   8.303 -11.288
  363    H    GLY  48           H        GLY  48  11.580   8.245 -12.867
  364    HA2  GLY  48           2HA      GLY  48  12.173  10.930 -12.992
  365    HA3  GLY  48           1HA      GLY  48  10.759  10.194 -13.728
  366    H    CYS  49           H        CYS  49  10.401  12.689 -13.059
  367    HA   CYS  49           HA       CYS  49   9.665  13.269 -10.410
  368    HB2  CYS  49           2HB      CYS  49   8.458  14.542 -12.867
  369    HB3  CYS  49           1HB      CYS  49   8.680  15.263 -11.278
  370    HG   CYS  49           HG       CYS  49  10.508  16.065 -13.056
  371    H    PHE  50           H        PHE  50   6.953  14.365 -11.108
  372    HA   PHE  50           HA       PHE  50   4.741  13.767 -11.151
  373    HB2  PHE  50           2HB      PHE  50   5.642  11.984 -12.849
  374    HB3  PHE  50           1HB      PHE  50   5.460  10.858 -11.509
  375    HD1  PHE  50           2HD      PHE  50   3.241  10.385 -10.578
  376    HD2  PHE  50           1HD      PHE  50   3.747  12.879 -13.990
  377    HE1  PHE  50           2HE      PHE  50   0.850  10.145 -11.104
  378    HE2  PHE  50           1HE      PHE  50   1.356  12.644 -14.520
  379    HZ   PHE  50           HZ       PHE  50  -0.096  11.276 -13.076
  380    H    SER  51           H        SER  51   6.667  11.043  -9.576
  381    HA   SER  51           HA       SER  51   5.014  11.550  -7.186
  382    HB2  SER  51           2HB      SER  51   4.789   9.258  -6.764
  383    HB3  SER  51           1HB      SER  51   4.580   9.367  -8.509
  384    HG   SER  51           HG       SER  51   6.702   8.321  -7.026
  385    H    THR  52           H        THR  52   7.961   9.727  -8.058
  386    HA   THR  52           HA       THR  52   9.948   9.481  -6.961
  387    HB   THR  52           HB       THR  52  10.826  11.794  -6.096
  388    HG1  THR  52           1HG      THR  52   8.818  12.837  -6.072
  389   HG21  THR  52          3HG2      THR  52  10.751  10.599  -8.648
  390   HG22  THR  52          1HG2      THR  52  11.915  11.761  -8.011
  391   HG23  THR  52          2HG2      THR  52  10.475  12.328  -8.859
  392    H    PHE  53           H        PHE  53   8.069   8.497  -5.344
  393    HA   PHE  53           HA       PHE  53   8.509   9.736  -2.720
  394    HB2  PHE  53           2HB      PHE  53   6.607   8.171  -2.022
  395    HB3  PHE  53           1HB      PHE  53   6.202   9.545  -3.037
  396    HD1  PHE  53           1HD      PHE  53   7.530   6.124  -3.832
  397    HD2  PHE  53           2HD      PHE  53   4.438   9.006  -4.378
  398    HE1  PHE  53           1HE      PHE  53   6.425   4.633  -5.440
  399    HE2  PHE  53           2HE      PHE  53   3.331   7.514  -5.989
  400    HZ   PHE  53           HZ       PHE  53   4.326   5.324  -6.521
  401    H    GLN  54           H        GLN  54  10.682   8.428  -3.614
  402    HA   GLN  54           HA       GLN  54  11.549   6.062  -3.526
  403    HB2  GLN  54           2HB      GLN  54  12.864   8.074  -2.780
  404    HB3  GLN  54           1HB      GLN  54  12.305   7.749  -1.148
  405    HG2  GLN  54           2HG      GLN  54  13.376   5.478  -1.355
  406    HG3  GLN  54           1HG      GLN  54  14.111   6.059  -2.849
  407   HE21  GLN  54          1HE2      GLN  54  13.553   7.631   0.282
  408   HE22  GLN  54          2HE2      GLN  54  15.207   8.041   0.562
  409    HA   PRO  55           HA       PRO  55   8.973   3.722  -0.653
  410    HB2  PRO  55           2HB      PRO  55  10.718   1.455  -1.301
  411    HB3  PRO  55           1HB      PRO  55   8.980   1.646  -1.532
  412    HG2  PRO  55           2HG      PRO  55  10.700   1.666  -3.604
  413    HG3  PRO  55           1HG      PRO  55   9.213   2.630  -3.595
  414    HD2  PRO  55           2HD      PRO  55  12.036   3.479  -3.096
  415    HD3  PRO  55           1HD      PRO  55  10.738   4.323  -3.977
  416    H    THR  56           H        THR  56  12.497   3.662  -0.632
  417    HA   THR  56           HA       THR  56  13.074   2.300   1.693
  418    HB   THR  56           HB       THR  56  15.075   3.574   1.839
  419    HG1  THR  56           1HG      THR  56  14.523   5.651   1.929
  420   HG21  THR  56          3HG2      THR  56  14.257   2.642  -0.648
  421   HG22  THR  56          1HG2      THR  56  15.903   2.996  -0.124
  422   HG23  THR  56          2HG2      THR  56  14.958   4.232  -0.953
  423    H    THR  57           H        THR  57  11.844   5.726   1.379
  424    HA   THR  57           HA       THR  57  12.060   6.538   3.999
  425    HB   THR  57           HB       THR  57  11.271   7.946   2.120
  426    HG1  THR  57           1HG      THR  57   9.479   7.841   4.315
  427   HG21  THR  57          3HG2      THR  57   8.460   7.268   2.423
  428   HG22  THR  57          1HG2      THR  57   9.404   6.000   1.644
  429   HG23  THR  57          2HG2      THR  57   9.390   7.630   0.970
  430    H    GLY  58           H        GLY  58   9.845   4.210   2.624
  431    HA2  GLY  58           2HA      GLY  58   9.017   2.565   4.332
  432    HA3  GLY  58           1HA      GLY  58   8.583   3.967   5.279
  433    H    HIS  59           H        HIS  59   7.669   2.261   2.181
  434    HA   HIS  59           HA       HIS  59   5.374   3.969   1.931
  435    HB2  HIS  59           2HB      HIS  59   6.718   2.025   0.281
  436    HB3  HIS  59           1HB      HIS  59   4.985   1.707   0.305
  437    HD1  HIS  59           1HD      HIS  59   7.043   4.903   0.072
  438    HD2  HIS  59           2HD      HIS  59   3.866   2.991  -1.817
  439    HE1  HIS  59           1HE      HIS  59   6.301   6.467  -1.745
  440    HE2  HIS  59           2HE      HIS  59   4.422   5.263  -2.917
  441    H    ARG  60           H        ARG  60   3.445   3.696   2.669
  442    HA   ARG  60           HA       ARG  60   2.771   1.223   4.116
  443    HB2  ARG  60           2HB      ARG  60   1.461   2.683   5.607
  444    HB3  ARG  60           1HB      ARG  60   3.114   3.229   5.478
  445    HG2  ARG  60           2HG      ARG  60   2.417   4.907   3.801
  446    HG3  ARG  60           1HG      ARG  60   0.744   4.452   4.096
  447    HD2  ARG  60           2HD      ARG  60   2.589   6.063   5.720
  448    HD3  ARG  60           1HD      ARG  60   0.835   6.129   5.605
  449    HE   ARG  60           HE       ARG  60   0.677   4.622   7.360
  450   HH11  ARG  60          1HH1      ARG  60   4.014   5.001   6.387
  451   HH12  ARG  60          2HH1      ARG  60   4.640   4.201   7.790
  452   HH21  ARG  60          1HH2      ARG  60   1.509   3.571   9.203
  453   HH22  ARG  60          2HH2      ARG  60   3.222   3.390   9.385
  454    H    LEU  61           H        LEU  61   0.218   0.842   4.140
  455    HA   LEU  61           HA       LEU  61  -0.842   1.426   1.458
  456    HB2  LEU  61           2HB      LEU  61  -1.131  -1.023   3.188
  457    HB3  LEU  61           1HB      LEU  61  -2.113  -0.752   1.783
  458    HG   LEU  61           HG       LEU  61   0.473  -1.917   1.950
  459   HD11  LEU  61          1HD1      LEU  61   0.079  -2.467  -0.396
  460   HD12  LEU  61          2HD1      LEU  61  -1.332  -1.415  -0.387
  461   HD13  LEU  61          3HD1      LEU  61  -1.288  -2.849   0.639
  462   HD21  LEU  61          3HD2      LEU  61   1.418  -0.706  -0.067
  463   HD22  LEU  61          1HD2      LEU  61   1.570   0.088   1.496
  464   HD23  LEU  61          2HD2      LEU  61   0.326   0.607   0.357
  465    H    CYS  62           H        CYS  62  -3.441   1.487   1.273
  466    HA   CYS  62           HA       CYS  62  -4.441   2.665   3.739
  467    HB2  CYS  62           2HB      CYS  62  -5.891   4.095   2.448
  468    HB3  CYS  62           1HB      CYS  62  -4.285   4.201   1.821
  469    H    SER  63           H        SER  63  -6.582   2.516   4.411
  470    HA   SER  63           HA       SER  63  -7.432   0.423   5.492
  471    HB2  SER  63           2HB      SER  63  -8.573   2.882   4.700
  472    HB3  SER  63           1HB      SER  63  -9.821   1.662   4.521
  473    HG   SER  63           HG       SER  63  -9.252   0.989   6.707
  474    H    VAL  64           H        VAL  64  -9.585   1.205   2.996
  475    HA   VAL  64           HA       VAL  64 -11.027  -1.059   2.875
  476    HB   VAL  64           HB       VAL  64 -11.899  -0.157   0.707
  477   HG11  VAL  64          1HG1      VAL  64 -12.503   0.571   3.116
  478   HG12  VAL  64          2HG1      VAL  64 -12.968   1.632   1.784
  479   HG13  VAL  64          3HG1      VAL  64 -11.545   2.011   2.760
  480   HG21  VAL  64          3HG2      VAL  64 -10.999   2.087   0.104
  481   HG22  VAL  64          1HG2      VAL  64  -9.868   0.766  -0.185
  482   HG23  VAL  64          2HG2      VAL  64  -9.666   1.808   1.228
  483    H    HIS  65           H        HIS  65  -8.214  -1.958   2.282
  484    HA   HIS  65           HA       HIS  65  -8.666  -3.188  -0.368
  485    HB2  HIS  65           2HB      HIS  65  -6.208  -3.728   1.211
  486    HB3  HIS  65           1HB      HIS  65  -6.421  -3.675  -0.536
  487    HD1  HIS  65           1HD      HIS  65  -7.996  -0.770   0.210
  488    HD2  HIS  65           2HD      HIS  65  -4.074  -1.953   0.542
  489    HE1  HIS  65           1HE      HIS  65  -6.716   1.331   0.492
  490    H    PHE  66           H        PHE  66  -7.706  -4.418   2.928
  491    HA   PHE  66           HA       PHE  66  -7.965  -7.086   2.133
  492    HB2  PHE  66           2HB      PHE  66  -8.288  -6.204   4.999
  493    HB3  PHE  66           1HB      PHE  66  -7.468  -7.628   4.369
  494    HD1  PHE  66           2HD      PHE  66  -5.216  -7.471   3.458
  495    HD2  PHE  66           1HD      PHE  66  -7.149  -4.076   5.147
  496    HE1  PHE  66           2HE      PHE  66  -3.057  -6.313   3.590
  497    HE2  PHE  66           1HE      PHE  66  -4.986  -2.906   5.271
  498    HZ   PHE  66           HZ       PHE  66  -2.928  -4.024   4.481
  499    H    GLN  67           H        GLN  67  -9.699  -8.599   3.392
  500    HA   GLN  67           HA       GLN  67 -12.232  -7.398   2.772
  501    HB2  GLN  67           2HB      GLN  67 -12.803  -9.931   3.757
  502    HB3  GLN  67           1HB      GLN  67 -12.621  -9.497   2.073
  503    HG2  GLN  67           2HG      GLN  67 -11.291 -11.405   2.436
  504    HG3  GLN  67           1HG      GLN  67 -10.183 -10.043   2.300
  505   HE21  GLN  67          1HE2      GLN  67 -11.694 -12.302   4.496
  506   HE22  GLN  67          2HE2      GLN  67 -10.559 -12.113   5.785
  507    H    GLY  68           H        GLY  68 -14.055  -7.249   4.595
  508    HA2  GLY  68           2HA      GLY  68 -14.198  -6.173   6.746
  509    HA3  GLY  68           1HA      GLY  68 -14.358  -7.889   7.018
  510    H    GLY  69           H        GLY  69 -11.867  -5.227   7.109
  511    HA2  GLY  69           2HA      GLY  69  -9.708  -5.407   8.051
  512    HA3  GLY  69           1HA      GLY  69 -10.789  -5.231   9.415
  513    H    ARG  70           H        ARG  70  -8.237  -6.969   8.204
  514    HA   ARG  70           HA       ARG  70  -7.767  -8.579  10.295
  515    HB2  ARG  70           2HB      ARG  70  -9.587  -9.964  10.324
  516    HB3  ARG  70           1HB      ARG  70  -9.916  -9.751   8.615
  517    HG2  ARG  70           2HG      ARG  70  -8.273 -11.365   8.023
  518    HG3  ARG  70           1HG      ARG  70  -7.667 -11.439   9.681
  519    HD2  ARG  70           2HD      ARG  70 -10.537 -12.053   9.209
  520    HD3  ARG  70           1HD      ARG  70  -9.343 -13.249   8.712
  521    HE   ARG  70           HE       ARG  70  -8.771 -13.594  10.943
  522   HH11  ARG  70          1HH1      ARG  70 -11.172 -11.071  10.650
  523   HH12  ARG  70          2HH1      ARG  70 -11.576 -11.094  12.333
  524   HH21  ARG  70          1HH2      ARG  70  -9.305 -13.618  13.151
  525   HH22  ARG  70          2HH2      ARG  70 -10.518 -12.537  13.752
  526    H    LYS  71           H        LYS  71  -8.027  -8.699   6.791
  527    HA   LYS  71           HA       LYS  71  -6.502  -9.093   5.167
  528    HB2  LYS  71           2HB      LYS  71  -5.251  -7.319   6.175
  529    HB3  LYS  71           1HB      LYS  71  -4.672  -8.382   7.443
  530    HG2  LYS  71           2HG      LYS  71  -3.365  -9.629   5.757
  531    HG3  LYS  71           1HG      LYS  71  -3.902  -8.480   4.535
  532    HD2  LYS  71           2HD      LYS  71  -1.601  -8.106   5.599
  533    HD3  LYS  71           1HD      LYS  71  -2.680  -6.722   5.490
  534    HE2  LYS  71           2HE      LYS  71  -3.408  -7.338   7.879
  535    HE3  LYS  71           1HE      LYS  71  -1.955  -8.353   7.889
  536    HZ1  LYS  71           3HZ      LYS  71  -1.560  -6.144   8.830
  537    HZ2  LYS  71           1HZ      LYS  71  -1.977  -5.433   7.350
  538    HZ3  LYS  71           2HZ      LYS  71  -0.608  -6.421   7.460
  539    H    THR  72           H        THR  72  -7.395 -11.362   5.488
  540    HA   THR  72           HA       THR  72  -5.342 -13.230   5.187
  541    HB   THR  72           HB       THR  72  -6.071 -14.583   7.346
  542    HG1  THR  72           1HG      THR  72  -6.881 -13.423   8.897
  543   HG21  THR  72          3HG2      THR  72  -3.993 -14.251   8.010
  544   HG22  THR  72          1HG2      THR  72  -4.280 -12.530   8.277
  545   HG23  THR  72          2HG2      THR  72  -3.841 -13.114   6.668
  546    H    TYR  73           H        TYR  73  -6.406 -15.592   5.807
  547    HA   TYR  73           HA       TYR  73  -8.098 -17.098   5.489
  548    HB2  TYR  73           2HB      TYR  73  -9.579 -14.788   5.909
  549    HB3  TYR  73           1HB      TYR  73 -10.149 -15.371   4.349
  550    HD1  TYR  73           2HD      TYR  73 -10.052 -18.270   4.654
  551    HD2  TYR  73           1HD      TYR  73 -11.224 -15.291   7.456
  552    HE1  TYR  73           2HE      TYR  73 -11.477 -19.915   5.798
  553    HE2  TYR  73           1HE      TYR  73 -12.653 -16.928   8.608
  554    HH   TYR  73           HH       TYR  73 -13.764 -19.016   8.197
  555    H    THR  74           H        THR  74  -6.912 -14.899   3.169
  556    HA   THR  74           HA       THR  74  -6.761 -16.829   1.143
  557    HB   THR  74           HB       THR  74  -8.489 -14.936  -0.138
  558    HG1  THR  74           1HG      THR  74  -9.931 -16.357   1.802
  559   HG21  THR  74          3HG2      THR  74  -8.912 -16.778  -1.276
  560   HG22  THR  74          1HG2      THR  74  -9.812 -17.406   0.105
  561   HG23  THR  74          2HG2      THR  74  -8.091 -17.757  -0.061
  562    H    VAL  75           H        VAL  75  -7.143 -13.376   1.753
  563    HA   VAL  75           HA       VAL  75  -5.360 -12.696  -0.422
  564    HB   VAL  75           HB       VAL  75  -6.275 -10.613   1.489
  565   HG11  VAL  75          1HG1      VAL  75  -4.953 -10.143  -0.560
  566   HG12  VAL  75          2HG1      VAL  75  -6.515  -9.324  -0.534
  567   HG13  VAL  75          3HG1      VAL  75  -6.293 -10.768  -1.521
  568   HG21  VAL  75          3HG2      VAL  75  -8.128 -12.182  -0.291
  569   HG22  VAL  75          1HG2      VAL  75  -8.480 -10.532   0.224
  570   HG23  VAL  75          2HG2      VAL  75  -8.307 -11.812   1.425
  571    H    ARG  76           H        ARG  76  -3.214 -12.335  -0.241
  572    HA   ARG  76           HA       ARG  76  -2.120 -12.026   2.474
  573    HB2  ARG  76           2HB      ARG  76  -1.394 -14.019   1.104
  574    HB3  ARG  76           1HB      ARG  76  -0.600 -12.893   0.012
  575    HG2  ARG  76           2HG      ARG  76   0.905 -13.942   1.694
  576    HG3  ARG  76           1HG      ARG  76   0.902 -12.177   1.719
  577    HD2  ARG  76           2HD      ARG  76  -0.150 -12.070   3.744
  578    HD3  ARG  76           1HD      ARG  76  -0.997 -13.597   3.506
  579    HE   ARG  76           HE       ARG  76   0.809 -14.723   4.394
  580   HH11  ARG  76          1HH1      ARG  76   1.639 -11.368   3.896
  581   HH12  ARG  76          2HH1      ARG  76   3.103 -11.464   4.817
  582   HH21  ARG  76          1HH2      ARG  76   2.736 -14.849   5.601
  583   HH22  ARG  76          2HH2      ARG  76   3.725 -13.439   5.784
  584    H    VAL  77           H        VAL  77  -1.939 -10.738  -0.829
  585    HA   VAL  77           HA       VAL  77  -0.506  -8.403   0.250
  586    HB   VAL  77           HB       VAL  77   0.616  -8.112  -1.810
  587   HG11  VAL  77          1HG1      VAL  77   1.847 -10.021  -2.042
  588   HG12  VAL  77          2HG1      VAL  77   0.436 -11.076  -1.944
  589   HG13  VAL  77          3HG1      VAL  77   1.074 -10.318  -0.484
  590   HG21  VAL  77          3HG2      VAL  77   0.005  -9.152  -3.895
  591   HG22  VAL  77          1HG2      VAL  77  -1.368  -8.266  -3.239
  592   HG23  VAL  77          2HG2      VAL  77  -1.314 -10.024  -3.109
  593    HA   PRO  78           HA       PRO  78  -4.336  -6.081  -0.215
  594    HB2  PRO  78           2HB      PRO  78  -2.227  -3.999  -0.640
  595    HB3  PRO  78           1HB      PRO  78  -3.738  -3.869   0.259
  596    HG2  PRO  78           2HG      PRO  78  -1.623  -4.304   1.667
  597    HG3  PRO  78           1HG      PRO  78  -2.955  -5.458   1.890
  598    HD2  PRO  78           2HD      PRO  78  -0.531  -5.726   0.166
  599    HD3  PRO  78           1HD      PRO  78  -1.142  -6.881   1.377
  600    H    THR  79           H        THR  79  -3.578  -7.274  -2.892
  601    HA   THR  79           HA       THR  79  -4.107  -4.741  -4.292
  602    HB   THR  79           HB       THR  79  -3.139  -5.598  -6.219
  603    HG1  THR  79           1HG      THR  79  -3.865  -8.224  -5.444
  604   HG21  THR  79          3HG2      THR  79  -1.141  -6.280  -5.622
  605   HG22  THR  79          1HG2      THR  79  -1.771  -7.835  -5.086
  606   HG23  THR  79          2HG2      THR  79  -1.732  -6.468  -3.972
  607    H    ILE  80           H        ILE  80  -6.167  -4.334  -4.244
  608    HA   ILE  80           HA       ILE  80  -8.054  -6.377  -5.199
  609    HB   ILE  80           HB       ILE  80  -8.124  -4.951  -2.672
  610   HG12  ILE  80          2HG1      ILE  80 -10.479  -6.477  -2.964
  611   HG13  ILE  80          1HG1      ILE  80  -9.236  -7.317  -3.889
  612   HG21  ILE  80          1HG2      ILE  80 -10.334  -4.268  -4.573
  613   HG22  ILE  80          2HG2      ILE  80  -9.423  -3.213  -3.492
  614   HG23  ILE  80          3HG2      ILE  80 -10.605  -4.340  -2.832
  615   HD11  ILE  80          3HD1      ILE  80  -8.453  -8.176  -2.010
  616   HD12  ILE  80          1HD1      ILE  80  -9.678  -7.301  -1.088
  617   HD13  ILE  80          2HD1      ILE  80  -8.108  -6.556  -1.405
  618    H    PHE  81           H        PHE  81  -8.050  -5.589  -7.382
  619    HA   PHE  81           HA       PHE  81  -9.326  -3.031  -7.749
  620    HB2  PHE  81           2HB      PHE  81  -6.663  -3.202  -9.132
  621    HB3  PHE  81           1HB      PHE  81  -7.624  -1.785  -8.753
  622    HD1  PHE  81           1HD      PHE  81  -7.896  -1.493  -6.020
  623    HD2  PHE  81           2HD      PHE  81  -4.631  -3.329  -8.055
  624    HE1  PHE  81           1HE      PHE  81  -6.467  -1.098  -4.074
  625    HE2  PHE  81           2HE      PHE  81  -3.182  -2.912  -6.086
  626    HZ   PHE  81           HZ       PHE  81  -4.123  -1.821  -4.069
  Start of MODEL    5
    1    H1   GLY   1           1HT      GLY   1   6.579  20.163   1.386
    2    H2   GLY   1           2HT      GLY   1   7.373  18.698   1.673
    3    H3   GLY   1           3HT      GLY   1   7.995  20.134   2.314
    4    HA2  GLY   1           1HA      GLY   1   6.974  19.331   4.165
    5    HA3  GLY   1           2HA      GLY   1   5.674  20.281   3.462
    6    H    SER   2           H        SER   2   5.382  18.288   1.253
    7    HA   SER   2           HA       SER   2   4.488  15.888   2.609
    8    HB2  SER   2           2HB      SER   2   2.165  16.196   1.499
    9    HB3  SER   2           1HB      SER   2   2.501  17.074   2.990
   10    HG   SER   2           HG       SER   2   1.832  18.687   1.778
   11    HA   PRO   3           HA       PRO   3   5.933  15.124  -1.691
   12    HB2  PRO   3           2HB      PRO   3   7.525  13.033  -1.135
   13    HB3  PRO   3           1HB      PRO   3   8.049  14.699  -0.865
   14    HG2  PRO   3           2HG      PRO   3   6.998  12.705   1.106
   15    HG3  PRO   3           1HG      PRO   3   8.366  13.821   1.267
   16    HD2  PRO   3           2HD      PRO   3   5.886  14.304   2.318
   17    HD3  PRO   3           1HD      PRO   3   7.018  15.585   1.843
   18    H    GLY   4           H        GLY   4   3.934  13.560   0.492
   19    HA2  GLY   4           2HA      GLY   4   2.490  11.791   0.356
   20    HA3  GLY   4           1HA      GLY   4   2.441  12.191  -1.355
   21    H    PHE   5           H        PHE   5   2.045   9.623  -1.164
   22    HA   PHE   5           HA       PHE   5   4.645   8.384  -1.705
   23    HB2  PHE   5           2HB      PHE   5   2.585   7.455   0.262
   24    HB3  PHE   5           1HB      PHE   5   3.746   6.337  -0.431
   25    HD1  PHE   5           2HD      PHE   5   6.089   8.315  -0.524
   26    HD2  PHE   5           1HD      PHE   5   3.271   7.327   2.508
   27    HE1  PHE   5           2HE      PHE   5   7.712   8.985   1.194
   28    HE2  PHE   5           1HE      PHE   5   4.890   7.996   4.234
   29    HZ   PHE   5           HZ       PHE   5   7.115   8.825   3.578
   30    H    THR   6           H        THR   6   1.150   8.129  -2.068
   31    HA   THR   6           HA       THR   6  -0.126   7.393  -3.818
   32    HB   THR   6           HB       THR   6   2.246   6.205  -5.199
   33    HG1  THR   6           1HG      THR   6   1.565   8.938  -5.425
   34   HG21  THR   6          3HG2      THR   6   0.897   7.503  -7.096
   35   HG22  THR   6          1HG2      THR   6  -0.424   7.181  -5.974
   36   HG23  THR   6          2HG2      THR   6   0.533   5.845  -6.615
   37    H    CYS   7           H        CYS   7  -1.328   5.763  -2.954
   38    HA   CYS   7           HA       CYS   7  -0.096   3.254  -2.174
   39    HB2  CYS   7           2HB      CYS   7  -1.804   3.817  -0.645
   40    HB3  CYS   7           1HB      CYS   7  -2.929   4.335  -1.890
   41    H    CYS   8           H        CYS   8  -0.738   4.443  -5.096
   42    HA   CYS   8           HA       CYS   8  -1.283   3.537  -7.124
   43    HB2  CYS   8           2HB      CYS   8   0.428   1.925  -6.724
   44    HB3  CYS   8           1HB      CYS   8  -0.532   1.078  -5.526
   45    HG   CYS   8           HG       CYS   8  -1.304   0.960  -8.544
   46    H    VAL   9           H        VAL   9  -3.100   4.156  -5.070
   47    HA   VAL   9           HA       VAL   9  -5.237   2.306  -4.819
   48    HB   VAL   9           HB       VAL   9  -4.951   3.838  -3.054
   49   HG11  VAL   9          1HG1      VAL   9  -5.185   6.404  -3.822
   50   HG12  VAL   9          2HG1      VAL   9  -4.368   5.707  -5.219
   51   HG13  VAL   9          3HG1      VAL   9  -3.657   5.553  -3.612
   52   HG21  VAL   9          3HG2      VAL   9  -7.394   3.771  -4.147
   53   HG22  VAL   9          1HG2      VAL   9  -7.061   5.496  -4.290
   54   HG23  VAL   9          2HG2      VAL   9  -7.002   4.721  -2.701
   55    HA   PRO  10           HA       PRO  10  -6.849   3.586  -8.873
   56    HB2  PRO  10           2HB      PRO  10  -8.115   1.305  -9.453
   57    HB3  PRO  10           1HB      PRO  10  -6.353   1.410  -9.556
   58    HG2  PRO  10           2HG      PRO  10  -8.056   0.246  -7.388
   59    HG3  PRO  10           1HG      PRO  10  -6.562  -0.392  -8.100
   60    HD2  PRO  10           2HD      PRO  10  -6.679   0.993  -5.722
   61    HD3  PRO  10           1HD      PRO  10  -5.242   0.886  -6.748
   62    H    GLY  11           H        GLY  11  -8.400   2.220  -6.071
   63    HA2  GLY  11           2HA      GLY  11 -10.551   4.067  -6.231
   64    HA3  GLY  11           1HA      GLY  11 -11.065   2.452  -6.685
   65    H    CYS  12           H        CYS  12  -8.538   2.495  -4.284
   66    HA   CYS  12           HA       CYS  12 -10.356   1.331  -2.464
   67    HB2  CYS  12           2HB      CYS  12  -8.319   1.854  -0.763
   68    HB3  CYS  12           1HB      CYS  12  -8.418   0.442  -1.783
   69    H    TYR  13           H        TYR  13  -9.091   2.959  -0.091
   70    HA   TYR  13           HA       TYR  13 -11.311   4.818  -0.044
   71    HB2  TYR  13           2HB      TYR  13 -10.626   3.078   1.764
   72    HB3  TYR  13           1HB      TYR  13  -9.528   4.341   2.273
   73    HD1  TYR  13           1HD      TYR  13 -11.755   6.479   1.247
   74    HD2  TYR  13           2HD      TYR  13 -11.663   3.251   4.017
   75    HE1  TYR  13           1HE      TYR  13 -13.587   7.520   2.513
   76    HE2  TYR  13           2HE      TYR  13 -13.497   4.284   5.289
   77    HH   TYR  13           HH       TYR  13 -14.556   6.378   5.624
   78    H    ASN  14           H        ASN  14  -7.924   4.819   0.747
   79    HA   ASN  14           HA       ASN  14  -7.791   7.716   0.362
   80    HB2  ASN  14           2HB      ASN  14  -5.715   6.771   2.032
   81    HB3  ASN  14           1HB      ASN  14  -6.960   7.935   2.409
   82   HD21  ASN  14          1HD2      ASN  14  -9.194   6.714   2.637
   83   HD22  ASN  14          2HD2      ASN  14  -9.162   5.368   3.722
   84    H    ASN  15           H        ASN  15  -5.546   8.564  -0.391
   85    HA   ASN  15           HA       ASN  15  -4.287   6.430  -1.978
   86    HB2  ASN  15           2HB      ASN  15  -5.267   8.348  -3.247
   87    HB3  ASN  15           1HB      ASN  15  -4.188   9.424  -2.378
   88   HD21  ASN  15          1HD2      ASN  15  -4.620   8.139  -5.251
   89   HD22  ASN  15          2HD2      ASN  15  -2.986   7.958  -5.783
   90    H    SER  16           H        SER  16  -1.685   6.728  -2.098
   91    HA   SER  16           HA       SER  16  -0.880   7.388   0.567
   92    HB2  SER  16           2HB      SER  16  -0.244   5.205  -0.769
   93    HB3  SER  16           1HB      SER  16   0.971   6.179  -1.530
   94    HG   SER  16           HG       SER  16   0.675   5.640   1.228
   95    H    HIS  17           H        HIS  17  -1.204   9.308  -2.159
   96    HA   HIS  17           HA       HIS  17   0.706  11.223  -1.132
   97    HB2  HIS  17           2HB      HIS  17   2.253  10.415  -2.642
   98    HB3  HIS  17           1HB      HIS  17   1.064   9.883  -3.795
   99    HD1  HIS  17           1HD      HIS  17   1.571  11.099  -5.889
  100    HD2  HIS  17           2HD      HIS  17   1.854  13.575  -2.562
  101    HE1  HIS  17           1HE      HIS  17   2.075  13.390  -6.796
  102    HE2  HIS  17           2HE      HIS  17   2.349  14.848  -4.759
  103    H    ARG  18           H        ARG  18  -1.912  11.641  -0.828
  104    HA   ARG  18           HA       ARG  18  -2.384  14.014  -2.271
  105    HB2  ARG  18           2HB      ARG  18  -4.218  13.455  -3.674
  106    HB3  ARG  18           1HB      ARG  18  -2.922  12.332  -4.050
  107    HG2  ARG  18           2HG      ARG  18  -4.355  10.688  -3.767
  108    HG3  ARG  18           1HG      ARG  18  -4.438  11.110  -2.055
  109    HD2  ARG  18           2HD      ARG  18  -6.326  12.475  -2.383
  110    HD3  ARG  18           1HD      ARG  18  -6.123  12.476  -4.132
  111    HE   ARG  18           HE       ARG  18  -7.510  10.539  -2.574
  112   HH11  ARG  18          1HH1      ARG  18  -5.565  10.922  -5.445
  113   HH12  ARG  18          2HH1      ARG  18  -6.246   9.543  -6.243
  114   HH21  ARG  18          1HH2      ARG  18  -8.404   8.722  -3.621
  115   HH22  ARG  18          2HH2      ARG  18  -7.856   8.295  -5.207
  116    H    ASP  19           H        ASP  19  -2.752  12.289   0.362
  117    HA   ASP  19           HA       ASP  19  -4.778  14.003   1.447
  118    HB2  ASP  19           2HB      ASP  19  -5.332  11.072   1.741
  119    HB3  ASP  19           1HB      ASP  19  -6.367  12.439   2.114
  120    H    LYS  20           H        LYS  20  -3.544  10.846   2.429
  121    HA   LYS  20           HA       LYS  20  -2.305  10.200   4.206
  122    HB2  LYS  20           2HB      LYS  20  -0.384  11.307   3.886
  123    HB3  LYS  20           1HB      LYS  20  -1.222  12.760   3.384
  124    HG2  LYS  20           2HG      LYS  20   0.009  13.464   5.201
  125    HG3  LYS  20           1HG      LYS  20  -1.570  13.161   5.918
  126    HD2  LYS  20           2HD      LYS  20  -0.582  10.770   6.340
  127    HD3  LYS  20           1HD      LYS  20   0.965  11.599   6.161
  128    HE2  LYS  20           2HE      LYS  20   0.824  12.301   8.261
  129    HE3  LYS  20           1HE      LYS  20  -0.654  13.177   7.865
  130    HZ1  LYS  20           3HZ      LYS  20  -0.641  10.295   8.548
  131    HZ2  LYS  20           1HZ      LYS  20  -1.968  11.343   8.484
  132    HZ3  LYS  20           2HZ      LYS  20  -0.819  11.506   9.714
  133    H    ALA  21           H        ALA  21  -5.010  11.807   4.464
  134    HA   ALA  21           HA       ALA  21  -4.798  12.248   7.371
  135    HB1  ALA  21           1HB      ALA  21  -7.072  13.168   5.644
  136    HB2  ALA  21           2HB      ALA  21  -5.595  14.111   5.845
  137    HB3  ALA  21           3HB      ALA  21  -6.601  13.738   7.246
  138    H    LEU  22           H        LEU  22  -5.373   9.609   5.754
  139    HA   LEU  22           HA       LEU  22  -7.795   8.943   7.275
  140    HB2  LEU  22           2HB      LEU  22  -7.011   7.854   4.547
  141    HB3  LEU  22           1HB      LEU  22  -8.436   7.347   5.474
  142    HG   LEU  22           HG       LEU  22  -9.019   8.887   3.711
  143   HD11  LEU  22          1HD1      LEU  22  -9.540   9.342   6.545
  144   HD12  LEU  22          2HD1      LEU  22 -10.656   9.250   5.183
  145   HD13  LEU  22          3HD1      LEU  22  -9.820  10.763   5.536
  146   HD21  LEU  22          3HD2      LEU  22  -7.850  11.219   5.025
  147   HD22  LEU  22          1HD2      LEU  22  -8.085  10.844   3.322
  148   HD23  LEU  22          2HD2      LEU  22  -6.711  10.157   4.191
  149    H    HIS  23           H        HIS  23  -6.529   5.844   6.176
  150    HA   HIS  23           HA       HIS  23  -5.019   5.709   8.660
  151    HB2  HIS  23           2HB      HIS  23  -7.396   4.425   8.095
  152    HB3  HIS  23           1HB      HIS  23  -6.200   3.193   7.706
  153    HD1  HIS  23           1HD      HIS  23  -5.920   1.687   9.635
  154    HD2  HIS  23           2HD      HIS  23  -6.484   5.624  10.838
  155    HE1  HIS  23           1HE      HIS  23  -5.779   1.650  12.145
  156    HE2  HIS  23           2HE      HIS  23  -6.176   4.035  12.854
  157    H    PHE  24           H        PHE  24  -2.938   4.484   8.502
  158    HA   PHE  24           HA       PHE  24  -2.447   3.404   5.838
  159    HB2  PHE  24           2HB      PHE  24  -0.637   5.166   7.451
  160    HB3  PHE  24           1HB      PHE  24  -0.099   4.246   6.062
  161    HD1  PHE  24           2HD      PHE  24  -2.235   7.014   7.180
  162    HD2  PHE  24           1HD      PHE  24  -0.665   4.955   3.796
  163    HE1  PHE  24           2HE      PHE  24  -2.957   8.849   5.707
  164    HE2  PHE  24           1HE      PHE  24  -1.357   6.788   2.342
  165    HZ   PHE  24           HZ       PHE  24  -2.520   8.727   3.280
  166    H    TYR  25           H        TYR  25  -1.759   1.148   5.936
  167    HA   TYR  25           HA       TYR  25  -0.911   0.108   8.494
  168    HB2  TYR  25           2HB      TYR  25  -1.339  -1.292   5.826
  169    HB3  TYR  25           1HB      TYR  25  -0.883  -2.106   7.311
  170    HD1  TYR  25           1HD      TYR  25  -3.497   0.408   6.357
  171    HD2  TYR  25           2HD      TYR  25  -2.585  -3.270   8.292
  172    HE1  TYR  25           1HE      TYR  25  -5.864   0.147   6.966
  173    HE2  TYR  25           2HE      TYR  25  -4.951  -3.544   8.906
  174    HH   TYR  25           HH       TYR  25  -6.941  -2.118   9.238
  175    H    THR  26           H        THR  26   1.218  -1.171   8.702
  176    HA   THR  26           HA       THR  26   3.264   0.042   6.966
  177    HB   THR  26           HB       THR  26   4.647   0.184   8.777
  178    HG1  THR  26           1HG      THR  26   3.572  -2.239   9.785
  179   HG21  THR  26          3HG2      THR  26   2.506   1.108   9.639
  180   HG22  THR  26          1HG2      THR  26   3.615   0.527  10.882
  181   HG23  THR  26          2HG2      THR  26   2.217  -0.446  10.423
  182    H    PHE  27           H        PHE  27   5.346  -1.510   6.808
  183    HA   PHE  27           HA       PHE  27   4.325  -3.813   5.482
  184    HB2  PHE  27           2HB      PHE  27   6.920  -2.430   5.511
  185    HB3  PHE  27           1HB      PHE  27   6.797  -4.006   4.773
  186    HD1  PHE  27           1HD      PHE  27   3.850  -1.989   4.511
  187    HD2  PHE  27           2HD      PHE  27   7.616  -2.821   2.753
  188    HE1  PHE  27           1HE      PHE  27   3.115  -0.930   2.462
  189    HE2  PHE  27           2HE      PHE  27   6.902  -1.829   0.688
  190    HZ   PHE  27           HZ       PHE  27   4.642  -0.839   0.488
  191    HA   PRO  28           HA       PRO  28   5.475  -7.401   8.009
  192    HB2  PRO  28           2HB      PRO  28   6.837  -7.989   5.350
  193    HB3  PRO  28           1HB      PRO  28   6.036  -9.150   6.407
  194    HG2  PRO  28           2HG      PRO  28   4.728  -8.202   4.387
  195    HG3  PRO  28           1HG      PRO  28   3.921  -8.229   5.957
  196    HD2  PRO  28           2HD      PRO  28   4.998  -5.971   4.399
  197    HD3  PRO  28           1HD      PRO  28   3.640  -6.050   5.517
  198    H    LYS  29           H        LYS  29   7.584  -8.666   8.543
  199    HA   LYS  29           HA       LYS  29   9.745  -6.808   9.000
  200    HB2  LYS  29           2HB      LYS  29  10.783  -8.958  10.007
  201    HB3  LYS  29           1HB      LYS  29   9.433  -8.194  10.837
  202    HG2  LYS  29           2HG      LYS  29   8.503 -10.138   8.922
  203    HG3  LYS  29           1HG      LYS  29   9.671 -10.855  10.026
  204    HD2  LYS  29           2HD      LYS  29   8.333  -9.829  11.911
  205    HD3  LYS  29           1HD      LYS  29   7.097  -9.452  10.710
  206    HE2  LYS  29           2HE      LYS  29   7.503 -12.057  10.165
  207    HE3  LYS  29           1HE      LYS  29   7.878 -12.045  11.887
  208    HZ1  LYS  29           3HZ      LYS  29   5.662 -10.733  12.037
  209    HZ2  LYS  29           1HZ      LYS  29   5.628 -12.418  11.889
  210    HZ3  LYS  29           2HZ      LYS  29   5.336 -11.445  10.538
  211    H    ASP  30           H        ASP  30   9.043  -9.407   6.861
  212    HA   ASP  30           HA       ASP  30  11.759  -9.870   6.017
  213    HB2  ASP  30           2HB      ASP  30   9.837 -10.855   4.119
  214    HB3  ASP  30           1HB      ASP  30  10.854 -11.790   5.200
  215    H    ALA  31           H        ALA  31  12.844  -8.437   4.752
  216    HA   ALA  31           HA       ALA  31  11.895  -6.240   3.538
  217    HB1  ALA  31           1HB      ALA  31  13.962  -6.628   1.927
  218    HB2  ALA  31           2HB      ALA  31  14.307  -7.906   3.097
  219    HB3  ALA  31           3HB      ALA  31  14.140  -6.241   3.632
  220    H    GLU  32           H        GLU  32  12.553  -9.176   1.431
  221    HA   GLU  32           HA       GLU  32  11.334  -8.117  -0.847
  222    HB2  GLU  32           2HB      GLU  32  12.623 -10.084  -1.047
  223    HB3  GLU  32           1HB      GLU  32  11.676 -11.004   0.048
  224    HG2  GLU  32           2HG      GLU  32  10.432  -9.950  -2.452
  225    HG3  GLU  32           1HG      GLU  32  11.480 -11.367  -2.521
  226    H    LEU  33           H        LEU  33   9.513 -10.419   1.375
  227    HA   LEU  33           HA       LEU  33   7.165 -10.248   0.078
  228    HB2  LEU  33           2HB      LEU  33   7.686 -11.191   2.439
  229    HB3  LEU  33           1HB      LEU  33   7.256  -9.610   3.021
  230    HG   LEU  33           HG       LEU  33   5.128 -10.162   3.042
  231   HD11  LEU  33          1HD1      LEU  33   3.878 -10.826   1.029
  232   HD12  LEU  33          2HD1      LEU  33   5.404 -10.973   0.158
  233   HD13  LEU  33          3HD1      LEU  33   4.881  -9.404   0.767
  234   HD21  LEU  33          3HD2      LEU  33   5.599 -12.298   3.702
  235   HD22  LEU  33          1HD2      LEU  33   6.283 -12.733   2.138
  236   HD23  LEU  33          2HD2      LEU  33   4.539 -12.558   2.321
  237    H    ARG  34           H        ARG  34   8.725  -7.762   1.883
  238    HA   ARG  34           HA       ARG  34   6.726  -5.810   1.953
  239    HB2  ARG  34           2HB      ARG  34   8.263  -4.512   2.970
  240    HB3  ARG  34           1HB      ARG  34   9.300  -5.914   2.903
  241    HG2  ARG  34           2HG      ARG  34  10.567  -4.054   2.180
  242    HG3  ARG  34           1HG      ARG  34  10.209  -4.988   0.738
  243    HD2  ARG  34           2HD      ARG  34   9.459  -3.110  -0.170
  244    HD3  ARG  34           1HD      ARG  34   8.096  -3.221   0.934
  245    HE   ARG  34           HE       ARG  34   9.003  -1.523   2.198
  246   HH11  ARG  34          1HH1      ARG  34  11.344  -2.623  -0.146
  247   HH12  ARG  34          2HH1      ARG  34  12.427  -1.301   0.132
  248   HH21  ARG  34          1HH2      ARG  34  10.431   0.214   2.566
  249   HH22  ARG  34          2HH2      ARG  34  11.911   0.308   1.672
  250    H    ARG  35           H        ARG  35   9.437  -6.063  -0.303
  251    HA   ARG  35           HA       ARG  35   8.529  -4.048  -1.966
  252    HB2  ARG  35           2HB      ARG  35   9.974  -4.909  -3.708
  253    HB3  ARG  35           1HB      ARG  35  10.804  -4.912  -2.167
  254    HG2  ARG  35           2HG      ARG  35  11.447  -6.887  -3.190
  255    HG3  ARG  35           1HG      ARG  35  10.219  -7.388  -2.047
  256    HD2  ARG  35           2HD      ARG  35   9.471  -8.528  -3.870
  257    HD3  ARG  35           1HD      ARG  35   8.657  -6.999  -4.179
  258    HE   ARG  35           HE       ARG  35  10.038  -6.643  -5.972
  259   HH11  ARG  35          1HH1      ARG  35  11.291  -9.287  -4.070
  260   HH12  ARG  35          2HH1      ARG  35  12.463  -9.749  -5.256
  261   HH21  ARG  35          1HH2      ARG  35  11.580  -7.249  -7.533
  262   HH22  ARG  35          2HH2      ARG  35  12.629  -8.592  -7.221
  263    H    LEU  36           H        LEU  36   7.602  -7.444  -1.668
  264    HA   LEU  36           HA       LEU  36   6.218  -7.599  -4.149
  265    HB2  LEU  36           2HB      LEU  36   5.533  -8.902  -1.516
  266    HB3  LEU  36           1HB      LEU  36   4.608  -9.161  -2.971
  267    HG   LEU  36           HG       LEU  36   7.546  -9.782  -2.694
  268   HD11  LEU  36          1HD1      LEU  36   6.774 -11.470  -1.422
  269   HD12  LEU  36          2HD1      LEU  36   6.326 -12.170  -2.977
  270   HD13  LEU  36          3HD1      LEU  36   5.122 -11.307  -2.019
  271   HD21  LEU  36          3HD2      LEU  36   6.025 -11.136  -4.765
  272   HD22  LEU  36          1HD2      LEU  36   7.554 -10.266  -4.871
  273   HD23  LEU  36          2HD2      LEU  36   6.031  -9.385  -4.972
  274    H    TRP  37           H        TRP  37   5.088  -6.320  -1.050
  275    HA   TRP  37           HA       TRP  37   2.524  -5.615  -1.924
  276    HB2  TRP  37           2HB      TRP  37   4.401  -4.577   0.216
  277    HB3  TRP  37           1HB      TRP  37   2.854  -3.788  -0.061
  278    HD1  TRP  37           HD       TRP  37   3.201  -7.558  -0.421
  279    HE1  TRP  37           1HE      TRP  37   1.887  -8.678   1.527
  280    HE3  TRP  37           3HE      TRP  37   2.073  -3.393   2.254
  281    HZ2  TRP  37           2HZ      TRP  37   0.544  -7.836   3.905
  282    HZ3  TRP  37           3HZ      TRP  37   0.816  -3.609   4.350
  283    HH2  TRP  37           HH       TRP  37   0.073  -5.759   5.153
  284    H    LEU  38           H        LEU  38   5.658  -3.792  -1.981
  285    HA   LEU  38           HA       LEU  38   4.924  -1.337  -2.829
  286    HB2  LEU  38           2HB      LEU  38   7.172  -3.049  -3.942
  287    HB3  LEU  38           1HB      LEU  38   6.993  -1.345  -4.206
  288    HG   LEU  38           HG       LEU  38   7.614  -2.752  -1.654
  289   HD11  LEU  38          1HD1      LEU  38   8.973  -0.924  -3.505
  290   HD12  LEU  38          2HD1      LEU  38   9.633  -2.165  -2.439
  291   HD13  LEU  38          3HD1      LEU  38   9.196  -0.585  -1.790
  292   HD21  LEU  38          3HD2      LEU  38   5.896  -1.288  -0.964
  293   HD22  LEU  38          1HD2      LEU  38   6.473   0.004  -2.016
  294   HD23  LEU  38          2HD2      LEU  38   7.409  -0.460  -0.596
  295    H    LYS  39           H        LYS  39   5.247  -4.338  -4.935
  296    HA   LYS  39           HA       LYS  39   4.676  -3.256  -7.332
  297    HB2  LYS  39           2HB      LYS  39   4.343  -5.884  -6.059
  298    HB3  LYS  39           1HB      LYS  39   3.394  -5.646  -7.512
  299    HG2  LYS  39           2HG      LYS  39   5.656  -6.702  -7.781
  300    HG3  LYS  39           1HG      LYS  39   5.320  -5.315  -8.825
  301    HD2  LYS  39           2HD      LYS  39   6.484  -3.956  -6.933
  302    HD3  LYS  39           1HD      LYS  39   7.136  -5.521  -6.451
  303    HE2  LYS  39           2HE      LYS  39   8.246  -5.802  -8.517
  304    HE3  LYS  39           1HE      LYS  39   7.351  -4.480  -9.262
  305    HZ1  LYS  39           3HZ      LYS  39   9.692  -4.398  -7.547
  306    HZ2  LYS  39           1HZ      LYS  39   8.533  -3.201  -7.256
  307    HZ3  LYS  39           2HZ      LYS  39   9.223  -3.353  -8.792
  308    H    ASN  40           H        ASN  40   2.033  -4.751  -5.409
  309    HA   ASN  40           HA       ASN  40   0.076  -3.542  -7.117
  310    HB2  ASN  40           2HB      ASN  40   0.128  -5.446  -5.016
  311    HB3  ASN  40           1HB      ASN  40  -1.101  -4.255  -4.628
  312   HD21  ASN  40          1HD2      ASN  40  -0.536  -7.081  -6.096
  313   HD22  ASN  40          2HD2      ASN  40  -1.833  -7.125  -7.222
  314    H    VAL  41           H        VAL  41   1.647  -2.519  -4.302
  315    HA   VAL  41           HA       VAL  41  -0.255  -0.577  -3.623
  316    HB   VAL  41           HB       VAL  41   2.303  -1.415  -2.288
  317   HG11  VAL  41          1HG1      VAL  41   1.840   0.215  -0.562
  318   HG12  VAL  41          2HG1      VAL  41   0.449   0.824  -1.458
  319   HG13  VAL  41          3HG1      VAL  41   2.079   1.055  -2.099
  320   HG21  VAL  41          3HG2      VAL  41   0.641  -2.077  -0.607
  321   HG22  VAL  41          1HG2      VAL  41   0.351  -2.838  -2.161
  322   HG23  VAL  41          2HG2      VAL  41  -0.639  -1.474  -1.650
  323    H    SER  42           H        SER  42   2.449  -0.460  -5.828
  324    HA   SER  42           HA       SER  42   2.040   1.962  -6.834
  325    HB2  SER  42           2HB      SER  42   2.295   3.773  -5.446
  326    HB3  SER  42           1HB      SER  42   2.241   2.637  -4.094
  327    HG   SER  42           HG       SER  42   4.310   2.863  -3.807
  328    H    ARG  43           H        ARG  43   5.277   1.724  -5.027
  329    HA   ARG  43           HA       ARG  43   7.339   1.573  -5.942
  330    HB2  ARG  43           2HB      ARG  43   7.794  -0.416  -7.171
  331    HB3  ARG  43           1HB      ARG  43   6.512  -0.798  -6.035
  332    HG2  ARG  43           2HG      ARG  43   4.984  -1.167  -7.667
  333    HG3  ARG  43           1HG      ARG  43   5.686   0.027  -8.755
  334    HD2  ARG  43           2HD      ARG  43   7.673  -1.839  -8.605
  335    HD3  ARG  43           1HD      ARG  43   6.223  -2.836  -8.504
  336    HE   ARG  43           HE       ARG  43   7.179  -1.408 -10.797
  337   HH11  ARG  43          1HH1      ARG  43   4.343  -2.716  -9.241
  338   HH12  ARG  43          2HH1      ARG  43   3.446  -2.856 -10.716
  339   HH21  ARG  43          1HH2      ARG  43   6.001  -1.590 -12.738
  340   HH22  ARG  43          2HH2      ARG  43   4.386  -2.216 -12.701
  341    H    ALA  44           H        ALA  44   5.998   3.671  -6.970
  342    HA   ALA  44           HA       ALA  44   5.401   4.598  -9.205
  343    HB1  ALA  44           1HB      ALA  44   7.038   5.656  -7.407
  344    HB2  ALA  44           2HB      ALA  44   6.717   6.434  -8.957
  345    HB3  ALA  44           3HB      ALA  44   8.192   5.490  -8.732
  346    H    GLY  45           H        GLY  45   5.589   2.442 -10.697
  347    HA2  GLY  45           2HA      GLY  45   8.113   2.662 -12.218
  348    HA3  GLY  45           1HA      GLY  45   7.186   1.179 -12.050
  349    H    VAL  46           H        VAL  46   5.765   4.329 -12.613
  350    HA   VAL  46           HA       VAL  46   5.533   4.058 -15.437
  351    HB   VAL  46           HB       VAL  46   3.925   2.325 -14.817
  352   HG11  VAL  46          1HG1      VAL  46   1.968   2.736 -13.526
  353   HG12  VAL  46          2HG1      VAL  46   2.321   4.459 -13.424
  354   HG13  VAL  46          3HG1      VAL  46   3.349   3.296 -12.585
  355   HG21  VAL  46          3HG2      VAL  46   1.821   3.865 -15.723
  356   HG22  VAL  46          1HG2      VAL  46   3.002   3.020 -16.723
  357   HG23  VAL  46          2HG2      VAL  46   3.244   4.718 -16.319
  358    H    SER  47           H        SER  47   6.497   6.175 -14.087
  359    HA   SER  47           HA       SER  47   4.633   8.267 -14.829
  360    HB2  SER  47           2HB      SER  47   4.192   9.192 -12.725
  361    HB3  SER  47           1HB      SER  47   4.086   7.465 -12.385
  362    HG   SER  47           HG       SER  47   5.663   9.250 -11.241
  363    H    GLY  48           H        GLY  48   7.659   7.775 -12.660
  364    HA2  GLY  48           2HA      GLY  48   9.776   8.593 -13.113
  365    HA3  GLY  48           1HA      GLY  48   9.168   9.324 -14.589
  366    H    CYS  49           H        CYS  49  10.629  10.099 -11.856
  367    HA   CYS  49           HA       CYS  49  10.023  12.847 -12.019
  368    HB2  CYS  49           2HB      CYS  49   8.057  11.540 -10.653
  369    HB3  CYS  49           1HB      CYS  49   9.147  11.978  -9.341
  370    HG   CYS  49           HG       CYS  49   8.090  14.175  -9.417
  371    H    PHE  50           H        PHE  50  10.707  13.784  -9.567
  372    HA   PHE  50           HA       PHE  50  13.494  13.475  -9.517
  373    HB2  PHE  50           2HB      PHE  50  11.462  14.695  -7.673
  374    HB3  PHE  50           1HB      PHE  50  13.105  14.473  -7.080
  375    HD1  PHE  50           2HD      PHE  50  14.926  15.205  -8.976
  376    HD2  PHE  50           1HD      PHE  50  11.000  16.774  -8.492
  377    HE1  PHE  50           2HE      PHE  50  15.616  17.276 -10.112
  378    HE2  PHE  50           1HE      PHE  50  11.683  18.847  -9.627
  379    HZ   PHE  50           HZ       PHE  50  13.994  19.100 -10.439
  380    H    SER  51           H        SER  51  11.102  12.290  -6.972
  381    HA   SER  51           HA       SER  51  13.083  10.182  -6.386
  382    HB2  SER  51           2HB      SER  51  12.577  10.311  -4.097
  383    HB3  SER  51           1HB      SER  51  12.614  11.998  -4.609
  384    HG   SER  51           HG       SER  51  10.582  12.158  -4.117
  385    H    THR  52           H        THR  52   9.921  10.830  -7.466
  386    HA   THR  52           HA       THR  52   8.100   9.529  -7.886
  387    HB   THR  52           HB       THR  52   9.219   6.909  -7.859
  388    HG1  THR  52           1HG      THR  52  10.911   8.832  -9.074
  389   HG21  THR  52          3HG2      THR  52   8.680   6.842 -10.080
  390   HG22  THR  52          1HG2      THR  52   9.114   8.532 -10.349
  391   HG23  THR  52          2HG2      THR  52   7.614   8.129  -9.514
  392    H    PHE  53           H        PHE  53   8.626  10.140  -5.190
  393    HA   PHE  53           HA       PHE  53   8.106   9.616  -3.057
  394    HB2  PHE  53           2HB      PHE  53   6.016   8.443  -2.697
  395    HB3  PHE  53           1HB      PHE  53   5.833   9.563  -4.036
  396    HD1  PHE  53           2HD      PHE  53   6.887   5.991  -3.576
  397    HD2  PHE  53           1HD      PHE  53   4.539   8.798  -5.743
  398    HE1  PHE  53           2HE      PHE  53   5.969   4.170  -4.911
  399    HE2  PHE  53           1HE      PHE  53   3.597   6.962  -7.086
  400    HZ   PHE  53           HZ       PHE  53   4.302   4.637  -6.654
  401    H    GLN  54           H        GLN  54  10.004   7.736  -4.579
  402    HA   GLN  54           HA       GLN  54  10.314   5.253  -4.282
  403    HB2  GLN  54           2HB      GLN  54  12.147   7.080  -4.144
  404    HB3  GLN  54           1HB      GLN  54  12.119   6.757  -2.419
  405    HG2  GLN  54           2HG      GLN  54  13.850   5.569  -3.875
  406    HG3  GLN  54           1HG      GLN  54  12.992   4.625  -2.671
  407   HE21  GLN  54          1HE2      GLN  54  11.812   5.717  -5.809
  408   HE22  GLN  54          2HE2      GLN  54  11.625   4.142  -6.495
  409    HA   PRO  55           HA       PRO  55   8.443   3.750  -0.510
  410    HB2  PRO  55           2HB      PRO  55   9.652   1.151  -1.044
  411    HB3  PRO  55           1HB      PRO  55   7.954   1.623  -1.087
  412    HG2  PRO  55           2HG      PRO  55   9.383   1.010  -3.325
  413    HG3  PRO  55           1HG      PRO  55   7.993   2.105  -3.319
  414    HD2  PRO  55           2HD      PRO  55  10.908   2.739  -3.387
  415    HD3  PRO  55           1HD      PRO  55   9.561   3.549  -4.215
  416    H    THR  56           H        THR  56  11.806   3.657  -1.276
  417    HA   THR  56           HA       THR  56  12.982   2.380   0.874
  418    HB   THR  56           HB       THR  56  14.222   3.419  -1.008
  419    HG1  THR  56           1HG      THR  56  15.171   3.006   1.151
  420   HG21  THR  56          3HG2      THR  56  14.041   6.065   0.376
  421   HG22  THR  56          1HG2      THR  56  12.922   5.618  -0.914
  422   HG23  THR  56          2HG2      THR  56  14.655   5.689  -1.234
  423    H    THR  57           H        THR  57  11.703   5.806   0.724
  424    HA   THR  57           HA       THR  57  12.443   6.580   3.291
  425    HB   THR  57           HB       THR  57  11.546   8.115   1.592
  426    HG1  THR  57           1HG      THR  57   9.873   8.102   3.875
  427   HG21  THR  57          3HG2      THR  57   9.442   8.116   0.759
  428   HG22  THR  57          1HG2      THR  57   8.748   7.385   2.206
  429   HG23  THR  57          2HG2      THR  57   9.615   6.385   1.043
  430    H    GLY  58           H        GLY  58   9.905   4.443   2.218
  431    HA2  GLY  58           2HA      GLY  58   9.276   2.860   4.104
  432    HA3  GLY  58           1HA      GLY  58   8.912   4.322   4.989
  433    H    HIS  59           H        HIS  59   7.825   2.516   2.000
  434    HA   HIS  59           HA       HIS  59   5.424   4.110   1.981
  435    HB2  HIS  59           2HB      HIS  59   6.670   2.199   0.171
  436    HB3  HIS  59           1HB      HIS  59   4.944   1.936   0.319
  437    HD1  HIS  59           1HD      HIS  59   6.848   5.197   0.162
  438    HD2  HIS  59           2HD      HIS  59   3.886   3.091  -1.901
  439    HE1  HIS  59           1HE      HIS  59   6.057   6.741  -1.653
  440    HE2  HIS  59           2HE      HIS  59   4.319   5.427  -2.919
  441    H    ARG  60           H        ARG  60   3.546   3.650   2.728
  442    HA   ARG  60           HA       ARG  60   3.130   1.255   4.410
  443    HB2  ARG  60           2HB      ARG  60   1.863   2.682   5.862
  444    HB3  ARG  60           1HB      ARG  60   3.323   3.553   5.449
  445    HG2  ARG  60           2HG      ARG  60   1.851   4.556   3.540
  446    HG3  ARG  60           1HG      ARG  60   0.538   4.100   4.620
  447    HD2  ARG  60           2HD      ARG  60   2.819   5.989   5.141
  448    HD3  ARG  60           1HD      ARG  60   1.092   6.339   5.161
  449    HE   ARG  60           HE       ARG  60   1.889   4.399   7.123
  450   HH11  ARG  60          1HH1      ARG  60   1.573   7.806   6.444
  451   HH12  ARG  60          2HH1      ARG  60   1.448   8.256   8.111
  452   HH21  ARG  60          1HH2      ARG  60   1.727   4.987   9.320
  453   HH22  ARG  60          2HH2      ARG  60   1.536   6.656   9.744
  454    H    LEU  61           H        LEU  61   0.537   0.853   4.611
  455    HA   LEU  61           HA       LEU  61  -0.488   0.816   1.854
  456    HB2  LEU  61           2HB      LEU  61  -0.146  -1.176   3.800
  457    HB3  LEU  61           1HB      LEU  61  -1.869  -0.896   3.776
  458    HG   LEU  61           HG       LEU  61  -0.276  -2.452   1.983
  459   HD11  LEU  61          1HD1      LEU  61  -2.533  -3.191   1.280
  460   HD12  LEU  61          2HD1      LEU  61  -3.204  -1.954   2.354
  461   HD13  LEU  61          3HD1      LEU  61  -2.248  -3.262   3.009
  462   HD21  LEU  61          3HD2      LEU  61  -1.800  -0.184   0.785
  463   HD22  LEU  61          1HD2      LEU  61  -1.490  -1.691  -0.071
  464   HD23  LEU  61          2HD2      LEU  61  -0.143  -0.690   0.466
  465    H    CYS  62           H        CYS  62  -3.038   1.103   1.614
  466    HA   CYS  62           HA       CYS  62  -4.020   2.645   3.866
  467    HB2  CYS  62           2HB      CYS  62  -4.523   4.405   2.612
  468    HB3  CYS  62           1HB      CYS  62  -3.353   3.695   1.535
  469    H    SER  63           H        SER  63  -6.595   2.993   3.588
  470    HA   SER  63           HA       SER  63  -7.651   1.036   4.907
  471    HB2  SER  63           2HB      SER  63  -8.549   3.456   3.625
  472    HB3  SER  63           1HB      SER  63  -9.858   2.289   3.735
  473    HG   SER  63           HG       SER  63  -8.185   3.079   5.890
  474    H    VAL  64           H        VAL  64  -9.836   1.575   2.619
  475    HA   VAL  64           HA       VAL  64 -11.119  -0.789   2.706
  476    HB   VAL  64           HB       VAL  64 -12.413  -0.141   0.747
  477   HG11  VAL  64          1HG1      VAL  64 -12.548   2.418   1.763
  478   HG12  VAL  64          2HG1      VAL  64 -11.874   1.488   3.103
  479   HG13  VAL  64          3HG1      VAL  64 -13.413   1.012   2.384
  480   HG21  VAL  64          3HG2      VAL  64  -9.985   1.320   0.196
  481   HG22  VAL  64          1HG2      VAL  64 -11.409   2.369   0.159
  482   HG23  VAL  64          2HG2      VAL  64 -11.345   0.935  -0.867
  483    H    HIS  65           H        HIS  65  -8.331  -1.441   1.638
  484    HA   HIS  65           HA       HIS  65  -9.184  -2.871  -0.793
  485    HB2  HIS  65           2HB      HIS  65  -6.446  -3.420  -0.084
  486    HB3  HIS  65           1HB      HIS  65  -7.141  -2.708  -1.525
  487    HD1  HIS  65           1HD      HIS  65  -8.294  -0.188   0.096
  488    HD2  HIS  65           2HD      HIS  65  -4.416  -1.541  -0.199
  489    HE1  HIS  65           1HE      HIS  65  -6.870   1.743   0.716
  490    H    PHE  66           H        PHE  66  -7.525  -3.815   2.288
  491    HA   PHE  66           HA       PHE  66  -7.404  -6.459   2.091
  492    HB2  PHE  66           2HB      PHE  66  -8.216  -4.677   4.380
  493    HB3  PHE  66           1HB      PHE  66  -8.098  -6.410   4.623
  494    HD1  PHE  66           1HD      PHE  66  -5.857  -7.497   3.906
  495    HD2  PHE  66           2HD      PHE  66  -6.371  -3.342   4.724
  496    HE1  PHE  66           1HE      PHE  66  -3.453  -7.294   4.362
  497    HE2  PHE  66           2HE      PHE  66  -3.958  -3.141   5.181
  498    HZ   PHE  66           HZ       PHE  66  -2.507  -5.123   5.006
  499    H    GLN  67           H        GLN  67  -9.005  -8.250   3.057
  500    HA   GLN  67           HA       GLN  67 -11.704  -7.675   2.128
  501    HB2  GLN  67           2HB      GLN  67 -10.131  -9.837   1.762
  502    HB3  GLN  67           1HB      GLN  67 -11.000 -10.343   3.204
  503    HG2  GLN  67           2HG      GLN  67 -12.559 -11.077   1.800
  504    HG3  GLN  67           1HG      GLN  67 -13.012  -9.383   1.622
  505   HE21  GLN  67          1HE2      GLN  67 -13.682 -10.889  -0.408
  506   HE22  GLN  67          2HE2      GLN  67 -12.631 -10.673  -1.761
  507    H    GLY  68           H        GLY  68 -12.969  -6.654   4.105
  508    HA2  GLY  68           2HA      GLY  68 -13.837  -6.726   6.218
  509    HA3  GLY  68           1HA      GLY  68 -13.211  -8.358   6.389
  510    H    GLY  69           H        GLY  69 -10.671  -8.441   6.755
  511    HA2  GLY  69           2HA      GLY  69  -8.842  -6.794   7.420
  512    HA3  GLY  69           1HA      GLY  69 -10.012  -6.228   8.599
  513    H    ARG  70           H        ARG  70  -7.261  -7.673   8.636
  514    HA   ARG  70           HA       ARG  70  -6.767  -8.651  10.887
  515    HB2  ARG  70           2HB      ARG  70  -8.882  -9.667  11.356
  516    HB3  ARG  70           1HB      ARG  70  -8.827 -10.619   9.881
  517    HG2  ARG  70           2HG      ARG  70  -8.391 -11.892  11.984
  518    HG3  ARG  70           1HG      ARG  70  -7.130 -12.037  10.762
  519    HD2  ARG  70           2HD      ARG  70  -5.610 -11.260  12.182
  520    HD3  ARG  70           1HD      ARG  70  -6.562  -9.803  12.452
  521    HE   ARG  70           HE       ARG  70  -7.501 -12.092  13.917
  522   HH11  ARG  70          1HH1      ARG  70  -5.292  -9.388  13.937
  523   HH12  ARG  70          2HH1      ARG  70  -5.175  -9.337  15.663
  524   HH21  ARG  70          1HH2      ARG  70  -7.345 -12.026  16.187
  525   HH22  ARG  70          2HH2      ARG  70  -6.339 -10.834  16.940
  526    H    LYS  71           H        LYS  71  -6.962  -9.666   7.585
  527    HA   LYS  71           HA       LYS  71  -5.500 -10.761   6.224
  528    HB2  LYS  71           2HB      LYS  71  -4.019  -9.034   7.469
  529    HB3  LYS  71           1HB      LYS  71  -3.381 -10.430   8.324
  530    HG2  LYS  71           2HG      LYS  71  -2.296 -11.237   6.484
  531    HG3  LYS  71           1HG      LYS  71  -3.453 -10.535   5.357
  532    HD2  LYS  71           2HD      LYS  71  -0.990  -9.567   5.663
  533    HD3  LYS  71           1HD      LYS  71  -2.364  -8.541   5.264
  534    HE2  LYS  71           2HE      LYS  71  -2.621  -7.917   7.595
  535    HE3  LYS  71           1HE      LYS  71  -1.328  -9.025   8.057
  536    HZ1  LYS  71           3HZ      LYS  71  -0.065  -7.197   7.887
  537    HZ2  LYS  71           1HZ      LYS  71  -1.168  -6.379   6.897
  538    HZ3  LYS  71           2HZ      LYS  71  -0.102  -7.508   6.224
  539    H    THR  72           H        THR  72  -6.773 -12.691   6.723
  540    HA   THR  72           HA       THR  72  -6.019 -14.552   8.701
  541    HB   THR  72           HB       THR  72  -7.167 -16.078   6.716
  542    HG1  THR  72           1HG      THR  72  -8.103 -14.815   5.353
  543   HG21  THR  72          3HG2      THR  72  -8.007 -14.881   9.176
  544   HG22  THR  72          1HG2      THR  72  -8.542 -16.378   8.414
  545   HG23  THR  72          2HG2      THR  72  -9.321 -14.851   7.998
  546    H    TYR  73           H        TYR  73  -5.639 -16.967   7.598
  547    HA   TYR  73           HA       TYR  73  -2.907 -16.773   6.623
  548    HB2  TYR  73           2HB      TYR  73  -4.060 -18.444   8.421
  549    HB3  TYR  73           1HB      TYR  73  -4.132 -19.440   6.970
  550    HD1  TYR  73           1HD      TYR  73  -1.759 -19.142   5.552
  551    HD2  TYR  73           2HD      TYR  73  -2.268 -18.938   9.772
  552    HE1  TYR  73           1HE      TYR  73   0.600 -19.764   5.861
  553    HE2  TYR  73           2HE      TYR  73   0.089 -19.558  10.092
  554    HH   TYR  73           HH       TYR  73   1.860 -20.954   8.477
  555    H    THR  74           H        THR  74  -4.529 -15.846   4.687
  556    HA   THR  74           HA       THR  74  -4.135 -17.784   2.574
  557    HB   THR  74           HB       THR  74  -6.713 -16.758   2.043
  558    HG1  THR  74           1HG      THR  74  -7.807 -16.933   3.832
  559   HG21  THR  74          3HG2      THR  74  -6.373 -18.850   1.194
  560   HG22  THR  74          1HG2      THR  74  -7.346 -19.227   2.616
  561   HG23  THR  74          2HG2      THR  74  -5.595 -19.442   2.662
  562    H    VAL  75           H        VAL  75  -5.285 -14.591   3.537
  563    HA   VAL  75           HA       VAL  75  -4.875 -13.424   0.932
  564    HB   VAL  75           HB       VAL  75  -6.642 -12.692   2.534
  565   HG11  VAL  75          1HG1      VAL  75  -4.914 -11.073   4.212
  566   HG12  VAL  75          2HG1      VAL  75  -4.654 -12.806   4.410
  567   HG13  VAL  75          3HG1      VAL  75  -6.263 -12.124   4.640
  568   HG21  VAL  75          3HG2      VAL  75  -6.451 -10.301   2.286
  569   HG22  VAL  75          1HG2      VAL  75  -5.884 -11.077   0.812
  570   HG23  VAL  75          2HG2      VAL  75  -4.725 -10.418   1.974
  571    H    ARG  76           H        ARG  76  -2.603 -13.698   0.429
  572    HA   ARG  76           HA       ARG  76  -0.648 -12.880   2.385
  573    HB2  ARG  76           2HB      ARG  76  -0.465 -14.767   0.602
  574    HB3  ARG  76           1HB      ARG  76   0.008 -13.471  -0.485
  575    HG2  ARG  76           2HG      ARG  76   1.735 -12.883   1.348
  576    HG3  ARG  76           1HG      ARG  76   1.422 -14.523   1.925
  577    HD2  ARG  76           2HD      ARG  76   2.415 -15.492   0.126
  578    HD3  ARG  76           1HD      ARG  76   1.930 -14.202  -0.972
  579    HE   ARG  76           HE       ARG  76   3.759 -12.970   0.546
  580   HH11  ARG  76          1HH1      ARG  76   3.827 -16.045  -1.106
  581   HH12  ARG  76          2HH1      ARG  76   5.537 -16.007  -1.369
  582   HH21  ARG  76          1HH2      ARG  76   6.009 -12.920   0.196
  583   HH22  ARG  76          2HH2      ARG  76   6.776 -14.234  -0.629
  584    H    VAL  77           H        VAL  77  -1.805 -11.571  -0.743
  585    HA   VAL  77           HA       VAL  77  -0.512  -9.049   0.031
  586    HB   VAL  77           HB       VAL  77   0.698  -8.938  -1.864
  587   HG11  VAL  77          1HG1      VAL  77   0.713 -11.446  -1.397
  588   HG12  VAL  77          2HG1      VAL  77   1.257 -10.894  -2.981
  589   HG13  VAL  77          3HG1      VAL  77  -0.358 -11.580  -2.793
  590   HG21  VAL  77          3HG2      VAL  77  -1.798  -9.664  -3.396
  591   HG22  VAL  77          1HG2      VAL  77  -0.282  -9.117  -4.111
  592   HG23  VAL  77          2HG2      VAL  77  -1.200  -8.039  -3.062
  593    HA   PRO  78           HA       PRO  78  -4.742  -7.452  -0.148
  594    HB2  PRO  78           2HB      PRO  78  -3.172  -4.959  -0.609
  595    HB3  PRO  78           1HB      PRO  78  -4.529  -5.228   0.482
  596    HG2  PRO  78           2HG      PRO  78  -2.127  -5.141   1.503
  597    HG3  PRO  78           1HG      PRO  78  -3.172  -6.503   1.974
  598    HD2  PRO  78           2HD      PRO  78  -0.971  -6.431  -0.075
  599    HD3  PRO  78           1HD      PRO  78  -1.269  -7.633   1.212
  600    H    THR  79           H        THR  79  -4.686  -8.585  -2.593
  601    HA   THR  79           HA       THR  79  -4.788  -6.148  -4.228
  602    HB   THR  79           HB       THR  79  -4.513  -9.034  -5.019
  603    HG1  THR  79           1HG      THR  79  -2.520  -8.493  -5.235
  604   HG21  THR  79          3HG2      THR  79  -4.509  -8.356  -7.347
  605   HG22  THR  79          1HG2      THR  79  -4.908  -6.701  -6.879
  606   HG23  THR  79          2HG2      THR  79  -6.062  -8.003  -6.595
  607    H    ILE  80           H        ILE  80  -6.645  -5.353  -4.017
  608    HA   ILE  80           HA       ILE  80  -9.016  -6.868  -4.833
  609    HB   ILE  80           HB       ILE  80  -8.865  -4.881  -2.565
  610   HG12  ILE  80          2HG1      ILE  80  -8.387  -7.158  -1.913
  611   HG13  ILE  80          1HG1      ILE  80  -9.996  -6.738  -1.334
  612   HG21  ILE  80          1HG2      ILE  80 -11.144  -5.599  -4.308
  613   HG22  ILE  80          2HG2      ILE  80 -10.832  -4.122  -3.397
  614   HG23  ILE  80          3HG2      ILE  80 -11.458  -5.550  -2.574
  615   HD11  ILE  80          3HD1      ILE  80 -10.699  -8.614  -2.278
  616   HD12  ILE  80          1HD1      ILE  80  -9.168  -8.840  -3.123
  617   HD13  ILE  80          2HD1      ILE  80 -10.432  -7.840  -3.839
  618    H    PHE  81           H        PHE  81  -9.079  -5.993  -7.009
  619    HA   PHE  81           HA       PHE  81 -10.181  -3.415  -7.256
  620    HB2  PHE  81           2HB      PHE  81  -7.569  -3.273  -8.674
  621    HB3  PHE  81           1HB      PHE  81  -8.529  -1.987  -7.970
  622    HD1  PHE  81           2HD      PHE  81  -8.367  -1.587  -5.442
  623    HD2  PHE  81           1HD      PHE  81  -5.717  -4.147  -7.586
  624    HE1  PHE  81           2HE      PHE  81  -6.798  -1.532  -3.555
  625    HE2  PHE  81           1HE      PHE  81  -4.124  -4.062  -5.707
  626    HZ   PHE  81           HZ       PHE  81  -4.680  -2.789  -3.655
  Start of MODEL    6
    1    H1   GLY   1           1HT      GLY   1   4.734  18.570   7.247
    2    H2   GLY   1           2HT      GLY   1   4.128  18.083   8.750
    3    H3   GLY   1           3HT      GLY   1   3.254  19.176   7.800
    4    HA2  GLY   1           1HA      GLY   1   2.643  16.631   7.880
    5    HA3  GLY   1           2HA      GLY   1   2.433  17.599   6.429
    6    H    SER   2           H        SER   2   2.563  15.201   5.693
    7    HA   SER   2           HA       SER   2   5.357  14.410   5.273
    8    HB2  SER   2           2HB      SER   2   3.215  12.612   4.321
    9    HB3  SER   2           1HB      SER   2   4.672  12.245   5.243
   10    HG   SER   2           HG       SER   2   3.594  13.097   7.092
   11    HA   PRO   3           HA       PRO   3   5.169  15.557   1.012
   12    HB2  PRO   3           2HB      PRO   3   7.055  13.972  -0.056
   13    HB3  PRO   3           1HB      PRO   3   7.460  15.261   1.086
   14    HG2  PRO   3           2HG      PRO   3   7.182  12.321   1.570
   15    HG3  PRO   3           1HG      PRO   3   8.413  13.443   2.177
   16    HD2  PRO   3           2HD      PRO   3   6.248  12.614   3.641
   17    HD3  PRO   3           1HD      PRO   3   7.083  14.157   3.900
   18    H    GLY   4           H        GLY   4   3.952  12.642   2.065
   19    HA2  GLY   4           2HA      GLY   4   2.416  11.234   1.116
   20    HA3  GLY   4           1HA      GLY   4   2.458  12.242  -0.330
   21    H    PHE   5           H        PHE   5   2.252   9.678  -1.030
   22    HA   PHE   5           HA       PHE   5   4.856   9.055  -2.120
   23    HB2  PHE   5           2HB      PHE   5   3.483   7.035  -0.356
   24    HB3  PHE   5           1HB      PHE   5   5.001   6.834  -1.199
   25    HD1  PHE   5           1HD      PHE   5   6.972   8.240  -0.517
   26    HD2  PHE   5           2HD      PHE   5   3.389   8.013   1.765
   27    HE1  PHE   5           1HE      PHE   5   8.175   9.106   1.449
   28    HE2  PHE   5           2HE      PHE   5   4.583   8.878   3.733
   29    HZ   PHE   5           HZ       PHE   5   6.978   9.426   3.578
   30    H    THR   6           H        THR   6   1.479   8.093  -1.800
   31    HA   THR   6           HA       THR   6  -0.033   7.655  -3.497
   32    HB   THR   6           HB       THR   6   2.185   6.854  -5.356
   33    HG1  THR   6           1HG      THR   6   2.865   8.825  -5.258
   34   HG21  THR   6          3HG2      THR   6   0.308   8.292  -6.747
   35   HG22  THR   6          1HG2      THR   6  -0.661   7.360  -5.604
   36   HG23  THR   6          2HG2      THR   6   0.448   6.534  -6.698
   37    H    CYS   7           H        CYS   7  -1.069   5.863  -2.764
   38    HA   CYS   7           HA       CYS   7   0.236   3.313  -2.381
   39    HB2  CYS   7           2HB      CYS   7  -1.542   3.024  -0.977
   40    HB3  CYS   7           1HB      CYS   7  -2.362   4.438  -1.598
   41    H    CYS   8           H        CYS   8  -0.739   4.970  -5.087
   42    HA   CYS   8           HA       CYS   8  -1.180   4.358  -7.234
   43    HB2  CYS   8           2HB      CYS   8   0.598   2.760  -7.150
   44    HB3  CYS   8           1HB      CYS   8  -0.312   1.676  -6.111
   45    HG   CYS   8           HG       CYS   8  -1.759   1.011  -8.175
   46    H    VAL   9           H        VAL   9  -3.001   4.711  -5.211
   47    HA   VAL   9           HA       VAL   9  -5.072   2.765  -5.100
   48    HB   VAL   9           HB       VAL   9  -4.931   4.171  -3.203
   49   HG11  VAL   9          1HG1      VAL   9  -3.586   5.912  -3.717
   50   HG12  VAL   9          2HG1      VAL   9  -5.141   6.743  -3.637
   51   HG13  VAL   9          3HG1      VAL   9  -4.456   6.306  -5.201
   52   HG21  VAL   9          3HG2      VAL   9  -7.291   3.980  -4.020
   53   HG22  VAL   9          1HG2      VAL   9  -7.100   5.568  -4.763
   54   HG23  VAL   9          2HG2      VAL   9  -6.963   5.398  -3.004
   55    HA   PRO  10           HA       PRO  10  -6.746   4.272  -9.071
   56    HB2  PRO  10           2HB      PRO  10  -8.019   2.011  -9.741
   57    HB3  PRO  10           1HB      PRO  10  -6.263   2.148  -9.896
   58    HG2  PRO  10           2HG      PRO  10  -7.874   0.845  -7.732
   59    HG3  PRO  10           1HG      PRO  10  -6.413   0.258  -8.544
   60    HD2  PRO  10           2HD      PRO  10  -6.389   1.475  -6.088
   61    HD3  PRO  10           1HD      PRO  10  -5.029   1.503  -7.220
   62    H    GLY  11           H        GLY  11  -8.424   2.350  -6.641
   63    HA2  GLY  11           2HA      GLY  11 -10.606   4.277  -6.580
   64    HA3  GLY  11           1HA      GLY  11 -11.024   2.616  -6.981
   65    H    CYS  12           H        CYS  12  -8.359   2.758  -4.895
   66    HA   CYS  12           HA       CYS  12  -9.704   1.447  -2.833
   67    HB2  CYS  12           2HB      CYS  12  -7.653   1.097  -1.966
   68    HB3  CYS  12           1HB      CYS  12  -7.079   1.799  -3.464
   69    H    TYR  13           H        TYR  13  -8.943   2.678  -0.458
   70    HA   TYR  13           HA       TYR  13 -11.109   4.431  -0.078
   71    HB2  TYR  13           2HB      TYR  13  -9.618   2.815   1.516
   72    HB3  TYR  13           1HB      TYR  13  -9.074   4.411   2.006
   73    HD1  TYR  13           1HD      TYR  13 -12.465   3.352   0.902
   74    HD2  TYR  13           2HD      TYR  13 -10.033   4.710   4.118
   75    HE1  TYR  13           1HE      TYR  13 -14.468   3.591   2.308
   76    HE2  TYR  13           2HE      TYR  13 -12.029   4.952   5.533
   77    HH   TYR  13           HH       TYR  13 -14.963   5.216   4.550
   78    H    ASN  14           H        ASN  14  -7.795   4.886   0.649
   79    HA   ASN  14           HA       ASN  14  -7.828   7.733  -0.006
   80    HB2  ASN  14           2HB      ASN  14  -5.944   7.213   1.893
   81    HB3  ASN  14           1HB      ASN  14  -7.384   8.108   2.138
   82   HD21  ASN  14          1HD2      ASN  14  -5.987   4.927   2.213
   83   HD22  ASN  14          2HD2      ASN  14  -7.139   4.179   3.253
   84    H    ASN  15           H        ASN  15  -5.497   8.647  -0.478
   85    HA   ASN  15           HA       ASN  15  -4.084   6.554  -1.967
   86    HB2  ASN  15           2HB      ASN  15  -5.005   8.633  -3.109
   87    HB3  ASN  15           1HB      ASN  15  -3.801   9.560  -2.229
   88   HD21  ASN  15          1HD2      ASN  15  -3.984   9.597  -4.954
   89   HD22  ASN  15          2HD2      ASN  15  -2.574   8.869  -5.629
   90    H    SER  16           H        SER  16  -1.483   6.810  -1.997
   91    HA   SER  16           HA       SER  16  -0.668   7.157   0.710
   92    HB2  SER  16           2HB      SER  16   0.132   5.171  -0.682
   93    HB3  SER  16           1HB      SER  16   1.036   6.263  -1.674
   94    HG   SER  16           HG       SER  16   1.952   5.161   0.390
   95    H    HIS  17           H        HIS  17  -1.002   9.392  -1.771
   96    HA   HIS  17           HA       HIS  17   0.829  11.215  -0.445
   97    HB2  HIS  17           2HB      HIS  17   2.226  11.635  -2.185
   98    HB3  HIS  17           1HB      HIS  17   1.756  10.028  -2.715
   99    HD1  HIS  17           1HD      HIS  17   1.571  13.593  -3.642
  100    HD2  HIS  17           2HD      HIS  17  -0.135  10.007  -4.865
  101    HE1  HIS  17           1HE      HIS  17   0.550  14.068  -5.890
  102    HE2  HIS  17           2HE      HIS  17  -0.378  11.854  -6.659
  103    H    ARG  18           H        ARG  18  -2.198  10.666  -1.622
  104    HA   ARG  18           HA       ARG  18  -2.639  13.532  -2.138
  105    HB2  ARG  18           2HB      ARG  18  -4.408  11.344  -3.190
  106    HB3  ARG  18           1HB      ARG  18  -4.272  12.997  -3.749
  107    HG2  ARG  18           2HG      ARG  18  -1.848  12.398  -4.312
  108    HG3  ARG  18           1HG      ARG  18  -2.394  10.731  -4.195
  109    HD2  ARG  18           2HD      ARG  18  -3.088  10.884  -6.306
  110    HD3  ARG  18           1HD      ARG  18  -4.320  12.018  -5.753
  111    HE   ARG  18           HE       ARG  18  -2.209  13.627  -6.082
  112   HH11  ARG  18          1HH1      ARG  18  -3.591  11.189  -8.165
  113   HH12  ARG  18          2HH1      ARG  18  -3.099  11.981  -9.624
  114   HH21  ARG  18          1HH2      ARG  18  -1.562  14.666  -8.002
  115   HH22  ARG  18          2HH2      ARG  18  -1.945  13.951  -9.532
  116    H    ASP  19           H        ASP  19  -2.637  12.305   0.405
  117    HA   ASP  19           HA       ASP  19  -4.962  13.410   1.495
  118    HB2  ASP  19           2HB      ASP  19  -6.422  11.734   1.172
  119    HB3  ASP  19           1HB      ASP  19  -5.161  10.595   0.756
  120    H    LYS  20           H        LYS  20  -3.030  10.577   2.404
  121    HA   LYS  20           HA       LYS  20  -1.631  10.167   4.160
  122    HB2  LYS  20           2HB      LYS  20  -1.277  13.158   4.297
  123    HB3  LYS  20           1HB      LYS  20  -0.162  11.926   4.869
  124    HG2  LYS  20           2HG      LYS  20   0.223  11.201   2.572
  125    HG3  LYS  20           1HG      LYS  20  -0.913  12.422   1.994
  126    HD2  LYS  20           2HD      LYS  20   0.780  13.918   3.525
  127    HD3  LYS  20           1HD      LYS  20   1.872  12.697   2.869
  128    HE2  LYS  20           2HE      LYS  20   1.996  14.145   1.140
  129    HE3  LYS  20           1HE      LYS  20   0.513  13.332   0.642
  130    HZ1  LYS  20           3HZ      LYS  20  -0.716  15.144   1.061
  131    HZ2  LYS  20           1HZ      LYS  20   0.752  15.979   0.943
  132    HZ3  LYS  20           2HZ      LYS  20   0.141  15.552   2.462
  133    H    ALA  21           H        ALA  21  -4.517  11.227   4.557
  134    HA   ALA  21           HA       ALA  21  -4.340  11.790   7.431
  135    HB1  ALA  21           1HB      ALA  21  -6.952  12.342   6.755
  136    HB2  ALA  21           2HB      ALA  21  -6.034  12.855   5.336
  137    HB3  ALA  21           3HB      ALA  21  -5.638  13.505   6.923
  138    H    LEU  22           H        LEU  22  -6.451   9.804   5.224
  139    HA   LEU  22           HA       LEU  22  -7.953   8.568   7.161
  140    HB2  LEU  22           2HB      LEU  22  -7.153   7.209   4.591
  141    HB3  LEU  22           1HB      LEU  22  -8.731   7.212   5.382
  142    HG   LEU  22           HG       LEU  22  -7.553   9.155   3.490
  143   HD11  LEU  22          1HD1      LEU  22 -10.197   9.299   3.177
  144   HD12  LEU  22          2HD1      LEU  22 -10.100   7.715   3.941
  145   HD13  LEU  22          3HD1      LEU  22  -9.225   8.027   2.444
  146   HD21  LEU  22          3HD2      LEU  22  -8.751   9.976   5.986
  147   HD22  LEU  22          1HD2      LEU  22  -9.649  10.553   4.586
  148   HD23  LEU  22          2HD2      LEU  22  -7.935  10.925   4.745
  149    H    HIS  23           H        HIS  23  -7.234   5.534   6.623
  150    HA   HIS  23           HA       HIS  23  -5.202   5.484   8.664
  151    HB2  HIS  23           2HB      HIS  23  -7.548   4.057   8.161
  152    HB3  HIS  23           1HB      HIS  23  -6.263   2.905   7.833
  153    HD1  HIS  23           1HD      HIS  23  -4.538   2.518   9.869
  154    HD2  HIS  23           2HD      HIS  23  -8.096   4.450  10.807
  155    HE1  HIS  23           1HE      HIS  23  -4.751   2.357  12.369
  156    HE2  HIS  23           2HE      HIS  23  -6.959   3.447  12.903
  157    H    PHE  24           H        PHE  24  -3.141   4.286   8.392
  158    HA   PHE  24           HA       PHE  24  -2.687   3.284   5.693
  159    HB2  PHE  24           2HB      PHE  24  -0.849   4.992   7.344
  160    HB3  PHE  24           1HB      PHE  24  -0.360   4.170   5.877
  161    HD1  PHE  24           1HD      PHE  24  -1.191   4.926   3.680
  162    HD2  PHE  24           2HD      PHE  24  -2.278   6.937   7.275
  163    HE1  PHE  24           1HE      PHE  24  -1.917   6.852   2.367
  164    HE2  PHE  24           2HE      PHE  24  -3.037   8.870   5.955
  165    HZ   PHE  24           HZ       PHE  24  -2.864   8.835   3.491
  166    H    TYR  25           H        TYR  25  -1.768   1.097   5.665
  167    HA   TYR  25           HA       TYR  25  -1.020  -0.042   8.216
  168    HB2  TYR  25           2HB      TYR  25  -1.331  -1.231   5.443
  169    HB3  TYR  25           1HB      TYR  25  -0.618  -2.138   6.764
  170    HD1  TYR  25           1HD      TYR  25  -3.581   0.143   6.671
  171    HD2  TYR  25           2HD      TYR  25  -2.094  -3.782   7.374
  172    HE1  TYR  25           1HE      TYR  25  -5.820  -0.569   7.401
  173    HE2  TYR  25           2HE      TYR  25  -4.324  -4.511   8.106
  174    HH   TYR  25           HH       TYR  25  -7.072  -2.928   7.465
  175    H    THR  26           H        THR  26   1.207  -1.142   8.470
  176    HA   THR  26           HA       THR  26   3.177   0.370   6.897
  177    HB   THR  26           HB       THR  26   4.433   0.591   8.778
  178    HG1  THR  26           1HG      THR  26   3.753  -2.081   9.435
  179   HG21  THR  26          3HG2      THR  26   3.315   0.697  10.826
  180   HG22  THR  26          1HG2      THR  26   2.176  -0.568  10.367
  181   HG23  THR  26          2HG2      THR  26   2.081   1.021   9.608
  182    H    PHE  27           H        PHE  27   5.400  -0.912   6.767
  183    HA   PHE  27           HA       PHE  27   4.758  -3.182   5.215
  184    HB2  PHE  27           2HB      PHE  27   6.779  -1.242   5.347
  185    HB3  PHE  27           1HB      PHE  27   7.500  -2.817   5.145
  186    HD1  PHE  27           1HD      PHE  27   4.189  -2.240   3.750
  187    HD2  PHE  27           2HD      PHE  27   8.376  -2.064   3.005
  188    HE1  PHE  27           1HE      PHE  27   3.759  -2.130   1.338
  189    HE2  PHE  27           2HE      PHE  27   7.952  -1.969   0.614
  190    HZ   PHE  27           HZ       PHE  27   5.634  -1.997  -0.244
  191    HA   PRO  28           HA       PRO  28   5.832  -6.652   7.979
  192    HB2  PRO  28           2HB      PRO  28   6.994  -7.483   5.294
  193    HB3  PRO  28           1HB      PRO  28   6.197  -8.521   6.473
  194    HG2  PRO  28           2HG      PRO  28   4.817  -7.644   4.459
  195    HG3  PRO  28           1HG      PRO  28   4.098  -7.525   6.067
  196    HD2  PRO  28           2HD      PRO  28   5.202  -5.412   4.314
  197    HD3  PRO  28           1HD      PRO  28   3.906  -5.344   5.497
  198    H    LYS  29           H        LYS  29   7.975  -7.932   8.480
  199    HA   LYS  29           HA       LYS  29  10.163  -6.016   8.528
  200    HB2  LYS  29           2HB      LYS  29  10.719  -8.619   9.726
  201    HB3  LYS  29           1HB      LYS  29  10.814  -7.014  10.433
  202    HG2  LYS  29           2HG      LYS  29   8.344  -7.081  10.747
  203    HG3  LYS  29           1HG      LYS  29   8.375  -8.758  10.195
  204    HD2  LYS  29           2HD      LYS  29  10.172  -7.907  12.423
  205    HD3  LYS  29           1HD      LYS  29   8.464  -8.208  12.752
  206    HE2  LYS  29           2HE      LYS  29   9.719 -10.222  13.172
  207    HE3  LYS  29           1HE      LYS  29   8.712 -10.455  11.744
  208    HZ1  LYS  29           3HZ      LYS  29  11.459  -9.516  11.363
  209    HZ2  LYS  29           1HZ      LYS  29  10.510 -10.502  10.369
  210    HZ3  LYS  29           2HZ      LYS  29  11.225 -11.143  11.761
  211    H    ASP  30           H        ASP  30   9.230  -8.787   6.778
  212    HA   ASP  30           HA       ASP  30  11.902  -9.555   5.958
  213    HB2  ASP  30           2HB      ASP  30   9.864 -10.598   4.232
  214    HB3  ASP  30           1HB      ASP  30  10.859 -11.485   5.376
  215    H    ALA  31           H        ALA  31  13.025  -8.328   4.504
  216    HA   ALA  31           HA       ALA  31  12.125  -6.207   3.130
  217    HB1  ALA  31           1HB      ALA  31  14.074  -6.849   1.463
  218    HB2  ALA  31           2HB      ALA  31  14.418  -8.044   2.718
  219    HB3  ALA  31           3HB      ALA  31  14.373  -6.333   3.116
  220    H    GLU  32           H        GLU  32  12.517  -9.350   1.262
  221    HA   GLU  32           HA       GLU  32  11.193  -8.399  -1.009
  222    HB2  GLU  32           2HB      GLU  32  12.439 -10.463  -1.015
  223    HB3  GLU  32           1HB      GLU  32  11.324 -11.271   0.007
  224    HG2  GLU  32           2HG      GLU  32  10.150 -10.127  -2.420
  225    HG3  GLU  32           1HG      GLU  32  11.332 -11.407  -2.685
  226    H    LEU  33           H        LEU  33   9.393 -10.418   1.491
  227    HA   LEU  33           HA       LEU  33   6.989 -10.220   0.299
  228    HB2  LEU  33           2HB      LEU  33   7.610 -11.013   2.702
  229    HB3  LEU  33           1HB      LEU  33   7.255  -9.374   3.178
  230    HG   LEU  33           HG       LEU  33   5.081  -9.759   3.228
  231   HD11  LEU  33          1HD1      LEU  33   4.888  -9.541   0.806
  232   HD12  LEU  33          2HD1      LEU  33   3.807 -10.804   1.395
  233   HD13  LEU  33          3HD1      LEU  33   5.321 -11.236   0.607
  234   HD21  LEU  33          3HD2      LEU  33   5.549 -11.724   4.331
  235   HD22  LEU  33          1HD2      LEU  33   6.103 -12.526   2.863
  236   HD23  LEU  33          2HD2      LEU  33   4.388 -12.203   3.099
  237    H    ARG  34           H        ARG  34   8.764  -7.692   1.824
  238    HA   ARG  34           HA       ARG  34   6.853  -5.638   1.803
  239    HB2  ARG  34           2HB      ARG  34   8.483  -4.214   2.515
  240    HB3  ARG  34           1HB      ARG  34   9.271  -5.731   2.886
  241    HG2  ARG  34           2HG      ARG  34  10.937  -4.444   1.919
  242    HG3  ARG  34           1HG      ARG  34  10.403  -5.458   0.591
  243    HD2  ARG  34           2HD      ARG  34  10.374  -3.506  -0.514
  244    HD3  ARG  34           1HD      ARG  34   8.783  -3.367   0.224
  245    HE   ARG  34           HE       ARG  34   9.575  -1.658   1.532
  246   HH11  ARG  34          1HH1      ARG  34  12.269  -3.343   0.096
  247   HH12  ARG  34          2HH1      ARG  34  13.440  -2.190   0.641
  248   HH21  ARG  34          1HH2      ARG  34  11.110  -0.145   2.252
  249   HH22  ARG  34          2HH2      ARG  34  12.783  -0.373   1.865
  250    H    ARG  35           H        ARG  35   9.461  -6.207  -0.511
  251    HA   ARG  35           HA       ARG  35   8.600  -4.242  -2.261
  252    HB2  ARG  35           2HB      ARG  35  10.026  -5.127  -3.903
  253    HB3  ARG  35           1HB      ARG  35  10.816  -5.476  -2.380
  254    HG2  ARG  35           2HG      ARG  35  11.090  -7.350  -3.790
  255    HG3  ARG  35           1HG      ARG  35   9.935  -7.814  -2.553
  256    HD2  ARG  35           2HD      ARG  35   8.372  -8.249  -4.097
  257    HD3  ARG  35           1HD      ARG  35   8.604  -6.671  -4.849
  258    HE   ARG  35           HE       ARG  35  10.614  -8.660  -5.471
  259   HH11  ARG  35          1HH1      ARG  35   7.610  -7.153  -6.424
  260   HH12  ARG  35          2HH1      ARG  35   7.770  -7.603  -8.088
  261   HH21  ARG  35          1HH2      ARG  35  10.822  -9.252  -7.659
  262   HH22  ARG  35          2HH2      ARG  35   9.590  -8.797  -8.788
  263    H    LEU  36           H        LEU  36   7.465  -7.531  -1.677
  264    HA   LEU  36           HA       LEU  36   5.886  -7.621  -4.089
  265    HB2  LEU  36           2HB      LEU  36   5.375  -8.953  -1.423
  266    HB3  LEU  36           1HB      LEU  36   4.464  -9.257  -2.883
  267    HG   LEU  36           HG       LEU  36   7.429  -9.648  -2.856
  268   HD11  LEU  36          1HD1      LEU  36   5.475 -11.161  -1.347
  269   HD12  LEU  36          2HD1      LEU  36   7.236 -11.262  -1.337
  270   HD13  LEU  36          3HD1      LEU  36   6.309 -12.160  -2.539
  271   HD21  LEU  36          3HD2      LEU  36   5.115 -10.439  -4.551
  272   HD22  LEU  36          1HD2      LEU  36   6.517 -11.507  -4.478
  273   HD23  LEU  36          2HD2      LEU  36   6.706  -9.838  -5.020
  274    H    TRP  37           H        TRP  37   5.080  -6.357  -0.861
  275    HA   TRP  37           HA       TRP  37   2.467  -5.592  -1.607
  276    HB2  TRP  37           2HB      TRP  37   4.415  -4.631   0.474
  277    HB3  TRP  37           1HB      TRP  37   2.874  -3.814   0.225
  278    HD1  TRP  37           HD       TRP  37   3.194  -7.593  -0.132
  279    HE1  TRP  37           1HE      TRP  37   1.871  -8.724   1.810
  280    HE3  TRP  37           3HE      TRP  37   1.891  -3.435   2.510
  281    HZ2  TRP  37           2HZ      TRP  37   0.426  -7.896   4.133
  282    HZ3  TRP  37           3HZ      TRP  37   0.583  -3.671   4.544
  283    HH2  TRP  37           HH       TRP  37  -0.162  -5.819   5.330
  284    H    LEU  38           H        LEU  38   5.700  -4.008  -1.967
  285    HA   LEU  38           HA       LEU  38   5.117  -1.447  -2.624
  286    HB2  LEU  38           2HB      LEU  38   6.945  -3.371  -4.083
  287    HB3  LEU  38           1HB      LEU  38   6.819  -1.697  -4.503
  288    HG   LEU  38           HG       LEU  38   7.742  -2.808  -1.880
  289   HD11  LEU  38          1HD1      LEU  38   9.838  -1.585  -2.539
  290   HD12  LEU  38          2HD1      LEU  38   9.130  -1.399  -4.143
  291   HD13  LEU  38          3HD1      LEU  38   9.454  -3.009  -3.505
  292   HD21  LEU  38          3HD2      LEU  38   8.163  -0.488  -1.239
  293   HD22  LEU  38          1HD2      LEU  38   6.450  -0.778  -1.515
  294   HD23  LEU  38          2HD2      LEU  38   7.407   0.063  -2.732
  295    H    LYS  39           H        LYS  39   4.775  -4.352  -4.814
  296    HA   LYS  39           HA       LYS  39   3.766  -3.210  -7.031
  297    HB2  LYS  39           2HB      LYS  39   3.620  -5.789  -5.668
  298    HB3  LYS  39           1HB      LYS  39   2.322  -5.542  -6.797
  299    HG2  LYS  39           2HG      LYS  39   4.588  -6.660  -7.497
  300    HG3  LYS  39           1HG      LYS  39   3.684  -5.630  -8.609
  301    HD2  LYS  39           2HD      LYS  39   5.611  -4.219  -6.884
  302    HD3  LYS  39           1HD      LYS  39   6.324  -5.351  -8.034
  303    HE2  LYS  39           2HE      LYS  39   4.271  -3.813  -9.321
  304    HE3  LYS  39           1HE      LYS  39   5.418  -2.737  -8.527
  305    HZ1  LYS  39           3HZ      LYS  39   5.936  -3.424 -10.890
  306    HZ2  LYS  39           1HZ      LYS  39   6.304  -4.956 -10.271
  307    HZ3  LYS  39           2HZ      LYS  39   7.186  -3.605  -9.765
  308    H    ASN  40           H        ASN  40   1.588  -4.472  -4.497
  309    HA   ASN  40           HA       ASN  40  -0.734  -3.453  -5.662
  310    HB2  ASN  40           2HB      ASN  40  -1.407  -3.493  -3.008
  311    HB3  ASN  40           1HB      ASN  40  -1.465  -4.873  -4.094
  312   HD21  ASN  40          1HD2      ASN  40   0.125  -6.446  -3.965
  313   HD22  ASN  40          2HD2      ASN  40   1.172  -6.583  -2.600
  314    H    VAL  41           H        VAL  41   1.380  -1.988  -3.323
  315    HA   VAL  41           HA       VAL  41  -0.331   0.274  -2.983
  316    HB   VAL  41           HB       VAL  41   1.618  -0.783  -1.364
  317   HG11  VAL  41          1HG1      VAL  41   3.349   0.779  -1.097
  318   HG12  VAL  41          2HG1      VAL  41   2.522   1.985  -2.085
  319   HG13  VAL  41          3HG1      VAL  41   3.235   0.569  -2.845
  320   HG21  VAL  41          3HG2      VAL  41   0.742   2.009  -0.900
  321   HG22  VAL  41          1HG2      VAL  41   0.677   0.605   0.161
  322   HG23  VAL  41          2HG2      VAL  41  -0.521   0.795  -1.119
  323    H    SER  42           H        SER  42   2.237  -0.367  -5.247
  324    HA   SER  42           HA       SER  42   1.968   1.794  -6.810
  325    HB2  SER  42           2HB      SER  42   2.204   3.726  -5.586
  326    HB3  SER  42           1HB      SER  42   2.760   2.848  -4.150
  327    HG   SER  42           HG       SER  42   4.413   3.479  -6.393
  328    H    ARG  43           H        ARG  43   5.287   1.763  -5.215
  329    HA   ARG  43           HA       ARG  43   7.073   0.384  -5.770
  330    HB2  ARG  43           2HB      ARG  43   5.586  -1.341  -6.702
  331    HB3  ARG  43           1HB      ARG  43   5.522  -0.455  -8.219
  332    HG2  ARG  43           2HG      ARG  43   7.214  -1.753  -8.842
  333    HG3  ARG  43           1HG      ARG  43   8.207  -0.700  -7.835
  334    HD2  ARG  43           2HD      ARG  43   6.971  -2.689  -6.192
  335    HD3  ARG  43           1HD      ARG  43   7.766  -3.471  -7.559
  336    HE   ARG  43           HE       ARG  43   9.323  -1.483  -6.122
  337   HH11  ARG  43          1HH1      ARG  43   8.586  -4.869  -6.579
  338   HH12  ARG  43          2HH1      ARG  43  10.073  -5.411  -5.878
  339   HH21  ARG  43          1HH2      ARG  43  11.270  -2.201  -5.197
  340   HH22  ARG  43          2HH2      ARG  43  11.594  -3.899  -5.090
  341    H    ALA  44           H        ALA  44   7.550   2.924  -6.077
  342    HA   ALA  44           HA       ALA  44   7.796   3.961  -8.691
  343    HB1  ALA  44           1HB      ALA  44   8.147   5.738  -7.394
  344    HB2  ALA  44           2HB      ALA  44   9.785   5.148  -7.107
  345    HB3  ALA  44           3HB      ALA  44   8.486   4.721  -5.994
  346    H    GLY  45           H        GLY  45   8.775   1.723  -9.647
  347    HA2  GLY  45           2HA      GLY  45  11.265   0.793  -9.021
  348    HA3  GLY  45           1HA      GLY  45  10.589   0.743 -10.629
  349    H    VAL  46           H        VAL  46  10.645   3.252 -11.501
  350    HA   VAL  46           HA       VAL  46  12.853   4.863 -10.916
  351    HB   VAL  46           HB       VAL  46  14.288   3.025 -11.474
  352   HG11  VAL  46          1HG1      VAL  46  14.077   2.309 -14.048
  353   HG12  VAL  46          2HG1      VAL  46  12.383   2.652 -13.696
  354   HG13  VAL  46          3HG1      VAL  46  13.261   1.461 -12.735
  355   HG21  VAL  46          3HG2      VAL  46  15.719   4.067 -12.951
  356   HG22  VAL  46          1HG2      VAL  46  14.700   5.414 -12.450
  357   HG23  VAL  46          2HG2      VAL  46  14.411   4.619 -13.998
  358    H    SER  47           H        SER  47  10.482   5.841 -11.599
  359    HA   SER  47           HA       SER  47  10.932   6.871 -14.328
  360    HB2  SER  47           2HB      SER  47   8.573   6.430 -14.937
  361    HB3  SER  47           1HB      SER  47   9.469   4.941 -14.616
  362    HG   SER  47           HG       SER  47   7.427   4.893 -13.621
  363    H    GLY  48           H        GLY  48   8.815   7.089 -11.249
  364    HA2  GLY  48           2HA      GLY  48   7.586   9.486 -11.806
  365    HA3  GLY  48           1HA      GLY  48   8.065   8.974 -10.199
  366    H    CYS  49           H        CYS  49   8.135  11.429 -10.116
  367    HA   CYS  49           HA       CYS  49  10.087  12.954 -11.371
  368    HB2  CYS  49           2HB      CYS  49   9.091  13.381  -8.553
  369    HB3  CYS  49           1HB      CYS  49   9.714  14.599  -9.661
  370    HG   CYS  49           HG       CYS  49   7.429  13.742 -11.099
  371    H    PHE  50           H        PHE  50  11.572  14.201  -9.417
  372    HA   PHE  50           HA       PHE  50  14.015  13.293  -9.416
  373    HB2  PHE  50           2HB      PHE  50  12.999  13.985  -6.659
  374    HB3  PHE  50           1HB      PHE  50  14.512  14.434  -7.432
  375    HD1  PHE  50           1HD      PHE  50  10.948  15.194  -7.123
  376    HD2  PHE  50           2HD      PHE  50  14.637  16.327  -8.916
  377    HE1  PHE  50           1HE      PHE  50   9.969  17.361  -7.754
  378    HE2  PHE  50           2HE      PHE  50  13.666  18.497  -9.550
  379    HZ   PHE  50           HZ       PHE  50  11.330  19.016  -8.969
  380    H    SER  51           H        SER  51  12.161  12.249  -6.411
  381    HA   SER  51           HA       SER  51  13.747   9.771  -6.539
  382    HB2  SER  51           2HB      SER  51  13.599  11.516  -4.482
  383    HB3  SER  51           1HB      SER  51  12.270  10.438  -4.060
  384    HG   SER  51           HG       SER  51  14.872   9.526  -4.711
  385    H    THR  52           H        THR  52  10.757  10.866  -7.331
  386    HA   THR  52           HA       THR  52   8.661   9.970  -7.490
  387    HB   THR  52           HB       THR  52   9.840   8.781  -9.238
  388    HG1  THR  52           1HG      THR  52   7.632   8.126  -8.472
  389   HG21  THR  52          3HG2      THR  52  10.606   6.859  -7.074
  390   HG22  THR  52          1HG2      THR  52  11.640   7.679  -8.245
  391   HG23  THR  52          2HG2      THR  52  10.556   6.393  -8.774
  392    H    PHE  53           H        PHE  53   9.035  10.227  -4.873
  393    HA   PHE  53           HA       PHE  53   8.600   9.420  -2.790
  394    HB2  PHE  53           2HB      PHE  53   6.526   8.107  -2.628
  395    HB3  PHE  53           1HB      PHE  53   6.346   9.465  -3.729
  396    HD1  PHE  53           1HD      PHE  53   7.177   5.825  -3.756
  397    HD2  PHE  53           2HD      PHE  53   5.387   9.099  -5.797
  398    HE1  PHE  53           1HE      PHE  53   6.338   4.287  -5.463
  399    HE2  PHE  53           2HE      PHE  53   4.547   7.556  -7.522
  400    HZ   PHE  53           HZ       PHE  53   5.017   5.140  -7.346
  401    H    GLN  54           H        GLN  54  10.658   7.911  -4.314
  402    HA   GLN  54           HA       GLN  54  10.927   5.343  -4.396
  403    HB2  GLN  54           2HB      GLN  54  12.642   7.403  -3.361
  404    HB3  GLN  54           1HB      GLN  54  12.935   5.896  -2.503
  405    HG2  GLN  54           2HG      GLN  54  12.829   5.077  -5.111
  406    HG3  GLN  54           1HG      GLN  54  13.594   6.660  -5.234
  407   HE21  GLN  54          1HE2      GLN  54  15.399   7.030  -3.655
  408   HE22  GLN  54          2HE2      GLN  54  16.480   5.712  -3.378
  409    HA   PRO  55           HA       PRO  55   9.091   3.399  -0.844
  410    HB2  PRO  55           2HB      PRO  55  10.551   0.961  -1.463
  411    HB3  PRO  55           1HB      PRO  55   8.823   1.292  -1.577
  412    HG2  PRO  55           2HG      PRO  55  10.441   0.956  -3.752
  413    HG3  PRO  55           1HG      PRO  55   8.939   1.892  -3.768
  414    HD2  PRO  55           2HD      PRO  55  11.762   2.836  -3.682
  415    HD3  PRO  55           1HD      PRO  55  10.345   3.564  -4.465
  416    H    THR  56           H        THR  56  12.529   3.445  -1.399
  417    HA   THR  56           HA       THR  56  13.603   2.158   0.780
  418    HB   THR  56           HB       THR  56  14.994   3.256  -0.883
  419    HG1  THR  56           1HG      THR  56  16.496   3.556   0.542
  420   HG21  THR  56          3HG2      THR  56  13.385   5.443  -0.683
  421   HG22  THR  56          1HG2      THR  56  14.958   5.399  -1.478
  422   HG23  THR  56          2HG2      THR  56  14.827   5.961   0.189
  423    H    THR  57           H        THR  57  12.023   5.450   0.724
  424    HA   THR  57           HA       THR  57  12.663   6.151   3.360
  425    HB   THR  57           HB       THR  57  11.845   7.827   1.871
  426    HG1  THR  57           1HG      THR  57  10.709   8.780   3.352
  427   HG21  THR  57          3HG2      THR  57   9.069   7.213   1.671
  428   HG22  THR  57          1HG2      THR  57  10.014   5.883   1.002
  429   HG23  THR  57          2HG2      THR  57  10.240   7.521   0.389
  430    H    GLY  58           H        GLY  58  10.048   4.168   2.040
  431    HA2  GLY  58           2HA      GLY  58   9.399   2.401   3.773
  432    HA3  GLY  58           1HA      GLY  58   9.092   3.778   4.799
  433    H    HIS  59           H        HIS  59   7.800   2.119   1.818
  434    HA   HIS  59           HA       HIS  59   5.575   3.940   1.756
  435    HB2  HIS  59           2HB      HIS  59   6.592   1.776   0.082
  436    HB3  HIS  59           1HB      HIS  59   4.840   1.753   0.218
  437    HD1  HIS  59           1HD      HIS  59   7.045   4.812   0.025
  438    HD2  HIS  59           2HD      HIS  59   4.183   2.813  -2.252
  439    HE1  HIS  59           1HE      HIS  59   6.586   6.293  -1.946
  440    HE2  HIS  59           2HE      HIS  59   4.806   5.102  -3.264
  441    H    ARG  60           H        ARG  60   3.503   3.542   2.301
  442    HA   ARG  60           HA       ARG  60   3.011   1.328   4.200
  443    HB2  ARG  60           2HB      ARG  60   1.693   2.802   5.463
  444    HB3  ARG  60           1HB      ARG  60   3.029   3.801   4.934
  445    HG2  ARG  60           2HG      ARG  60   1.209   4.158   2.920
  446    HG3  ARG  60           1HG      ARG  60   0.200   4.056   4.358
  447    HD2  ARG  60           2HD      ARG  60   2.543   5.910   3.954
  448    HD3  ARG  60           1HD      ARG  60   0.842   6.363   3.901
  449    HE   ARG  60           HE       ARG  60   0.718   6.109   6.230
  450   HH11  ARG  60          1HH1      ARG  60   3.949   5.495   5.033
  451   HH12  ARG  60          2HH1      ARG  60   4.678   5.631   6.595
  452   HH21  ARG  60          1HH2      ARG  60   1.688   6.290   8.272
  453   HH22  ARG  60          2HH2      ARG  60   3.401   6.080   8.430
  454    H    LEU  61           H        LEU  61   0.496   0.800   4.251
  455    HA   LEU  61           HA       LEU  61  -0.525   0.615   1.479
  456    HB2  LEU  61           2HB      LEU  61   0.083  -1.294   3.465
  457    HB3  LEU  61           1HB      LEU  61  -1.654  -1.216   3.479
  458    HG   LEU  61           HG       LEU  61  -0.121  -2.869   1.942
  459   HD11  LEU  61          1HD1      LEU  61  -2.219  -3.562   2.381
  460   HD12  LEU  61          2HD1      LEU  61  -2.334  -3.175   0.670
  461   HD13  LEU  61          3HD1      LEU  61  -2.953  -2.044   1.881
  462   HD21  LEU  61          3HD2      LEU  61  -0.661  -2.205  -0.396
  463   HD22  LEU  61          1HD2      LEU  61   0.635  -1.313   0.393
  464   HD23  LEU  61          2HD2      LEU  61  -0.959  -0.584   0.231
  465    H    CYS  62           H        CYS  62  -3.132   0.770   1.377
  466    HA   CYS  62           HA       CYS  62  -4.046   2.060   3.819
  467    HB2  CYS  62           2HB      CYS  62  -5.507   3.396   1.842
  468    HB3  CYS  62           1HB      CYS  62  -4.185   3.975   2.802
  469    H    SER  63           H        SER  63  -6.429   2.322   4.046
  470    HA   SER  63           HA       SER  63  -7.707   0.458   5.026
  471    HB2  SER  63           2HB      SER  63  -8.531   2.875   3.687
  472    HB3  SER  63           1HB      SER  63  -9.807   1.666   3.592
  473    HG   SER  63           HG       SER  63  -8.459   2.282   6.009
  474    H    VAL  64           H        VAL  64  -9.133   1.059   1.986
  475    HA   VAL  64           HA       VAL  64 -10.449  -1.444   2.029
  476    HB   VAL  64           HB       VAL  64 -11.576  -0.754   0.012
  477   HG11  VAL  64          1HG1      VAL  64 -12.222   0.203   2.200
  478   HG12  VAL  64          2HG1      VAL  64 -12.539   1.307   0.862
  479   HG13  VAL  64          3HG1      VAL  64 -11.135   1.560   1.902
  480   HG21  VAL  64          3HG2      VAL  64  -9.362   1.249  -0.067
  481   HG22  VAL  64          1HG2      VAL  64 -10.902   1.560  -0.867
  482   HG23  VAL  64          2HG2      VAL  64  -9.925   0.170  -1.348
  483    H    HIS  65           H        HIS  65  -7.593  -2.063   1.624
  484    HA   HIS  65           HA       HIS  65  -7.900  -3.390  -1.010
  485    HB2  HIS  65           2HB      HIS  65  -5.183  -3.260   0.099
  486    HB3  HIS  65           1HB      HIS  65  -5.737  -3.095  -1.552
  487    HD1  HIS  65           1HD      HIS  65  -7.640  -0.640  -0.001
  488    HD2  HIS  65           2HD      HIS  65  -3.590  -0.981  -0.804
  489    HE1  HIS  65           1HE      HIS  65  -6.686   1.622   0.419
  490    H    PHE  66           H        PHE  66  -8.839  -4.400   1.644
  491    HA   PHE  66           HA       PHE  66  -7.145  -6.797   1.688
  492    HB2  PHE  66           2HB      PHE  66  -8.359  -5.217   3.934
  493    HB3  PHE  66           1HB      PHE  66  -8.049  -6.931   4.167
  494    HD1  PHE  66           2HD      PHE  66  -5.610  -7.644   3.264
  495    HD2  PHE  66           1HD      PHE  66  -6.732  -3.786   4.663
  496    HE1  PHE  66           2HE      PHE  66  -3.256  -7.148   3.772
  497    HE2  PHE  66           1HE      PHE  66  -4.377  -3.282   5.170
  498    HZ   PHE  66           HZ       PHE  66  -2.637  -4.967   4.721
  499    H    GLN  67           H        GLN  67  -8.454  -8.883   2.486
  500    HA   GLN  67           HA       GLN  67 -11.138  -8.673   1.378
  501    HB2  GLN  67           2HB      GLN  67 -10.687 -11.380   1.670
  502    HB3  GLN  67           1HB      GLN  67 -10.448 -10.462   0.192
  503    HG2  GLN  67           2HG      GLN  67  -8.066 -10.067   1.061
  504    HG3  GLN  67           1HG      GLN  67  -8.411 -11.382   2.183
  505   HE21  GLN  67          1HE2      GLN  67  -7.417 -13.128   1.477
  506   HE22  GLN  67          2HE2      GLN  67  -7.411 -13.708  -0.151
  507    H    GLY  68           H        GLY  68 -13.004  -9.741   2.806
  508    HA2  GLY  68           2HA      GLY  68 -13.332  -9.177   5.311
  509    HA3  GLY  68           1HA      GLY  68 -13.754 -10.776   4.753
  510    H    GLY  69           H        GLY  69 -10.966  -8.968   6.188
  511    HA2  GLY  69           2HA      GLY  69 -10.522 -10.667   8.294
  512    HA3  GLY  69           1HA      GLY  69  -9.647 -11.389   6.950
  513    H    ARG  70           H        ARG  70  -8.126 -10.705   9.037
  514    HA   ARG  70           HA       ARG  70  -6.752  -8.279   8.123
  515    HB2  ARG  70           2HB      ARG  70  -6.058  -8.073  10.617
  516    HB3  ARG  70           1HB      ARG  70  -7.646  -7.503  10.121
  517    HG2  ARG  70           2HG      ARG  70  -8.696  -9.468  10.993
  518    HG3  ARG  70           1HG      ARG  70  -7.131 -10.211  11.326
  519    HD2  ARG  70           2HD      ARG  70  -8.345  -9.187  13.300
  520    HD3  ARG  70           1HD      ARG  70  -6.668  -8.702  13.072
  521    HE   ARG  70           HE       ARG  70  -7.725  -6.683  11.894
  522   HH11  ARG  70          1HH1      ARG  70  -9.149  -8.332  14.632
  523   HH12  ARG  70          2HH1      ARG  70  -9.993  -6.929  15.188
  524   HH21  ARG  70          1HH2      ARG  70  -8.834  -4.845  12.637
  525   HH22  ARG  70          2HH2      ARG  70  -9.816  -4.953  14.060
  526    H    LYS  71           H        LYS  71  -6.083 -10.683   7.115
  527    HA   LYS  71           HA       LYS  71  -4.264 -11.955   6.668
  528    HB2  LYS  71           2HB      LYS  71  -3.155  -9.835   8.367
  529    HB3  LYS  71           1HB      LYS  71  -2.218 -11.318   8.348
  530    HG2  LYS  71           2HG      LYS  71  -1.328 -10.689   6.426
  531    HG3  LYS  71           1HG      LYS  71  -2.918 -10.797   5.681
  532    HD2  LYS  71           2HD      LYS  71  -1.792  -8.371   7.069
  533    HD3  LYS  71           1HD      LYS  71  -1.957  -8.588   5.323
  534    HE2  LYS  71           2HE      LYS  71  -4.215  -8.534   7.334
  535    HE3  LYS  71           1HE      LYS  71  -3.787  -7.242   6.210
  536    HZ1  LYS  71           3HZ      LYS  71  -5.612  -8.485   5.322
  537    HZ2  LYS  71           1HZ      LYS  71  -4.787  -9.948   5.515
  538    HZ3  LYS  71           2HZ      LYS  71  -4.247  -8.818   4.379
  539    H    THR  72           H        THR  72  -4.752 -13.942   7.201
  540    HA   THR  72           HA       THR  72  -4.049 -14.930   9.871
  541    HB   THR  72           HB       THR  72  -6.029 -16.298  10.012
  542    HG1  THR  72           1HG      THR  72  -6.852 -15.212   7.530
  543   HG21  THR  72          3HG2      THR  72  -6.209 -13.654  10.367
  544   HG22  THR  72          1HG2      THR  72  -7.558 -14.764  10.606
  545   HG23  THR  72          2HG2      THR  72  -7.415 -13.868   9.095
  546    H    TYR  73           H        TYR  73  -5.057 -15.728   6.602
  547    HA   TYR  73           HA       TYR  73  -2.773 -17.221   5.968
  548    HB2  TYR  73           2HB      TYR  73  -4.195 -18.783   7.544
  549    HB3  TYR  73           1HB      TYR  73  -5.183 -19.014   6.109
  550    HD1  TYR  73           1HD      TYR  73  -1.632 -19.195   7.242
  551    HD2  TYR  73           2HD      TYR  73  -4.616 -20.680   4.597
  552    HE1  TYR  73           1HE      TYR  73  -0.063 -20.914   6.446
  553    HE2  TYR  73           2HE      TYR  73  -3.056 -22.403   3.793
  554    HH   TYR  73           HH       TYR  73   0.109 -22.309   4.110
  555    H    THR  74           H        THR  74  -3.282 -18.436   3.684
  556    HA   THR  74           HA       THR  74  -4.052 -18.262   1.561
  557    HB   THR  74           HB       THR  74  -6.554 -16.915   1.875
  558    HG1  THR  74           1HG      THR  74  -7.482 -18.048   3.504
  559   HG21  THR  74          3HG2      THR  74  -7.510 -18.902   1.088
  560   HG22  THR  74          1HG2      THR  74  -6.162 -19.878   1.671
  561   HG23  THR  74          2HG2      THR  74  -5.937 -18.789   0.301
  562    H    VAL  75           H        VAL  75  -4.991 -15.309   3.361
  563    HA   VAL  75           HA       VAL  75  -4.574 -13.621   1.069
  564    HB   VAL  75           HB       VAL  75  -6.266 -13.357   3.026
  565   HG11  VAL  75          1HG1      VAL  75  -4.151 -11.777   4.394
  566   HG12  VAL  75          2HG1      VAL  75  -4.308 -13.509   4.698
  567   HG13  VAL  75          3HG1      VAL  75  -5.665 -12.430   5.019
  568   HG21  VAL  75          3HG2      VAL  75  -6.431 -10.997   2.807
  569   HG22  VAL  75          1HG2      VAL  75  -5.899 -11.625   1.251
  570   HG23  VAL  75          2HG2      VAL  75  -4.743 -10.843   2.338
  571    H    ARG  76           H        ARG  76  -2.335 -13.780   0.477
  572    HA   ARG  76           HA       ARG  76  -0.369 -13.220   2.559
  573    HB2  ARG  76           2HB      ARG  76  -0.369 -14.792   0.224
  574    HB3  ARG  76           1HB      ARG  76   0.748 -13.472  -0.095
  575    HG2  ARG  76           2HG      ARG  76   1.963 -14.014   1.962
  576    HG3  ARG  76           1HG      ARG  76   0.852 -15.353   2.255
  577    HD2  ARG  76           2HD      ARG  76   3.096 -15.895   1.159
  578    HD3  ARG  76           1HD      ARG  76   1.643 -16.563   0.418
  579    HE   ARG  76           HE       ARG  76   2.021 -15.258  -1.435
  580   HH11  ARG  76          1HH1      ARG  76   4.088 -14.190   1.167
  581   HH12  ARG  76          2HH1      ARG  76   5.028 -13.146   0.156
  582   HH21  ARG  76          1HH2      ARG  76   3.256 -13.885  -2.763
  583   HH22  ARG  76          2HH2      ARG  76   4.554 -12.969  -2.073
  584    H    VAL  77           H        VAL  77  -1.366 -11.889  -0.606
  585    HA   VAL  77           HA       VAL  77  -0.311  -9.296   0.302
  586    HB   VAL  77           HB       VAL  77   0.700  -8.822  -1.815
  587   HG11  VAL  77          1HG1      VAL  77   1.297 -11.591  -0.820
  588   HG12  VAL  77          2HG1      VAL  77   2.206 -10.106  -0.560
  589   HG13  VAL  77          3HG1      VAL  77   2.202 -10.868  -2.148
  590   HG21  VAL  77          3HG2      VAL  77  -1.075 -10.931  -2.778
  591   HG22  VAL  77          1HG2      VAL  77   0.551 -10.988  -3.455
  592   HG23  VAL  77          2HG2      VAL  77  -0.414  -9.523  -3.609
  593    HA   PRO  78           HA       PRO  78  -4.544  -8.013  -0.595
  594    HB2  PRO  78           2HB      PRO  78  -3.144  -5.385  -0.667
  595    HB3  PRO  78           1HB      PRO  78  -4.624  -5.837   0.172
  596    HG2  PRO  78           2HG      PRO  78  -2.445  -5.602   1.578
  597    HG3  PRO  78           1HG      PRO  78  -3.419  -7.075   1.801
  598    HD2  PRO  78           2HD      PRO  78  -0.960  -6.689   0.120
  599    HD3  PRO  78           1HD      PRO  78  -1.304  -7.963   1.329
  600    H    THR  79           H        THR  79  -4.026  -8.970  -3.059
  601    HA   THR  79           HA       THR  79  -3.884  -6.447  -4.579
  602    HB   THR  79           HB       THR  79  -4.042  -8.894  -6.173
  603    HG1  THR  79           1HG      THR  79  -1.963  -8.589  -4.286
  604   HG21  THR  79          3HG2      THR  79  -1.580  -7.404  -6.374
  605   HG22  THR  79          1HG2      THR  79  -2.993  -6.351  -6.475
  606   HG23  THR  79          2HG2      THR  79  -2.824  -7.708  -7.589
  607    H    ILE  80           H        ILE  80  -5.665  -5.631  -4.572
  608    HA   ILE  80           HA       ILE  80  -8.040  -6.904  -5.719
  609    HB   ILE  80           HB       ILE  80  -7.980  -4.814  -3.496
  610   HG12  ILE  80          2HG1      ILE  80  -7.577  -6.758  -2.313
  611   HG13  ILE  80          1HG1      ILE  80  -9.336  -6.738  -2.314
  612   HG21  ILE  80          1HG2      ILE  80 -10.440  -5.186  -3.369
  613   HG22  ILE  80          2HG2      ILE  80 -10.340  -6.075  -4.881
  614   HG23  ILE  80          3HG2      ILE  80  -9.905  -4.362  -4.827
  615   HD11  ILE  80          3HD1      ILE  80  -8.841  -8.156  -4.558
  616   HD12  ILE  80          1HD1      ILE  80  -9.138  -8.846  -2.960
  617   HD13  ILE  80          2HD1      ILE  80  -7.483  -8.628  -3.536
  618    H    PHE  81           H        PHE  81  -8.954  -5.401  -7.436
  619    HA   PHE  81           HA       PHE  81  -8.829  -3.675  -8.927
  620    HB2  PHE  81           2HB      PHE  81  -7.815  -1.462  -8.099
  621    HB3  PHE  81           1HB      PHE  81  -9.220  -2.052  -7.227
  622    HD1  PHE  81           1HD      PHE  81  -5.564  -1.525  -7.049
  623    HD2  PHE  81           2HD      PHE  81  -9.067  -2.705  -4.925
  624    HE1  PHE  81           1HE      PHE  81  -4.292  -1.476  -4.928
  625    HE2  PHE  81           2HE      PHE  81  -7.810  -2.661  -2.815
  626    HZ   PHE  81           HZ       PHE  81  -5.414  -2.087  -2.800
  Start of MODEL    7
    1    H1   GLY   1           1HT      GLY   1   6.537  19.563  -0.242
    2    H2   GLY   1           2HT      GLY   1   6.313  18.363   0.929
    3    H3   GLY   1           3HT      GLY   1   5.192  18.539  -0.326
    4    HA2  GLY   1           1HA      GLY   1   7.506  18.186  -1.678
    5    HA3  GLY   1           2HA      GLY   1   7.705  17.137  -0.283
    6    H    SER   2           H        SER   2   6.616  15.234  -0.192
    7    HA   SER   2           HA       SER   2   4.320  14.713  -1.833
    8    HB2  SER   2           2HB      SER   2   6.478  14.477  -3.305
    9    HB3  SER   2           1HB      SER   2   6.660  12.944  -2.452
   10    HG   SER   2           HG       SER   2   5.453  12.493  -4.230
   11    HA   PRO   3           HA       PRO   3   5.065  11.981   1.934
   12    HB2  PRO   3           2HB      PRO   3   3.389  13.133   3.693
   13    HB3  PRO   3           1HB      PRO   3   5.047  13.701   3.472
   14    HG2  PRO   3           2HG      PRO   3   2.498  14.836   2.405
   15    HG3  PRO   3           1HG      PRO   3   3.911  15.679   3.061
   16    HD2  PRO   3           2HD      PRO   3   3.401  15.374   0.376
   17    HD3  PRO   3           1HD      PRO   3   5.018  15.623   1.063
   18    H    GLY   4           H        GLY   4   3.639  11.224  -0.225
   19    HA2  GLY   4           2HA      GLY   4   1.320   9.962   0.990
   20    HA3  GLY   4           1HA      GLY   4   0.982  11.025  -0.378
   21    H    PHE   5           H        PHE   5   0.151   8.591  -0.997
   22    HA   PHE   5           HA       PHE   5   1.664   7.828  -3.158
   23    HB2  PHE   5           2HB      PHE   5   2.175   5.421  -2.026
   24    HB3  PHE   5           1HB      PHE   5   3.360   6.701  -2.258
   25    HD1  PHE   5           1HD      PHE   5   0.790   5.668   0.245
   26    HD2  PHE   5           2HD      PHE   5   4.644   7.323  -0.467
   27    HE1  PHE   5           1HE      PHE   5   1.197   5.782   2.672
   28    HE2  PHE   5           2HE      PHE   5   5.055   7.429   1.953
   29    HZ   PHE   5           HZ       PHE   5   3.327   6.659   3.527
   30    H    THR   6           H        THR   6   0.747   5.874  -4.281
   31    HA   THR   6           HA       THR   6  -2.005   5.844  -4.093
   32    HB   THR   6           HB       THR   6  -1.235   3.442  -5.352
   33    HG1  THR   6           1HG      THR   6   0.449   5.547  -6.190
   34   HG21  THR   6          3HG2      THR   6  -2.555   4.307  -6.889
   35   HG22  THR   6          1HG2      THR   6  -1.337   5.527  -7.263
   36   HG23  THR   6          2HG2      THR   6  -2.556   5.847  -6.029
   37    H    CYS   7           H        CYS   7   0.082   4.253  -1.967
   38    HA   CYS   7           HA       CYS   7  -0.194   2.404  -0.611
   39    HB2  CYS   7           2HB      CYS   7  -2.526   2.246   0.385
   40    HB3  CYS   7           1HB      CYS   7  -1.673   3.759   0.665
   41    H    CYS   8           H        CYS   8  -0.725   2.112  -3.555
   42    HA   CYS   8           HA       CYS   8  -1.370   0.479  -4.974
   43    HB2  CYS   8           2HB      CYS   8  -0.511  -1.267  -3.784
   44    HB3  CYS   8           1HB      CYS   8  -1.274  -0.775  -2.306
   45    HG   CYS   8           HG       CYS   8  -2.672  -2.738  -2.669
   46    H    VAL   9           H        VAL   9  -2.963   2.547  -4.727
   47    HA   VAL   9           HA       VAL   9  -5.671   1.451  -4.381
   48    HB   VAL   9           HB       VAL   9  -5.266   3.318  -2.896
   49   HG11  VAL   9          1HG1      VAL   9  -5.082   5.448  -4.836
   50   HG12  VAL   9          2HG1      VAL   9  -3.722   4.335  -4.973
   51   HG13  VAL   9          3HG1      VAL   9  -4.071   5.117  -3.431
   52   HG21  VAL   9          3HG2      VAL   9  -7.022   4.289  -5.159
   53   HG22  VAL   9          1HG2      VAL   9  -7.185   4.706  -3.447
   54   HG23  VAL   9          2HG2      VAL   9  -7.508   3.063  -4.003
   55    HA   PRO  10           HA       PRO  10  -6.006   2.340  -8.836
   56    HB2  PRO  10           2HB      PRO  10  -7.524   0.233  -9.416
   57    HB3  PRO  10           1HB      PRO  10  -5.793   0.000  -9.124
   58    HG2  PRO  10           2HG      PRO  10  -8.101  -0.449  -7.258
   59    HG3  PRO  10           1HG      PRO  10  -6.692  -1.485  -7.567
   60    HD2  PRO  10           2HD      PRO  10  -6.857   0.248  -5.425
   61    HD3  PRO  10           1HD      PRO  10  -5.343  -0.288  -6.161
   62    H    GLY  11           H        GLY  11  -7.889   2.001  -6.063
   63    HA2  GLY  11           2HA      GLY  11  -9.761   3.961  -6.451
   64    HA3  GLY  11           1HA      GLY  11 -10.527   2.472  -7.013
   65    H    CYS  12           H        CYS  12  -9.082   4.088  -4.241
   66    HA   CYS  12           HA       CYS  12 -10.470   2.197  -2.472
   67    HB2  CYS  12           2HB      CYS  12  -8.631   1.987  -1.016
   68    HB3  CYS  12           1HB      CYS  12  -7.912   1.872  -2.612
   69    H    TYR  13           H        TYR  13  -9.222   3.790  -0.172
   70    HA   TYR  13           HA       TYR  13 -11.237   5.777  -0.176
   71    HB2  TYR  13           2HB      TYR  13 -10.244   4.038   1.797
   72    HB3  TYR  13           1HB      TYR  13 -10.078   5.698   2.355
   73    HD1  TYR  13           2HD      TYR  13 -12.631   3.526   0.690
   74    HD2  TYR  13           1HD      TYR  13 -11.849   6.607   3.519
   75    HE1  TYR  13           2HE      TYR  13 -15.010   3.552   1.311
   76    HE2  TYR  13           1HE      TYR  13 -14.227   6.641   4.147
   77    HH   TYR  13           HH       TYR  13 -16.193   4.800   4.016
   78    H    ASN  14           H        ASN  14  -7.976   5.495  -0.335
   79    HA   ASN  14           HA       ASN  14  -7.486   8.300   0.222
   80    HB2  ASN  14           2HB      ASN  14  -5.484   6.150   0.661
   81    HB3  ASN  14           1HB      ASN  14  -5.641   7.695   1.459
   82   HD21  ASN  14          1HD2      ASN  14  -7.877   4.955   0.948
   83   HD22  ASN  14          2HD2      ASN  14  -8.334   4.787   2.593
   84    H    ASN  15           H        ASN  15  -5.597   9.362  -1.065
   85    HA   ASN  15           HA       ASN  15  -5.242   7.841  -3.551
   86    HB2  ASN  15           2HB      ASN  15  -4.432  10.526  -3.993
   87    HB3  ASN  15           1HB      ASN  15  -5.864   9.716  -4.617
   88   HD21  ASN  15          1HD2      ASN  15  -7.415  11.188  -4.452
   89   HD22  ASN  15          2HD2      ASN  15  -7.846  12.032  -3.006
   90    H    SER  16           H        SER  16  -2.951   8.383  -4.670
   91    HA   SER  16           HA       SER  16  -0.981   7.659  -2.933
   92    HB2  SER  16           2HB      SER  16   0.548   7.672  -4.894
   93    HB3  SER  16           1HB      SER  16  -0.992   6.957  -5.297
   94    HG   SER  16           HG       SER  16  -0.585   8.372  -6.913
   95    H    HIS  17           H        HIS  17   0.164  10.113  -5.064
   96    HA   HIS  17           HA       HIS  17   0.988  11.666  -2.748
   97    HB2  HIS  17           2HB      HIS  17   2.484  12.822  -4.284
   98    HB3  HIS  17           1HB      HIS  17   2.657  11.079  -4.468
   99    HD1  HIS  17           1HD      HIS  17  -0.337  11.685  -6.168
  100    HD2  HIS  17           2HD      HIS  17   3.641  12.518  -7.036
  101    HE1  HIS  17           1HE      HIS  17  -0.245  12.006  -8.659
  102    HE2  HIS  17           2HE      HIS  17   2.153  12.600  -9.150
  103    H    ARG  18           H        ARG  18  -1.715  11.950  -3.005
  104    HA   ARG  18           HA       ARG  18  -1.871  14.728  -3.901
  105    HB2  ARG  18           2HB      ARG  18  -3.931  12.613  -4.622
  106    HB3  ARG  18           1HB      ARG  18  -4.169  14.347  -4.802
  107    HG2  ARG  18           2HG      ARG  18  -1.772  13.081  -6.014
  108    HG3  ARG  18           1HG      ARG  18  -3.343  12.892  -6.797
  109    HD2  ARG  18           2HD      ARG  18  -2.362  14.799  -7.785
  110    HD3  ARG  18           1HD      ARG  18  -3.564  15.411  -6.650
  111    HE   ARG  18           HE       ARG  18  -0.899  15.197  -5.569
  112   HH11  ARG  18          1HH1      ARG  18  -3.171  17.242  -7.256
  113   HH12  ARG  18          2HH1      ARG  18  -2.381  18.712  -6.794
  114   HH21  ARG  18          1HH2      ARG  18   0.138  17.128  -4.959
  115   HH22  ARG  18          2HH2      ARG  18  -0.502  18.647  -5.491
  116    H    ASP  19           H        ASP  19  -2.196  12.718  -1.289
  117    HA   ASP  19           HA       ASP  19  -4.036  14.631  -0.050
  118    HB2  ASP  19           2HB      ASP  19  -5.532  13.004   0.063
  119    HB3  ASP  19           1HB      ASP  19  -4.335  11.751  -0.233
  120    H    LYS  20           H        LYS  20  -2.087  11.948   1.216
  121    HA   LYS  20           HA       LYS  20  -0.482  11.907   2.842
  122    HB2  LYS  20           2HB      LYS  20  -0.351  14.904   2.889
  123    HB3  LYS  20           1HB      LYS  20   0.934  13.735   3.159
  124    HG2  LYS  20           2HG      LYS  20   1.527  13.771   1.022
  125    HG3  LYS  20           1HG      LYS  20  -0.131  13.522   0.482
  126    HD2  LYS  20           2HD      LYS  20  -0.564  15.931   0.796
  127    HD3  LYS  20           1HD      LYS  20   1.123  16.153   1.263
  128    HE2  LYS  20           2HE      LYS  20   1.015  16.754  -1.010
  129    HE3  LYS  20           1HE      LYS  20   1.729  15.142  -0.982
  130    HZ1  LYS  20           3HZ      LYS  20  -0.375  14.195  -1.590
  131    HZ2  LYS  20           1HZ      LYS  20   0.007  15.415  -2.700
  132    HZ3  LYS  20           2HZ      LYS  20  -1.143  15.700  -1.493
  133    H    ALA  21           H        ALA  21  -3.036  11.667   3.684
  134    HA   ALA  21           HA       ALA  21  -2.882  12.708   6.365
  135    HB1  ALA  21           1HB      ALA  21  -4.680  13.966   4.439
  136    HB2  ALA  21           2HB      ALA  21  -4.020  14.563   5.958
  137    HB3  ALA  21           3HB      ALA  21  -5.444  13.527   5.972
  138    H    LEU  22           H        LEU  22  -5.416  11.048   4.285
  139    HA   LEU  22           HA       LEU  22  -6.828   9.808   6.228
  140    HB2  LEU  22           2HB      LEU  22  -6.215   8.246   3.750
  141    HB3  LEU  22           1HB      LEU  22  -7.772   8.556   4.517
  142    HG   LEU  22           HG       LEU  22  -6.954  11.053   3.628
  143   HD11  LEU  22          1HD1      LEU  22  -6.463   9.001   1.526
  144   HD12  LEU  22          2HD1      LEU  22  -5.203   9.912   2.336
  145   HD13  LEU  22          3HD1      LEU  22  -6.409  10.734   1.344
  146   HD21  LEU  22          3HD2      LEU  22  -8.867   8.977   2.672
  147   HD22  LEU  22          1HD2      LEU  22  -8.632  10.471   1.762
  148   HD23  LEU  22          2HD2      LEU  22  -9.193  10.534   3.437
  149    H    HIS  23           H        HIS  23  -6.540   6.830   5.972
  150    HA   HIS  23           HA       HIS  23  -4.342   6.572   7.819
  151    HB2  HIS  23           2HB      HIS  23  -6.958   5.591   7.563
  152    HB3  HIS  23           1HB      HIS  23  -5.921   4.188   7.372
  153    HD1  HIS  23           1HD      HIS  23  -5.731   7.171   9.744
  154    HD2  HIS  23           2HD      HIS  23  -5.759   3.015   9.804
  155    HE1  HIS  23           1HE      HIS  23  -5.455   6.532  12.160
  156    HE2  HIS  23           2HE      HIS  23  -5.550   4.015  12.182
  157    H    PHE  24           H        PHE  24  -2.376   5.315   7.341
  158    HA   PHE  24           HA       PHE  24  -2.568   3.446   5.096
  159    HB2  PHE  24           2HB      PHE  24  -0.126   5.159   5.668
  160    HB3  PHE  24           1HB      PHE  24  -0.262   3.955   4.406
  161    HD1  PHE  24           2HD      PHE  24  -1.775   7.184   5.520
  162    HD2  PHE  24           1HD      PHE  24  -0.810   4.681   2.182
  163    HE1  PHE  24           2HE      PHE  24  -2.399   8.981   3.963
  164    HE2  PHE  24           1HE      PHE  24  -1.407   6.454   0.655
  165    HZ   PHE  24           HZ       PHE  24  -2.255   8.610   1.495
  166    H    TYR  25           H        TYR  25  -1.788   1.303   5.737
  167    HA   TYR  25           HA       TYR  25  -0.793   0.840   8.397
  168    HB2  TYR  25           2HB      TYR  25  -1.470  -1.049   6.110
  169    HB3  TYR  25           1HB      TYR  25  -0.941  -1.584   7.696
  170    HD1  TYR  25           1HD      TYR  25  -3.337   1.177   6.986
  171    HD2  TYR  25           2HD      TYR  25  -2.812  -2.798   8.402
  172    HE1  TYR  25           1HE      TYR  25  -5.672   1.147   7.747
  173    HE2  TYR  25           2HE      TYR  25  -5.148  -2.842   9.166
  174    HH   TYR  25           HH       TYR  25  -7.445  -0.839   8.171
  175    H    THR  26           H        THR  26   1.299  -0.512   8.745
  176    HA   THR  26           HA       THR  26   3.201   0.227   6.636
  177    HB   THR  26           HB       THR  26   4.689   0.722   8.263
  178    HG1  THR  26           1HG      THR  26   5.480  -1.096   8.964
  179   HG21  THR  26          3HG2      THR  26   3.898   1.336  10.377
  180   HG22  THR  26          1HG2      THR  26   2.598   0.142  10.329
  181   HG23  THR  26          2HG2      THR  26   2.536   1.558   9.278
  182    H    PHE  27           H        PHE  27   5.246  -1.321   6.609
  183    HA   PHE  27           HA       PHE  27   4.184  -3.719   5.589
  184    HB2  PHE  27           2HB      PHE  27   6.702  -2.254   5.373
  185    HB3  PHE  27           1HB      PHE  27   6.681  -3.908   4.817
  186    HD1  PHE  27           1HD      PHE  27   4.035  -1.337   4.642
  187    HD2  PHE  27           2HD      PHE  27   6.827  -3.718   2.508
  188    HE1  PHE  27           1HE      PHE  27   3.054  -0.598   2.548
  189    HE2  PHE  27           2HE      PHE  27   5.857  -3.021   0.424
  190    HZ   PHE  27           HZ       PHE  27   3.953  -1.431   0.393
  191    HA   PRO  28           HA       PRO  28   5.407  -7.232   8.137
  192    HB2  PRO  28           2HB      PRO  28   6.751  -7.886   5.482
  193    HB3  PRO  28           1HB      PRO  28   5.934  -9.013   6.563
  194    HG2  PRO  28           2HG      PRO  28   4.667  -8.089   4.504
  195    HG3  PRO  28           1HG      PRO  28   3.835  -8.118   6.063
  196    HD2  PRO  28           2HD      PRO  28   4.892  -5.868   4.496
  197    HD3  PRO  28           1HD      PRO  28   3.534  -5.946   5.619
  198    H    LYS  29           H        LYS  29   7.561  -8.465   8.672
  199    HA   LYS  29           HA       LYS  29   9.705  -6.510   8.871
  200    HB2  LYS  29           2HB      LYS  29  10.303  -9.126   9.997
  201    HB3  LYS  29           1HB      LYS  29  10.286  -7.550  10.771
  202    HG2  LYS  29           2HG      LYS  29   7.815  -7.745  10.978
  203    HG3  LYS  29           1HG      LYS  29   7.944  -9.390  10.349
  204    HD2  LYS  29           2HD      LYS  29   9.800  -9.427  12.340
  205    HD3  LYS  29           1HD      LYS  29   8.596  -8.322  13.008
  206    HE2  LYS  29           2HE      LYS  29   7.900 -10.423  13.745
  207    HE3  LYS  29           1HE      LYS  29   6.877 -10.102  12.346
  208    HZ1  LYS  29           3HZ      LYS  29   7.853 -11.726  11.141
  209    HZ2  LYS  29           1HZ      LYS  29   8.179 -12.373  12.671
  210    HZ3  LYS  29           2HZ      LYS  29   9.376 -11.512  11.844
  211    H    ASP  30           H        ASP  30   8.851  -9.178   6.945
  212    HA   ASP  30           HA       ASP  30  11.555  -9.904   6.203
  213    HB2  ASP  30           2HB      ASP  30   9.647 -10.904   4.318
  214    HB3  ASP  30           1HB      ASP  30  10.539 -11.813   5.529
  215    H    ALA  31           H        ALA  31  12.739  -8.607   4.876
  216    HA   ALA  31           HA       ALA  31  11.918  -6.406   3.570
  217    HB1  ALA  31           1HB      ALA  31  14.157  -6.518   3.681
  218    HB2  ALA  31           2HB      ALA  31  13.971  -6.970   1.994
  219    HB3  ALA  31           3HB      ALA  31  14.239  -8.214   3.220
  220    H    GLU  32           H        GLU  32  12.422  -9.464   1.606
  221    HA   GLU  32           HA       GLU  32  11.280  -8.441  -0.728
  222    HB2  GLU  32           2HB      GLU  32  12.450 -10.459  -0.894
  223    HB3  GLU  32           1HB      GLU  32  11.535 -11.284   0.303
  224    HG2  GLU  32           2HG      GLU  32  10.313 -10.370  -2.283
  225    HG3  GLU  32           1HG      GLU  32  11.171 -11.901  -2.146
  226    H    LEU  33           H        LEU  33   9.348 -10.587   1.548
  227    HA   LEU  33           HA       LEU  33   7.016 -10.340   0.244
  228    HB2  LEU  33           2HB      LEU  33   7.496 -11.227   2.644
  229    HB3  LEU  33           1HB      LEU  33   7.119  -9.611   3.162
  230    HG   LEU  33           HG       LEU  33   4.980 -10.091   3.195
  231   HD11  LEU  33          1HD1      LEU  33   3.740 -10.742   1.163
  232   HD12  LEU  33          2HD1      LEU  33   5.269 -10.955   0.323
  233   HD13  LEU  33          3HD1      LEU  33   4.795  -9.361   0.901
  234   HD21  LEU  33          3HD2      LEU  33   4.333 -12.496   2.423
  235   HD22  LEU  33          1HD2      LEU  33   5.280 -12.232   3.887
  236   HD23  LEU  33          2HD2      LEU  33   6.083 -12.709   2.391
  237    H    ARG  34           H        ARG  34   8.682  -7.875   1.983
  238    HA   ARG  34           HA       ARG  34   6.745  -5.852   1.980
  239    HB2  ARG  34           2HB      ARG  34   8.296  -4.673   3.105
  240    HB3  ARG  34           1HB      ARG  34   9.302  -6.097   2.998
  241    HG2  ARG  34           2HG      ARG  34  10.770  -4.574   2.227
  242    HG3  ARG  34           1HG      ARG  34   9.986  -4.926   0.698
  243    HD2  ARG  34           2HD      ARG  34   9.187  -2.862   0.527
  244    HD3  ARG  34           1HD      ARG  34   8.568  -2.887   2.177
  245    HE   ARG  34           HE       ARG  34  10.344  -1.596   2.757
  246   HH11  ARG  34          1HH1      ARG  34  11.246  -3.446  -0.064
  247   HH12  ARG  34          2HH1      ARG  34  12.813  -2.721  -0.193
  248   HH21  ARG  34          1HH2      ARG  34  12.404  -0.640   2.587
  249   HH22  ARG  34          2HH2      ARG  34  13.470  -1.128   1.313
  250    H    ARG  35           H        ARG  35   9.500  -6.287  -0.203
  251    HA   ARG  35           HA       ARG  35   8.785  -4.254  -1.936
  252    HB2  ARG  35           2HB      ARG  35  10.114  -5.384  -3.672
  253    HB3  ARG  35           1HB      ARG  35  10.964  -5.254  -2.146
  254    HG2  ARG  35           2HG      ARG  35  11.461  -7.380  -2.947
  255    HG3  ARG  35           1HG      ARG  35  10.249  -7.632  -1.707
  256    HD2  ARG  35           2HD      ARG  35   9.947  -8.968  -3.808
  257    HD3  ARG  35           1HD      ARG  35   8.554  -8.032  -3.309
  258    HE   ARG  35           HE       ARG  35   9.298  -6.361  -5.016
  259   HH11  ARG  35          1HH1      ARG  35  10.149  -9.742  -5.333
  260   HH12  ARG  35          2HH1      ARG  35  10.316  -9.657  -7.053
  261   HH21  ARG  35          1HH2      ARG  35   9.521  -6.264  -7.271
  262   HH22  ARG  35          2HH2      ARG  35   9.961  -7.691  -8.151
  263    H    LEU  36           H        LEU  36   7.575  -7.548  -1.587
  264    HA   LEU  36           HA       LEU  36   6.202  -7.618  -4.111
  265    HB2  LEU  36           2HB      LEU  36   5.574  -8.875  -1.453
  266    HB3  LEU  36           1HB      LEU  36   4.445  -8.999  -2.783
  267    HG   LEU  36           HG       LEU  36   7.297  -9.986  -2.794
  268   HD11  LEU  36          1HD1      LEU  36   6.013 -12.206  -3.074
  269   HD12  LEU  36          2HD1      LEU  36   4.651 -11.323  -2.385
  270   HD13  LEU  36          3HD1      LEU  36   6.145 -11.495  -1.464
  271   HD21  LEU  36          3HD2      LEU  36   5.196  -9.780  -4.899
  272   HD22  LEU  36          1HD2      LEU  36   6.305 -11.152  -4.916
  273   HD23  LEU  36          2HD2      LEU  36   6.936  -9.507  -5.010
  274    H    TRP  37           H        TRP  37   5.116  -6.271  -1.021
  275    HA   TRP  37           HA       TRP  37   2.620  -5.401  -1.930
  276    HB2  TRP  37           2HB      TRP  37   4.541  -4.406   0.175
  277    HB3  TRP  37           1HB      TRP  37   3.003  -3.600  -0.111
  278    HD1  TRP  37           HD       TRP  37   3.261  -7.407  -0.324
  279    HE1  TRP  37           1HE      TRP  37   1.939  -8.439   1.640
  280    HE3  TRP  37           3HE      TRP  37   2.196  -3.136   2.256
  281    HZ2  TRP  37           2HZ      TRP  37   0.534  -7.528   3.941
  282    HZ3  TRP  37           3HZ      TRP  37   0.866  -3.329   4.340
  283    HH2  TRP  37           HH       TRP  37   0.046  -5.415   5.126
  284    H    LEU  38           H        LEU  38   5.902  -3.880  -2.088
  285    HA   LEU  38           HA       LEU  38   5.471  -1.332  -2.955
  286    HB2  LEU  38           2HB      LEU  38   7.427  -3.415  -3.899
  287    HB3  LEU  38           1HB      LEU  38   7.420  -1.835  -4.590
  288    HG   LEU  38           HG       LEU  38   8.065  -0.810  -2.598
  289   HD11  LEU  38          1HD1      LEU  38   8.022  -1.684  -0.450
  290   HD12  LEU  38          2HD1      LEU  38   7.760  -3.323  -1.034
  291   HD13  LEU  38          3HD1      LEU  38   6.478  -2.126  -1.173
  292   HD21  LEU  38          3HD2      LEU  38   9.933  -2.608  -1.828
  293   HD22  LEU  38          1HD2      LEU  38  10.080  -1.505  -3.195
  294   HD23  LEU  38          2HD2      LEU  38   9.533  -3.163  -3.452
  295    H    LYS  39           H        LYS  39   5.292  -4.320  -5.030
  296    HA   LYS  39           HA       LYS  39   4.776  -3.089  -7.443
  297    HB2  LYS  39           2HB      LYS  39   4.450  -5.704  -6.146
  298    HB3  LYS  39           1HB      LYS  39   3.381  -5.470  -7.498
  299    HG2  LYS  39           2HG      LYS  39   5.752  -6.555  -7.738
  300    HG3  LYS  39           1HG      LYS  39   5.087  -5.527  -9.013
  301    HD2  LYS  39           2HD      LYS  39   6.531  -3.990  -7.013
  302    HD3  LYS  39           1HD      LYS  39   7.539  -5.242  -7.735
  303    HE2  LYS  39           2HE      LYS  39   5.960  -3.163  -9.242
  304    HE3  LYS  39           1HE      LYS  39   7.702  -3.142  -8.972
  305    HZ1  LYS  39           3HZ      LYS  39   8.046  -4.626 -10.590
  306    HZ2  LYS  39           1HZ      LYS  39   6.499  -4.204 -11.127
  307    HZ3  LYS  39           2HZ      LYS  39   6.714  -5.577 -10.164
  308    H    ASN  40           H        ASN  40   2.376  -4.330  -5.168
  309    HA   ASN  40           HA       ASN  40   0.101  -3.784  -6.580
  310    HB2  ASN  40           2HB      ASN  40  -0.144  -3.268  -3.691
  311    HB3  ASN  40           1HB      ASN  40  -1.047  -4.350  -4.727
  312   HD21  ASN  40          1HD2      ASN  40  -0.296  -5.083  -2.206
  313   HD22  ASN  40          2HD2      ASN  40   0.883  -6.342  -2.297
  314    H    VAL  41           H        VAL  41   2.069  -1.387  -4.920
  315    HA   VAL  41           HA       VAL  41  -0.166   0.363  -4.776
  316    HB   VAL  41           HB       VAL  41   1.176   0.718  -3.007
  317   HG11  VAL  41          1HG1      VAL  41   3.463   0.852  -4.926
  318   HG12  VAL  41          2HG1      VAL  41   3.083  -0.414  -3.761
  319   HG13  VAL  41          3HG1      VAL  41   3.580   1.183  -3.196
  320   HG21  VAL  41          3HG2      VAL  41   1.521   2.990  -3.035
  321   HG22  VAL  41          1HG2      VAL  41   0.435   2.780  -4.411
  322   HG23  VAL  41          2HG2      VAL  41   2.171   2.984  -4.674
  323    H    SER  42           H        SER  42   2.229   0.029  -7.305
  324    HA   SER  42           HA       SER  42   0.826   1.376  -9.164
  325    HB2  SER  42           2HB      SER  42   0.294   3.434  -8.250
  326    HB3  SER  42           1HB      SER  42   1.716   3.500  -7.192
  327    HG   SER  42           HG       SER  42   1.687   5.010  -9.004
  328    H    ARG  43           H        ARG  43   3.933   3.225  -8.642
  329    HA   ARG  43           HA       ARG  43   5.922   3.021  -9.697
  330    HB2  ARG  43           2HB      ARG  43   5.084   0.240 -10.531
  331    HB3  ARG  43           1HB      ARG  43   6.715   0.889 -10.484
  332    HG2  ARG  43           2HG      ARG  43   5.286   0.990  -7.927
  333    HG3  ARG  43           1HG      ARG  43   5.604  -0.634  -8.542
  334    HD2  ARG  43           2HD      ARG  43   7.705   1.513  -8.306
  335    HD3  ARG  43           1HD      ARG  43   7.393   0.308  -7.057
  336    HE   ARG  43           HE       ARG  43   7.798  -1.204  -9.249
  337   HH11  ARG  43          1HH1      ARG  43   9.626   1.406  -7.823
  338   HH12  ARG  43          2HH1      ARG  43  11.153   0.803  -8.374
  339   HH21  ARG  43          1HH2      ARG  43   9.803  -2.000  -9.972
  340   HH22  ARG  43          2HH2      ARG  43  11.254  -1.132  -9.595
  341    H    ALA  44           H        ALA  44   3.598   1.187 -11.703
  342    HA   ALA  44           HA       ALA  44   4.554   2.133 -14.177
  343    HB1  ALA  44           1HB      ALA  44   2.774   0.977 -15.137
  344    HB2  ALA  44           2HB      ALA  44   1.702   1.283 -13.768
  345    HB3  ALA  44           3HB      ALA  44   3.022   0.123 -13.613
  346    H    GLY  45           H        GLY  45   4.671   4.627 -13.356
  347    HA2  GLY  45           2HA      GLY  45   2.275   6.069 -13.061
  348    HA3  GLY  45           1HA      GLY  45   3.830   6.737 -13.518
  349    H    VAL  46           H        VAL  46   3.641   4.685 -15.867
  350    HA   VAL  46           HA       VAL  46   3.091   4.782 -18.070
  351    HB   VAL  46           HB       VAL  46   0.635   6.370 -17.773
  352   HG11  VAL  46          1HG1      VAL  46   1.529   3.838 -19.054
  353   HG12  VAL  46          2HG1      VAL  46   0.772   5.261 -19.772
  354   HG13  VAL  46          3HG1      VAL  46  -0.195   4.128 -18.827
  355   HG21  VAL  46          3HG2      VAL  46  -0.516   4.303 -16.725
  356   HG22  VAL  46          1HG2      VAL  46   0.307   5.450 -15.667
  357   HG23  VAL  46          2HG2      VAL  46   1.090   3.929 -16.100
  358    H    SER  47           H        SER  47   4.527   7.024 -16.748
  359    HA   SER  47           HA       SER  47   4.743   8.732 -19.008
  360    HB2  SER  47           2HB      SER  47   3.536  10.616 -18.419
  361    HB3  SER  47           1HB      SER  47   2.489   9.378 -17.723
  362    HG   SER  47           HG       SER  47   3.532  11.399 -16.474
  363    H    GLY  48           H        GLY  48   4.974   9.137 -15.282
  364    HA2  GLY  48           2HA      GLY  48   7.745  10.024 -15.790
  365    HA3  GLY  48           1HA      GLY  48   6.789  10.415 -14.368
  366    H    CYS  49           H        CYS  49   9.351   8.689 -15.332
  367    HA   CYS  49           HA       CYS  49   9.007   6.751 -13.153
  368    HB2  CYS  49           2HB      CYS  49  10.017   4.984 -14.463
  369    HB3  CYS  49           1HB      CYS  49   8.635   5.626 -15.342
  370    HG   CYS  49           HG       CYS  49  10.988   5.258 -16.746
  371    H    PHE  50           H        PHE  50  11.531   5.529 -13.427
  372    HA   PHE  50           HA       PHE  50  13.767   5.773 -13.002
  373    HB2  PHE  50           2HB      PHE  50  13.310   7.830 -14.735
  374    HB3  PHE  50           1HB      PHE  50  13.820   8.729 -13.312
  375    HD1  PHE  50           1HD      PHE  50  14.840   5.765 -15.331
  376    HD2  PHE  50           2HD      PHE  50  16.061   9.121 -13.016
  377    HE1  PHE  50           1HE      PHE  50  17.191   5.279 -15.874
  378    HE2  PHE  50           2HE      PHE  50  18.413   8.642 -13.556
  379    HZ   PHE  50           HZ       PHE  50  18.981   6.719 -14.987
  380    H    SER  51           H        SER  51  12.149   8.869 -11.824
  381    HA   SER  51           HA       SER  51  13.336   8.271  -9.195
  382    HB2  SER  51           2HB      SER  51  13.820  10.486 -10.414
  383    HB3  SER  51           1HB      SER  51  12.155  10.919 -10.024
  384    HG   SER  51           HG       SER  51  12.804  10.350  -7.779
  385    H    THR  52           H        THR  52  11.178   6.755  -9.753
  386    HA   THR  52           HA       THR  52   8.673   7.848  -9.101
  387    HB   THR  52           HB       THR  52   7.866   5.664  -9.111
  388    HG1  THR  52           1HG      THR  52   8.713   4.356  -7.732
  389   HG21  THR  52          3HG2      THR  52  10.220   4.602 -10.436
  390   HG22  THR  52          1HG2      THR  52   9.765   6.195 -11.045
  391   HG23  THR  52          2HG2      THR  52   8.594   4.875 -11.064
  392    H    PHE  53           H        PHE  53   7.453   6.788  -7.011
  393    HA   PHE  53           HA       PHE  53   8.898   7.864  -4.734
  394    HB2  PHE  53           2HB      PHE  53   6.671   7.354  -3.567
  395    HB3  PHE  53           1HB      PHE  53   6.658   8.600  -4.809
  396    HD1  PHE  53           1HD      PHE  53   6.280   4.855  -4.682
  397    HD2  PHE  53           2HD      PHE  53   4.844   8.592  -6.162
  398    HE1  PHE  53           1HE      PHE  53   4.475   3.695  -5.880
  399    HE2  PHE  53           2HE      PHE  53   3.038   7.427  -7.356
  400    HZ   PHE  53           HZ       PHE  53   2.855   4.979  -7.216
  401    H    GLN  54           H        GLN  54  10.015   5.472  -5.710
  402    HA   GLN  54           HA       GLN  54   9.614   3.051  -5.084
  403    HB2  GLN  54           2HB      GLN  54  11.879   4.166  -5.311
  404    HB3  GLN  54           1HB      GLN  54  11.884   4.299  -3.561
  405    HG2  GLN  54           2HG      GLN  54  11.611   1.817  -3.463
  406    HG3  GLN  54           1HG      GLN  54  11.832   1.785  -5.213
  407   HE21  GLN  54          1HE2      GLN  54  13.791   3.876  -5.300
  408   HE22  GLN  54          2HE2      GLN  54  15.251   3.230  -4.643
  409    HA   PRO  55           HA       PRO  55   7.384   3.026  -1.160
  410    HB2  PRO  55           2HB      PRO  55   7.537   0.113  -1.516
  411    HB3  PRO  55           1HB      PRO  55   6.124   1.126  -1.281
  412    HG2  PRO  55           2HG      PRO  55   6.626   0.073  -3.667
  413    HG3  PRO  55           1HG      PRO  55   6.002   1.728  -3.520
  414    HD2  PRO  55           2HD      PRO  55   8.803   0.790  -4.034
  415    HD3  PRO  55           1HD      PRO  55   7.901   2.124  -4.798
  416    H    THR  56           H        THR  56  10.430   1.618  -1.847
  417    HA   THR  56           HA       THR  56  11.061   0.270   0.511
  418    HB   THR  56           HB       THR  56  13.427   1.008   0.022
  419    HG1  THR  56           1HG      THR  56  12.960   3.040  -0.883
  420   HG21  THR  56          3HG2      THR  56  12.321  -0.949  -1.123
  421   HG22  THR  56          1HG2      THR  56  13.704  -0.234  -1.952
  422   HG23  THR  56          2HG2      THR  56  12.068   0.123  -2.500
  423    H    THR  57           H        THR  57  11.258   3.854  -0.220
  424    HA   THR  57           HA       THR  57  12.480   4.728   2.071
  425    HB   THR  57           HB       THR  57  11.997   6.309   0.379
  426    HG1  THR  57           1HG      THR  57  11.828   7.581   2.049
  427   HG21  THR  57          3HG2      THR  57   9.118   6.543   0.687
  428   HG22  THR  57          1HG2      THR  57   9.621   5.005  -0.012
  429   HG23  THR  57          2HG2      THR  57  10.109   6.519  -0.770
  430    H    GLY  58           H        GLY  58   8.940   4.315   1.662
  431    HA2  GLY  58           2HA      GLY  58   8.483   3.201   4.168
  432    HA3  GLY  58           1HA      GLY  58   8.376   4.939   4.371
  433    H    HIS  59           H        HIS  59   7.200   2.593   1.907
  434    HA   HIS  59           HA       HIS  59   4.704   4.067   1.731
  435    HB2  HIS  59           2HB      HIS  59   6.133   2.082   0.114
  436    HB3  HIS  59           1HB      HIS  59   4.405   1.861   0.120
  437    HD1  HIS  59           1HD      HIS  59   6.389   5.094  -0.114
  438    HD2  HIS  59           2HD      HIS  59   3.544   2.863  -2.184
  439    HE1  HIS  59           1HE      HIS  59   5.766   6.493  -2.121
  440    HE2  HIS  59           2HE      HIS  59   4.018   5.137  -3.330
  441    H    ARG  60           H        ARG  60   2.636   3.081   2.094
  442    HA   ARG  60           HA       ARG  60   2.569   0.714   3.873
  443    HB2  ARG  60           2HB      ARG  60   0.782   2.406   5.089
  444    HB3  ARG  60           1HB      ARG  60   2.442   2.156   5.587
  445    HG2  ARG  60           2HG      ARG  60   1.731   4.285   3.617
  446    HG3  ARG  60           1HG      ARG  60   1.609   4.550   5.356
  447    HD2  ARG  60           2HD      ARG  60   4.111   3.362   4.911
  448    HD3  ARG  60           1HD      ARG  60   3.921   4.596   3.670
  449    HE   ARG  60           HE       ARG  60   4.076   6.213   5.292
  450   HH11  ARG  60          1HH1      ARG  60   3.578   3.111   6.817
  451   HH12  ARG  60          2HH1      ARG  60   3.854   3.715   8.416
  452   HH21  ARG  60          1HH2      ARG  60   4.437   7.005   7.393
  453   HH22  ARG  60          2HH2      ARG  60   4.341   5.924   8.742
  454    H    LEU  61           H        LEU  61   0.040   0.057   4.239
  455    HA   LEU  61           HA       LEU  61  -1.359   0.522   1.679
  456    HB2  LEU  61           2HB      LEU  61  -0.926  -1.924   3.057
  457    HB3  LEU  61           1HB      LEU  61  -2.614  -1.639   3.095
  458    HG   LEU  61           HG       LEU  61  -2.868  -2.306   0.984
  459   HD11  LEU  61          1HD1      LEU  61  -1.888  -0.128   0.272
  460   HD12  LEU  61          2HD1      LEU  61  -1.727  -1.460  -0.867
  461   HD13  LEU  61          3HD1      LEU  61  -0.351  -0.969   0.116
  462   HD21  LEU  61          3HD2      LEU  61  -1.583  -4.067   0.507
  463   HD22  LEU  61          1HD2      LEU  61  -0.702  -3.664   1.974
  464   HD23  LEU  61          2HD2      LEU  61  -0.127  -3.093   0.414
  465    H    CYS  62           H        CYS  62  -3.920   0.644   1.947
  466    HA   CYS  62           HA       CYS  62  -4.517   1.666   4.635
  467    HB2  CYS  62           2HB      CYS  62  -4.628   3.769   3.883
  468    HB3  CYS  62           1HB      CYS  62  -3.783   3.143   2.504
  469    H    SER  63           H        SER  63  -6.848   2.603   4.661
  470    HA   SER  63           HA       SER  63  -8.777   1.226   5.281
  471    HB2  SER  63           2HB      SER  63  -8.763   3.669   3.600
  472    HB3  SER  63           1HB      SER  63 -10.238   2.739   3.418
  473    HG   SER  63           HG       SER  63 -10.826   3.463   5.280
  474    H    VAL  64           H        VAL  64  -8.541   1.521   1.742
  475    HA   VAL  64           HA       VAL  64 -10.426  -0.711   1.654
  476    HB   VAL  64           HB       VAL  64  -9.768   0.649  -0.876
  477   HG11  VAL  64          1HG1      VAL  64 -11.553  -1.153  -0.334
  478   HG12  VAL  64          2HG1      VAL  64 -11.979   0.215  -1.364
  479   HG13  VAL  64          3HG1      VAL  64 -12.451   0.210   0.334
  480   HG21  VAL  64          3HG2      VAL  64 -11.190   2.554  -0.322
  481   HG22  VAL  64          1HG2      VAL  64  -9.767   2.505   0.715
  482   HG23  VAL  64          2HG2      VAL  64 -11.325   1.976   1.337
  483    H    HIS  65           H        HIS  65  -7.772  -1.513   2.180
  484    HA   HIS  65           HA       HIS  65  -7.407  -3.181  -0.218
  485    HB2  HIS  65           2HB      HIS  65  -5.040  -2.396   1.465
  486    HB3  HIS  65           1HB      HIS  65  -5.059  -3.071  -0.161
  487    HD1  HIS  65           1HD      HIS  65  -4.410  -1.364  -1.846
  488    HD2  HIS  65           2HD      HIS  65  -6.407   0.268   1.359
  489    HE1  HIS  65           1HE      HIS  65  -4.489   1.097  -2.293
  490    H    PHE  66           H        PHE  66  -9.002  -3.871   2.046
  491    HA   PHE  66           HA       PHE  66  -7.504  -6.217   2.848
  492    HB2  PHE  66           2HB      PHE  66  -8.404  -4.074   4.743
  493    HB3  PHE  66           1HB      PHE  66  -8.300  -5.735   5.307
  494    HD1  PHE  66           1HD      PHE  66  -6.015  -6.919   4.534
  495    HD2  PHE  66           2HD      PHE  66  -6.603  -2.751   5.154
  496    HE1  PHE  66           1HE      PHE  66  -3.609  -6.648   4.926
  497    HE2  PHE  66           2HE      PHE  66  -4.198  -2.460   5.549
  498    HZ   PHE  66           HZ       PHE  66  -2.684  -4.439   5.435
  499    H    GLN  67           H        GLN  67  -9.019  -7.910   4.056
  500    HA   GLN  67           HA       GLN  67 -11.757  -7.540   3.130
  501    HB2  GLN  67           2HB      GLN  67  -9.994  -9.704   2.884
  502    HB3  GLN  67           1HB      GLN  67 -11.107 -10.200   4.149
  503    HG2  GLN  67           2HG      GLN  67 -12.209 -10.980   2.322
  504    HG3  GLN  67           1HG      GLN  67 -12.917  -9.370   2.440
  505   HE21  GLN  67          1HE2      GLN  67 -12.099 -11.425   0.237
  506   HE22  GLN  67          2HE2      GLN  67 -11.403 -10.412  -0.976
  507    H    GLY  68           H        GLY  68 -13.550  -7.978   4.942
  508    HA2  GLY  68           2HA      GLY  68 -14.212  -7.547   7.102
  509    HA3  GLY  68           1HA      GLY  68 -13.287  -9.004   7.391
  510    H    GLY  69           H        GLY  69 -10.801  -8.549   7.785
  511    HA2  GLY  69           2HA      GLY  69  -9.597  -6.244   8.408
  512    HA3  GLY  69           1HA      GLY  69 -10.657  -6.455   9.792
  513    H    ARG  70           H        ARG  70  -7.635  -6.547   9.345
  514    HA   ARG  70           HA       ARG  70  -6.022  -7.471  10.695
  515    HB2  ARG  70           2HB      ARG  70  -6.504  -8.965  12.302
  516    HB3  ARG  70           1HB      ARG  70  -8.170  -8.707  11.821
  517    HG2  ARG  70           2HG      ARG  70  -7.751 -10.668  10.181
  518    HG3  ARG  70           1HG      ARG  70  -6.358 -11.009  11.214
  519    HD2  ARG  70           2HD      ARG  70  -7.858 -12.254  12.344
  520    HD3  ARG  70           1HD      ARG  70  -8.251 -10.709  13.093
  521    HE   ARG  70           HE       ARG  70  -9.818 -12.123  11.066
  522   HH11  ARG  70          1HH1      ARG  70  -9.466  -9.364  13.187
  523   HH12  ARG  70          2HH1      ARG  70 -11.128  -8.899  13.052
  524   HH21  ARG  70          1HH2      ARG  70 -11.994 -11.502  10.889
  525   HH22  ARG  70          2HH2      ARG  70 -12.561 -10.108  11.749
  526    H    LYS  71           H        LYS  71  -7.603  -8.979   8.039
  527    HA   LYS  71           HA       LYS  71  -6.895 -10.399   6.405
  528    HB2  LYS  71           2HB      LYS  71  -5.594  -8.887   5.372
  529    HB3  LYS  71           1HB      LYS  71  -4.880  -8.346   6.871
  530    HG2  LYS  71           2HG      LYS  71  -3.606 -10.745   6.471
  531    HG3  LYS  71           1HG      LYS  71  -3.845 -10.164   4.831
  532    HD2  LYS  71           2HD      LYS  71  -1.680  -9.486   5.909
  533    HD3  LYS  71           1HD      LYS  71  -2.643  -8.159   5.268
  534    HE2  LYS  71           2HE      LYS  71  -3.481  -8.479   7.932
  535    HE3  LYS  71           1HE      LYS  71  -1.720  -8.634   7.954
  536    HZ1  LYS  71           3HZ      LYS  71  -3.375  -6.332   7.241
  537    HZ2  LYS  71           1HZ      LYS  71  -1.907  -6.527   6.421
  538    HZ3  LYS  71           2HZ      LYS  71  -1.924  -6.392   8.108
  539    H    THR  72           H        THR  72  -6.992 -12.478   7.017
  540    HA   THR  72           HA       THR  72  -4.575 -13.655   8.212
  541    HB   THR  72           HB       THR  72  -6.311 -13.404   9.956
  542    HG1  THR  72           1HG      THR  72  -5.363 -15.140  10.617
  543   HG21  THR  72          3HG2      THR  72  -8.107 -14.173   7.982
  544   HG22  THR  72          1HG2      THR  72  -8.441 -13.939   9.698
  545   HG23  THR  72          2HG2      THR  72  -8.030 -15.543   9.091
  546    H    TYR  73           H        TYR  73  -3.765 -15.170   6.934
  547    HA   TYR  73           HA       TYR  73  -3.544 -16.711   5.290
  548    HB2  TYR  73           2HB      TYR  73  -5.139 -17.814   7.104
  549    HB3  TYR  73           1HB      TYR  73  -6.308 -17.739   5.792
  550    HD1  TYR  73           2HD      TYR  73  -2.738 -18.753   6.276
  551    HD2  TYR  73           1HD      TYR  73  -6.501 -19.637   4.498
  552    HE1  TYR  73           2HE      TYR  73  -1.802 -20.827   5.343
  553    HE2  TYR  73           1HE      TYR  73  -5.575 -21.715   3.561
  554    HH   TYR  73           HH       TYR  73  -2.446 -22.344   3.215
  555    H    THR  74           H        THR  74  -4.866 -17.701   3.216
  556    HA   THR  74           HA       THR  74  -5.629 -17.154   1.152
  557    HB   THR  74           HB       THR  74  -7.870 -15.624   1.469
  558    HG1  THR  74           1HG      THR  74  -8.321 -15.521   3.500
  559   HG21  THR  74          3HG2      THR  74  -8.811 -18.109   2.140
  560   HG22  THR  74          1HG2      THR  74  -7.305 -18.466   1.293
  561   HG23  THR  74          2HG2      THR  74  -8.554 -17.502   0.506
  562    H    VAL  75           H        VAL  75  -6.262 -14.156   3.035
  563    HA   VAL  75           HA       VAL  75  -5.445 -12.503   0.813
  564    HB   VAL  75           HB       VAL  75  -7.310 -11.921   2.360
  565   HG11  VAL  75          1HG1      VAL  75  -5.561 -12.707   4.340
  566   HG12  VAL  75          2HG1      VAL  75  -7.144 -11.966   4.565
  567   HG13  VAL  75          3HG1      VAL  75  -5.692 -10.963   4.559
  568   HG21  VAL  75          3HG2      VAL  75  -5.101  -9.861   2.563
  569   HG22  VAL  75          1HG2      VAL  75  -6.828  -9.584   2.741
  570   HG23  VAL  75          2HG2      VAL  75  -6.181 -10.061   1.177
  571    H    ARG  76           H        ARG  76  -3.172 -12.954   0.486
  572    HA   ARG  76           HA       ARG  76  -1.402 -12.662   2.773
  573    HB2  ARG  76           2HB      ARG  76  -1.218 -13.761   0.066
  574    HB3  ARG  76           1HB      ARG  76   0.204 -12.853   0.536
  575    HG2  ARG  76           2HG      ARG  76   0.236 -14.246   2.646
  576    HG3  ARG  76           1HG      ARG  76  -0.979 -15.265   1.871
  577    HD2  ARG  76           2HD      ARG  76   1.436 -14.653   0.280
  578    HD3  ARG  76           1HD      ARG  76   1.665 -15.699   1.682
  579    HE   ARG  76           HE       ARG  76  -0.525 -16.467  -0.023
  580   HH11  ARG  76          1HH1      ARG  76   2.897 -16.785   0.589
  581   HH12  ARG  76          2HH1      ARG  76   3.029 -18.307  -0.227
  582   HH21  ARG  76          1HH2      ARG  76  -0.353 -18.471  -1.096
  583   HH22  ARG  76          2HH2      ARG  76   1.185 -19.263  -1.184
  584    H    VAL  77           H        VAL  77  -1.631 -11.151  -0.455
  585    HA   VAL  77           HA       VAL  77  -0.447  -8.712   0.684
  586    HB   VAL  77           HB       VAL  77   0.399  -8.148  -1.460
  587   HG11  VAL  77          1HG1      VAL  77   1.634 -10.039  -2.216
  588   HG12  VAL  77          2HG1      VAL  77   0.467 -11.156  -1.508
  589   HG13  VAL  77          3HG1      VAL  77   1.479 -10.159  -0.464
  590   HG21  VAL  77          3HG2      VAL  77  -0.381  -9.681  -3.456
  591   HG22  VAL  77          1HG2      VAL  77  -1.275  -8.238  -2.985
  592   HG23  VAL  77          2HG2      VAL  77  -1.831  -9.830  -2.463
  593    HA   PRO  78           HA       PRO  78  -4.618  -7.062   0.668
  594    HB2  PRO  78           2HB      PRO  78  -3.137  -4.497   0.538
  595    HB3  PRO  78           1HB      PRO  78  -4.439  -4.988   1.601
  596    HG2  PRO  78           2HG      PRO  78  -2.020  -4.923   2.579
  597    HG3  PRO  78           1HG      PRO  78  -3.010  -6.366   2.892
  598    HD2  PRO  78           2HD      PRO  78  -0.893  -5.952   0.798
  599    HD3  PRO  78           1HD      PRO  78  -1.067  -7.300   1.959
  600    H    THR  79           H        THR  79  -4.327  -7.904  -1.872
  601    HA   THR  79           HA       THR  79  -4.899  -5.327  -3.159
  602    HB   THR  79           HB       THR  79  -4.499  -7.111  -5.254
  603    HG1  THR  79           1HG      THR  79  -3.618  -8.681  -3.981
  604   HG21  THR  79          3HG2      THR  79  -2.022  -6.064  -5.013
  605   HG22  THR  79          1HG2      THR  79  -2.972  -4.915  -4.069
  606   HG23  THR  79          2HG2      THR  79  -3.395  -5.240  -5.751
  607    H    ILE  80           H        ILE  80  -6.936  -5.095  -3.045
  608    HA   ILE  80           HA       ILE  80  -8.669  -7.190  -4.223
  609    HB   ILE  80           HB       ILE  80  -9.354  -5.262  -1.986
  610   HG12  ILE  80          2HG1      ILE  80  -8.134  -7.538  -1.583
  611   HG13  ILE  80          1HG1      ILE  80  -9.497  -7.092  -0.562
  612   HG21  ILE  80          1HG2      ILE  80 -11.065  -6.664  -3.920
  613   HG22  ILE  80          2HG2      ILE  80 -11.381  -5.222  -2.955
  614   HG23  ILE  80          3HG2      ILE  80 -11.553  -6.822  -2.233
  615   HD11  ILE  80          3HD1      ILE  80  -9.405  -9.477  -1.427
  616   HD12  ILE  80          1HD1      ILE  80  -9.838  -8.802  -2.998
  617   HD13  ILE  80          2HD1      ILE  80 -10.926  -8.605  -1.623
  618    H    PHE  81           H        PHE  81  -8.654  -6.243  -6.349
  619    HA   PHE  81           HA       PHE  81 -10.282  -3.921  -6.638
  620    HB2  PHE  81           2HB      PHE  81  -7.680  -3.281  -7.892
  621    HB3  PHE  81           1HB      PHE  81  -8.825  -2.226  -7.084
  622    HD1  PHE  81           1HD      PHE  81  -8.828  -2.361  -4.458
  623    HD2  PHE  81           2HD      PHE  81  -5.615  -3.692  -6.919
  624    HE1  PHE  81           1HE      PHE  81  -7.316  -2.257  -2.525
  625    HE2  PHE  81           2HE      PHE  81  -4.076  -3.554  -4.995
  626    HZ   PHE  81           HZ       PHE  81  -4.955  -2.898  -2.746
  Start of MODEL    8
    1    H1   GLY   1           1HT      GLY   1   7.581  20.725  -0.805
    2    H2   GLY   1           2HT      GLY   1   8.473  21.010  -2.213
    3    H3   GLY   1           3HT      GLY   1   8.603  19.524  -1.417
    4    HA2  GLY   1           1HA      GLY   1   5.909  20.228  -2.180
    5    HA3  GLY   1           2HA      GLY   1   7.008  19.998  -3.532
    6    H    SER   2           H        SER   2   6.024  18.444  -0.479
    7    HA   SER   2           HA       SER   2   7.009  15.901  -1.005
    8    HB2  SER   2           2HB      SER   2   5.602  17.047   1.048
    9    HB3  SER   2           1HB      SER   2   4.413  15.929   0.382
   10    HG   SER   2           HG       SER   2   7.067  15.166   1.010
   11    HA   PRO   3           HA       PRO   3   4.234  14.706  -4.281
   12    HB2  PRO   3           2HB      PRO   3   5.384  12.389  -4.932
   13    HB3  PRO   3           1HB      PRO   3   6.186  13.934  -5.243
   14    HG2  PRO   3           2HG      PRO   3   6.684  11.938  -3.084
   15    HG3  PRO   3           1HG      PRO   3   7.840  12.943  -3.974
   16    HD2  PRO   3           2HD      PRO   3   6.827  13.479  -1.425
   17    HD3  PRO   3           1HD      PRO   3   7.645  14.644  -2.482
   18    H    GLY   4           H        GLY   4   3.650  13.924  -1.338
   19    HA2  GLY   4           2HA      GLY   4   2.292  12.437  -0.203
   20    HA3  GLY   4           1HA      GLY   4   1.369  12.514  -1.696
   21    H    PHE   5           H        PHE   5   0.753  10.115  -1.186
   22    HA   PHE   5           HA       PHE   5   1.789   8.289  -2.723
   23    HB2  PHE   5           2HB      PHE   5   3.429   6.978  -1.706
   24    HB3  PHE   5           1HB      PHE   5   4.029   8.627  -1.702
   25    HD1  PHE   5           1HD      PHE   5   4.030   9.928   0.405
   26    HD2  PHE   5           2HD      PHE   5   3.058   5.798   0.273
   27    HE1  PHE   5           1HE      PHE   5   4.430   9.772   2.831
   28    HE2  PHE   5           2HE      PHE   5   3.464   5.625   2.700
   29    HZ   PHE   5           HZ       PHE   5   4.144   7.613   3.982
   30    H    THR   6           H        THR   6  -0.349   9.186  -0.958
   31    HA   THR   6           HA       THR   6  -1.237   7.379   0.903
   32    HB   THR   6           HB       THR   6  -2.409   9.397  -0.903
   33    HG1  THR   6           1HG      THR   6  -1.832  10.365   0.841
   34   HG21  THR   6          3HG2      THR   6  -4.442   8.703   0.926
   35   HG22  THR   6          1HG2      THR   6  -4.076   7.271  -0.029
   36   HG23  THR   6          2HG2      THR   6  -4.527   8.775  -0.822
   37    H    CYS   7           H        CYS   7  -0.165   5.500  -0.487
   38    HA   CYS   7           HA       CYS   7  -0.489   3.554  -1.665
   39    HB2  CYS   7           2HB      CYS   7  -1.933   3.123   0.276
   40    HB3  CYS   7           1HB      CYS   7  -3.246   3.994  -0.500
   41    H    CYS   8           H        CYS   8  -0.224   4.553  -3.794
   42    HA   CYS   8           HA       CYS   8  -1.994   5.912  -5.314
   43    HB2  CYS   8           2HB      CYS   8   0.157   5.277  -6.195
   44    HB3  CYS   8           1HB      CYS   8  -0.301   3.579  -6.192
   45    HG   CYS   8           HG       CYS   8  -2.216   4.714  -8.014
   46    H    VAL   9           H        VAL   9  -3.935   5.235  -4.289
   47    HA   VAL   9           HA       VAL   9  -5.135   2.721  -4.702
   48    HB   VAL   9           HB       VAL   9  -6.122   5.364  -3.687
   49   HG11  VAL   9          1HG1      VAL   9  -7.966   3.314  -3.041
   50   HG12  VAL   9          2HG1      VAL   9  -7.801   3.381  -4.788
   51   HG13  VAL   9          3HG1      VAL   9  -8.254   4.827  -3.893
   52   HG21  VAL   9          3HG2      VAL   9  -4.996   2.954  -2.582
   53   HG22  VAL   9          1HG2      VAL   9  -6.481   3.470  -1.789
   54   HG23  VAL   9          2HG2      VAL   9  -5.115   4.574  -1.907
   55    HA   PRO  10           HA       PRO  10  -6.750   3.771  -8.789
   56    HB2  PRO  10           2HB      PRO  10  -7.229   1.256  -9.573
   57    HB3  PRO  10           1HB      PRO  10  -5.576   1.889  -9.538
   58    HG2  PRO  10           2HG      PRO  10  -6.984   0.166  -7.534
   59    HG3  PRO  10           1HG      PRO  10  -5.344  -0.004  -8.190
   60    HD2  PRO  10           2HD      PRO  10  -5.876   1.145  -5.767
   61    HD3  PRO  10           1HD      PRO  10  -4.482   1.586  -6.773
   62    H    GLY  11           H        GLY  11  -7.985   2.062  -6.033
   63    HA2  GLY  11           2HA      GLY  11 -10.622   3.061  -6.468
   64    HA3  GLY  11           1HA      GLY  11 -10.531   1.340  -6.769
   65    H    CYS  12           H        CYS  12  -8.327   1.605  -4.330
   66    HA   CYS  12           HA       CYS  12 -10.277   0.700  -2.457
   67    HB2  CYS  12           2HB      CYS  12  -8.237   0.743  -0.822
   68    HB3  CYS  12           1HB      CYS  12  -8.388  -0.485  -2.052
   69    H    TYR  13           H        TYR  13  -8.508   2.138  -0.197
   70    HA   TYR  13           HA       TYR  13 -10.544   3.841   0.609
   71    HB2  TYR  13           2HB      TYR  13  -8.496   2.736   1.879
   72    HB3  TYR  13           1HB      TYR  13  -7.848   4.349   1.709
   73    HD1  TYR  13           2HD      TYR  13 -11.465   3.741   2.082
   74    HD2  TYR  13           1HD      TYR  13  -7.868   4.812   4.089
   75    HE1  TYR  13           2HE      TYR  13 -12.771   4.478   4.027
   76    HE2  TYR  13           1HE      TYR  13  -9.167   5.552   6.033
   77    HH   TYR  13           HH       TYR  13 -11.406   6.286   6.584
   78    H    ASN  14           H        ASN  14  -7.429   5.303   0.567
   79    HA   ASN  14           HA       ASN  14  -8.290   7.501  -1.159
   80    HB2  ASN  14           2HB      ASN  14  -6.883   8.943   0.419
   81    HB3  ASN  14           1HB      ASN  14  -8.365   8.318   1.064
   82   HD21  ASN  14          1HD2      ASN  14  -8.266   6.129   2.027
   83   HD22  ASN  14          2HD2      ASN  14  -6.925   5.707   3.022
   84    H    ASN  15           H        ASN  15  -6.326   8.422  -2.457
   85    HA   ASN  15           HA       ASN  15  -4.364   6.290  -2.643
   86    HB2  ASN  15           2HB      ASN  15  -4.106   7.455  -5.085
   87    HB3  ASN  15           1HB      ASN  15  -5.299   6.221  -4.745
   88   HD21  ASN  15          1HD2      ASN  15  -5.155   8.592  -6.602
   89   HD22  ASN  15          2HD2      ASN  15  -6.660   9.405  -6.353
   90    H    SER  16           H        SER  16  -2.043   6.802  -3.524
   91    HA   SER  16           HA       SER  16  -0.690   8.333  -2.040
   92    HB2  SER  16           2HB      SER  16   0.666   6.891  -3.316
   93    HB3  SER  16           1HB      SER  16  -0.270   7.161  -4.746
   94    HG   SER  16           HG       SER  16   1.681   8.122  -5.080
   95    H    HIS  17           H        HIS  17   0.807  10.265  -3.146
   96    HA   HIS  17           HA       HIS  17   0.497  12.619  -3.168
   97    HB2  HIS  17           2HB      HIS  17   0.968  13.194  -5.436
   98    HB3  HIS  17           1HB      HIS  17   1.714  11.632  -5.114
   99    HD1  HIS  17           1HD      HIS  17  -0.574  13.321  -7.398
  100    HD2  HIS  17           2HD      HIS  17   0.224   9.403  -6.267
  101    HE1  HIS  17           1HE      HIS  17  -1.616  11.882  -9.178
  102    HE2  HIS  17           2HE      HIS  17  -1.050   9.518  -8.514
  103    H    ARG  18           H        ARG  18  -1.959  12.188  -2.199
  104    HA   ARG  18           HA       ARG  18  -3.560  13.970  -3.784
  105    HB2  ARG  18           2HB      ARG  18  -3.739  11.445  -4.602
  106    HB3  ARG  18           1HB      ARG  18  -4.950  11.391  -3.315
  107    HG2  ARG  18           2HG      ARG  18  -6.415  12.349  -4.643
  108    HG3  ARG  18           1HG      ARG  18  -5.341  13.729  -4.901
  109    HD2  ARG  18           2HD      ARG  18  -4.127  11.851  -6.431
  110    HD3  ARG  18           1HD      ARG  18  -5.820  11.364  -6.592
  111    HE   ARG  18           HE       ARG  18  -5.407  14.173  -7.014
  112   HH11  ARG  18          1HH1      ARG  18  -5.341  11.025  -8.522
  113   HH12  ARG  18          2HH1      ARG  18  -5.598  11.647 -10.118
  114   HH21  ARG  18          1HH2      ARG  18  -5.747  14.991  -9.113
  115   HH22  ARG  18          2HH2      ARG  18  -5.829  13.897 -10.454
  116    H    ASP  19           H        ASP  19  -3.512  11.858  -0.866
  117    HA   ASP  19           HA       ASP  19  -5.113  13.921   0.469
  118    HB2  ASP  19           2HB      ASP  19  -5.730  10.974   0.455
  119    HB3  ASP  19           1HB      ASP  19  -6.423  12.107   1.611
  120    H    LYS  20           H        LYS  20  -4.059  10.736   1.498
  121    HA   LYS  20           HA       LYS  20  -2.714  10.006   3.166
  122    HB2  LYS  20           2HB      LYS  20  -0.674  10.970   3.354
  123    HB3  LYS  20           1HB      LYS  20  -1.232  11.896   1.970
  124    HG2  LYS  20           2HG      LYS  20  -2.134  13.449   3.992
  125    HG3  LYS  20           1HG      LYS  20  -0.697  12.749   4.732
  126    HD2  LYS  20           2HD      LYS  20  -0.280  13.659   1.985
  127    HD3  LYS  20           1HD      LYS  20  -0.739  14.949   3.097
  128    HE2  LYS  20           2HE      LYS  20   1.333  15.003   3.888
  129    HE3  LYS  20           1HE      LYS  20   1.182  13.325   4.405
  130    HZ1  LYS  20           3HZ      LYS  20   2.056  14.231   1.715
  131    HZ2  LYS  20           1HZ      LYS  20   1.917  12.620   2.215
  132    HZ3  LYS  20           2HZ      LYS  20   3.069  13.632   2.931
  133    H    ALA  21           H        ALA  21  -5.197  11.911   3.632
  134    HA   ALA  21           HA       ALA  21  -4.628  12.616   6.417
  135    HB1  ALA  21           1HB      ALA  21  -6.822  13.309   4.512
  136    HB2  ALA  21           2HB      ALA  21  -5.709  14.372   5.374
  137    HB3  ALA  21           3HB      ALA  21  -7.015  13.570   6.246
  138    H    LEU  22           H        LEU  22  -5.698   9.805   4.970
  139    HA   LEU  22           HA       LEU  22  -7.576   9.204   7.121
  140    HB2  LEU  22           2HB      LEU  22  -7.247   7.507   4.628
  141    HB3  LEU  22           1HB      LEU  22  -8.650   7.645   5.683
  142    HG   LEU  22           HG       LEU  22  -8.049   9.079   3.253
  143   HD11  LEU  22          1HD1      LEU  22 -10.593   9.701   4.390
  144   HD12  LEU  22          2HD1      LEU  22 -10.257   7.992   4.650
  145   HD13  LEU  22          3HD1      LEU  22 -10.220   8.662   3.017
  146   HD21  LEU  22          3HD2      LEU  22  -9.198  11.208   4.243
  147   HD22  LEU  22          1HD2      LEU  22  -7.446  11.032   4.291
  148   HD23  LEU  22          2HD2      LEU  22  -8.410  10.694   5.730
  149    H    HIS  23           H        HIS  23  -6.981   6.116   6.886
  150    HA   HIS  23           HA       HIS  23  -4.581   6.282   8.494
  151    HB2  HIS  23           2HB      HIS  23  -7.014   4.904   8.697
  152    HB3  HIS  23           1HB      HIS  23  -5.823   3.657   8.354
  153    HD1  HIS  23           1HD      HIS  23  -3.587   5.439  10.019
  154    HD2  HIS  23           2HD      HIS  23  -7.210   3.897  11.344
  155    HE1  HIS  23           1HE      HIS  23  -3.367   5.255  12.517
  156    HE2  HIS  23           2HE      HIS  23  -5.532   4.224  13.285
  157    H    PHE  24           H        PHE  24  -2.610   4.963   8.015
  158    HA   PHE  24           HA       PHE  24  -2.829   3.378   5.612
  159    HB2  PHE  24           2HB      PHE  24  -0.729   5.431   6.150
  160    HB3  PHE  24           1HB      PHE  24  -0.418   4.076   5.068
  161    HD1  PHE  24           2HD      PHE  24  -3.053   6.645   5.661
  162    HD2  PHE  24           1HD      PHE  24  -0.828   4.484   2.712
  163    HE1  PHE  24           2HE      PHE  24  -4.228   7.810   3.849
  164    HE2  PHE  24           1HE      PHE  24  -2.020   5.582   0.998
  165    HZ   PHE  24           HZ       PHE  24  -3.706   7.241   1.489
  166    H    TYR  25           H        TYR  25  -1.827   1.265   5.701
  167    HA   TYR  25           HA       TYR  25  -0.801   0.464   8.267
  168    HB2  TYR  25           2HB      TYR  25  -1.596  -0.970   5.747
  169    HB3  TYR  25           1HB      TYR  25  -0.643  -1.808   6.966
  170    HD1  TYR  25           2HD      TYR  25  -3.274   0.693   7.664
  171    HD2  TYR  25           1HD      TYR  25  -2.241  -3.431   7.631
  172    HE1  TYR  25           2HE      TYR  25  -5.337   0.174   8.898
  173    HE2  TYR  25           1HE      TYR  25  -4.301  -3.966   8.865
  174    HH   TYR  25           HH       TYR  25  -5.929  -2.935  10.267
  175    H    THR  26           H        THR  26   1.367  -0.762   8.443
  176    HA   THR  26           HA       THR  26   3.254   0.455   6.558
  177    HB   THR  26           HB       THR  26   4.671   0.784   8.290
  178    HG1  THR  26           1HG      THR  26   5.554  -0.916   9.100
  179   HG21  THR  26          3HG2      THR  26   2.522  -0.165  10.152
  180   HG22  THR  26          1HG2      THR  26   2.438   1.377   9.301
  181   HG23  THR  26          2HG2      THR  26   3.757   1.063  10.430
  182    H    PHE  27           H        PHE  27   5.398  -0.915   6.336
  183    HA   PHE  27           HA       PHE  27   4.658  -3.195   4.911
  184    HB2  PHE  27           2HB      PHE  27   6.992  -1.585   5.273
  185    HB3  PHE  27           1HB      PHE  27   7.374  -3.244   4.906
  186    HD1  PHE  27           1HD      PHE  27   4.299  -2.271   3.461
  187    HD2  PHE  27           2HD      PHE  27   8.501  -2.033   2.934
  188    HE1  PHE  27           1HE      PHE  27   3.986  -1.794   1.066
  189    HE2  PHE  27           2HE      PHE  27   8.197  -1.596   0.576
  190    HZ   PHE  27           HZ       PHE  27   5.928  -1.455  -0.384
  191    HA   PRO  28           HA       PRO  28   5.213  -6.717   7.750
  192    HB2  PRO  28           2HB      PRO  28   6.577  -7.644   5.195
  193    HB3  PRO  28           1HB      PRO  28   5.604  -8.619   6.292
  194    HG2  PRO  28           2HG      PRO  28   4.490  -7.670   4.142
  195    HG3  PRO  28           1HG      PRO  28   3.619  -7.501   5.672
  196    HD2  PRO  28           2HD      PRO  28   5.003  -5.458   4.041
  197    HD3  PRO  28           1HD      PRO  28   3.624  -5.307   5.113
  198    H    LYS  29           H        LYS  29   7.190  -8.134   8.468
  199    HA   LYS  29           HA       LYS  29   9.481  -6.404   8.820
  200    HB2  LYS  29           2HB      LYS  29  10.250  -8.637  10.063
  201    HB3  LYS  29           1HB      LYS  29   9.181  -7.458  10.813
  202    HG2  LYS  29           2HG      LYS  29   7.324  -8.811  10.579
  203    HG3  LYS  29           1HG      LYS  29   8.034  -9.731   9.252
  204    HD2  LYS  29           2HD      LYS  29   8.422 -11.292  10.819
  205    HD3  LYS  29           1HD      LYS  29   9.778 -10.259  11.279
  206    HE2  LYS  29           2HE      LYS  29   8.831  -9.713  13.228
  207    HE3  LYS  29           1HE      LYS  29   7.264  -9.419  12.479
  208    HZ1  LYS  29           3HZ      LYS  29   6.555 -11.495  12.937
  209    HZ2  LYS  29           1HZ      LYS  29   7.717 -11.411  14.165
  210    HZ3  LYS  29           2HZ      LYS  29   8.075 -12.201  12.713
  211    H    ASP  30           H        ASP  30   8.623  -9.105   6.903
  212    HA   ASP  30           HA       ASP  30  11.320  -9.909   6.258
  213    HB2  ASP  30           2HB      ASP  30   9.362 -10.856   4.380
  214    HB3  ASP  30           1HB      ASP  30  10.277 -11.798   5.541
  215    H    ALA  31           H        ALA  31  12.587  -8.702   4.894
  216    HA   ALA  31           HA       ALA  31  11.867  -6.562   3.436
  217    HB1  ALA  31           1HB      ALA  31  14.101  -6.747   3.599
  218    HB2  ALA  31           2HB      ALA  31  13.927  -7.295   1.941
  219    HB3  ALA  31           3HB      ALA  31  14.129  -8.469   3.244
  220    H    GLU  32           H        GLU  32  12.309  -9.749   1.652
  221    HA   GLU  32           HA       GLU  32  11.251  -8.837  -0.758
  222    HB2  GLU  32           2HB      GLU  32  12.305 -10.927  -0.756
  223    HB3  GLU  32           1HB      GLU  32  11.316 -11.611   0.471
  224    HG2  GLU  32           2HG      GLU  32  10.215 -10.825  -2.210
  225    HG3  GLU  32           1HG      GLU  32  10.977 -12.390  -1.929
  226    H    LEU  33           H        LEU  33   9.132 -10.711   1.586
  227    HA   LEU  33           HA       LEU  33   6.847 -10.387   0.199
  228    HB2  LEU  33           2HB      LEU  33   7.261 -11.179   2.656
  229    HB3  LEU  33           1HB      LEU  33   6.921  -9.528   3.084
  230    HG   LEU  33           HG       LEU  33   4.756  -9.906   3.046
  231   HD11  LEU  33          1HD1      LEU  33   4.697  -9.479   0.653
  232   HD12  LEU  33          2HD1      LEU  33   3.550 -10.752   1.069
  233   HD13  LEU  33          3HD1      LEU  33   5.091 -11.161   0.323
  234   HD21  LEU  33          3HD2      LEU  33   5.822 -12.628   2.631
  235   HD22  LEU  33          1HD2      LEU  33   4.087 -12.389   2.523
  236   HD23  LEU  33          2HD2      LEU  33   4.935 -11.955   3.999
  237    H    ARG  34           H        ARG  34   8.639  -7.958   1.852
  238    HA   ARG  34           HA       ARG  34   6.857  -5.806   1.680
  239    HB2  ARG  34           2HB      ARG  34   8.478  -4.475   2.570
  240    HB3  ARG  34           1HB      ARG  34   9.188  -6.028   2.955
  241    HG2  ARG  34           2HG      ARG  34  11.041  -5.277   1.995
  242    HG3  ARG  34           1HG      ARG  34  10.223  -5.395   0.448
  243    HD2  ARG  34           2HD      ARG  34  10.429  -3.207   0.213
  244    HD3  ARG  34           1HD      ARG  34   9.384  -2.988   1.608
  245    HE   ARG  34           HE       ARG  34  12.143  -3.496   2.259
  246   HH11  ARG  34          1HH1      ARG  34   9.759  -1.045   1.552
  247   HH12  ARG  34          2HH1      ARG  34  10.633   0.213   2.357
  248   HH21  ARG  34          1HH2      ARG  34  13.293  -1.840   3.316
  249   HH22  ARG  34          2HH2      ARG  34  12.638  -0.237   3.358
  250    H    ARG  35           H        ARG  35   9.596  -6.550  -0.454
  251    HA   ARG  35           HA       ARG  35   8.949  -4.520  -2.245
  252    HB2  ARG  35           2HB      ARG  35  10.611  -5.238  -3.590
  253    HB3  ARG  35           1HB      ARG  35  11.095  -6.155  -2.177
  254    HG2  ARG  35           2HG      ARG  35   9.209  -7.626  -3.845
  255    HG3  ARG  35           1HG      ARG  35  10.621  -7.099  -4.750
  256    HD2  ARG  35           2HD      ARG  35  10.504  -8.843  -2.319
  257    HD3  ARG  35           1HD      ARG  35  11.171  -9.216  -3.903
  258    HE   ARG  35           HE       ARG  35  12.469  -7.765  -1.766
  259   HH11  ARG  35          1HH1      ARG  35  12.453  -8.499  -5.179
  260   HH12  ARG  35          2HH1      ARG  35  14.127  -8.109  -5.395
  261   HH21  ARG  35          1HH2      ARG  35  14.667  -7.253  -2.051
  262   HH22  ARG  35          2HH2      ARG  35  15.382  -7.404  -3.621
  263    H    LEU  36           H        LEU  36   7.586  -7.758  -1.723
  264    HA   LEU  36           HA       LEU  36   6.178  -7.807  -4.251
  265    HB2  LEU  36           2HB      LEU  36   5.380  -8.997  -1.581
  266    HB3  LEU  36           1HB      LEU  36   4.512  -9.259  -3.075
  267    HG   LEU  36           HG       LEU  36   7.280 -10.200  -2.360
  268   HD11  LEU  36          1HD1      LEU  36   4.700 -11.567  -3.092
  269   HD12  LEU  36          2HD1      LEU  36   5.574 -11.652  -1.563
  270   HD13  LEU  36          3HD1      LEU  36   6.255 -12.394  -3.011
  271   HD21  LEU  36          3HD2      LEU  36   7.443  -9.386  -4.613
  272   HD22  LEU  36          1HD2      LEU  36   5.934 -10.184  -5.059
  273   HD23  LEU  36          2HD2      LEU  36   7.355 -11.147  -4.659
  274    H    TRP  37           H        TRP  37   5.326  -6.357  -1.124
  275    HA   TRP  37           HA       TRP  37   2.822  -5.468  -2.058
  276    HB2  TRP  37           2HB      TRP  37   4.648  -4.591   0.158
  277    HB3  TRP  37           1HB      TRP  37   3.197  -3.672  -0.226
  278    HD1  TRP  37           HD       TRP  37   3.283  -7.465  -0.481
  279    HE1  TRP  37           1HE      TRP  37   1.754  -8.480   1.363
  280    HE3  TRP  37           3HE      TRP  37   2.035  -3.184   1.948
  281    HZ2  TRP  37           2HZ      TRP  37   0.173  -7.510   3.550
  282    HZ3  TRP  37           3HZ      TRP  37   0.553  -3.277   3.867
  283    HH2  TRP  37           HH       TRP  37  -0.382  -5.376   4.647
  284    H    LEU  38           H        LEU  38   6.138  -4.103  -2.271
  285    HA   LEU  38           HA       LEU  38   5.806  -1.513  -3.014
  286    HB2  LEU  38           2HB      LEU  38   7.504  -3.718  -4.151
  287    HB3  LEU  38           1HB      LEU  38   7.456  -2.218  -4.982
  288    HG   LEU  38           HG       LEU  38   9.141  -2.896  -2.881
  289   HD11  LEU  38          1HD1      LEU  38   9.658  -0.355  -3.062
  290   HD12  LEU  38          2HD1      LEU  38   8.515  -0.413  -4.403
  291   HD13  LEU  38          3HD1      LEU  38   9.961  -1.420  -4.435
  292   HD21  LEU  38          3HD2      LEU  38   7.375  -2.424  -1.277
  293   HD22  LEU  38          1HD2      LEU  38   7.164  -0.816  -1.973
  294   HD23  LEU  38          2HD2      LEU  38   8.675  -1.237  -1.173
  295    H    LYS  39           H        LYS  39   5.182  -4.491  -5.019
  296    HA   LYS  39           HA       LYS  39   4.362  -3.361  -7.372
  297    HB2  LYS  39           2HB      LYS  39   4.067  -5.872  -5.909
  298    HB3  LYS  39           1HB      LYS  39   2.801  -5.617  -7.074
  299    HG2  LYS  39           2HG      LYS  39   4.935  -6.902  -7.721
  300    HG3  LYS  39           1HG      LYS  39   4.256  -5.735  -8.863
  301    HD2  LYS  39           2HD      LYS  39   6.165  -4.544  -7.006
  302    HD3  LYS  39           1HD      LYS  39   6.869  -5.836  -7.976
  303    HE2  LYS  39           2HE      LYS  39   5.650  -4.607  -9.941
  304    HE3  LYS  39           1HE      LYS  39   5.700  -3.232  -8.840
  305    HZ1  LYS  39           3HZ      LYS  39   7.671  -3.872 -10.524
  306    HZ2  LYS  39           1HZ      LYS  39   8.197  -4.670  -9.127
  307    HZ3  LYS  39           2HZ      LYS  39   7.904  -3.005  -9.091
  308    H    ASN  40           H        ASN  40   2.142  -4.385  -4.785
  309    HA   ASN  40           HA       ASN  40  -0.203  -3.463  -5.964
  310    HB2  ASN  40           2HB      ASN  40  -0.460  -3.244  -3.105
  311    HB3  ASN  40           1HB      ASN  40  -1.174  -4.418  -4.205
  312   HD21  ASN  40          1HD2      ASN  40   0.394  -6.137  -4.931
  313   HD22  ASN  40          2HD2      ASN  40   1.430  -6.804  -3.718
  314    H    VAL  41           H        VAL  41   2.188  -1.658  -4.282
  315    HA   VAL  41           HA       VAL  41   0.411   0.458  -3.601
  316    HB   VAL  41           HB       VAL  41   2.719  -0.242  -2.515
  317   HG11  VAL  41          1HG1      VAL  41   4.416   1.480  -2.978
  318   HG12  VAL  41          2HG1      VAL  41   3.447   2.037  -4.341
  319   HG13  VAL  41          3HG1      VAL  41   4.135   0.417  -4.349
  320   HG21  VAL  41          3HG2      VAL  41   2.262   1.426  -1.075
  321   HG22  VAL  41          1HG2      VAL  41   0.825   1.631  -2.076
  322   HG23  VAL  41          2HG2      VAL  41   2.237   2.653  -2.341
  323    H    SER  42           H        SER  42   2.311  -0.155  -6.494
  324    HA   SER  42           HA       SER  42   1.231   1.349  -8.287
  325    HB2  SER  42           2HB      SER  42   0.813   3.430  -7.476
  326    HB3  SER  42           1HB      SER  42   2.097   3.368  -6.259
  327    HG   SER  42           HG       SER  42   2.181   4.796  -8.342
  328    H    ARG  43           H        ARG  43   4.431   2.928  -7.461
  329    HA   ARG  43           HA       ARG  43   6.351   2.898  -8.627
  330    HB2  ARG  43           2HB      ARG  43   7.476   0.920  -8.555
  331    HB3  ARG  43           1HB      ARG  43   6.134   0.509  -7.507
  332    HG2  ARG  43           2HG      ARG  43   5.835  -1.279  -8.781
  333    HG3  ARG  43           1HG      ARG  43   5.227  -0.193 -10.026
  334    HD2  ARG  43           2HD      ARG  43   7.147  -1.883 -10.559
  335    HD3  ARG  43           1HD      ARG  43   7.181  -0.260 -11.231
  336    HE   ARG  43           HE       ARG  43   8.842  -1.259  -9.025
  337   HH11  ARG  43          1HH1      ARG  43   8.112   1.247 -11.355
  338   HH12  ARG  43          2HH1      ARG  43   9.619   2.064 -11.125
  339   HH21  ARG  43          1HH2      ARG  43  10.818  -0.176  -8.731
  340   HH22  ARG  43          2HH2      ARG  43  11.153   1.260  -9.640
  341    H    ALA  44           H        ALA  44   3.706   3.088 -10.132
  342    HA   ALA  44           HA       ALA  44   4.212   1.905 -12.706
  343    HB1  ALA  44           1HB      ALA  44   2.116   3.584 -11.473
  344    HB2  ALA  44           2HB      ALA  44   1.975   2.151 -12.491
  345    HB3  ALA  44           3HB      ALA  44   2.290   3.725 -13.224
  346    H    GLY  45           H        GLY  45   6.602   3.042 -12.762
  347    HA2  GLY  45           2HA      GLY  45   7.846   5.016 -13.237
  348    HA3  GLY  45           1HA      GLY  45   7.167   4.503 -14.757
  349    H    VAL  46           H        VAL  46   6.044   6.405 -11.958
  350    HA   VAL  46           HA       VAL  46   4.602   8.161 -13.775
  351    HB   VAL  46           HB       VAL  46   4.609   8.991 -10.974
  352   HG11  VAL  46          1HG1      VAL  46   2.429   8.238 -12.912
  353   HG12  VAL  46          2HG1      VAL  46   3.058   9.859 -12.618
  354   HG13  VAL  46          3HG1      VAL  46   2.184   9.006 -11.344
  355   HG21  VAL  46          3HG2      VAL  46   3.641   6.225 -11.666
  356   HG22  VAL  46          1HG2      VAL  46   3.125   7.116 -10.235
  357   HG23  VAL  46          2HG2      VAL  46   4.821   6.678 -10.437
  358    H    SER  47           H        SER  47   7.600   8.139 -13.619
  359    HA   SER  47           HA       SER  47   8.006  10.917 -13.937
  360    HB2  SER  47           2HB      SER  47   9.005  11.612 -11.954
  361    HB3  SER  47           1HB      SER  47   7.760  10.528 -11.330
  362    HG   SER  47           HG       SER  47   9.724  10.066 -10.338
  363    H    GLY  48           H        GLY  48  10.003   8.053 -12.544
  364    HA2  GLY  48           2HA      GLY  48  11.392   6.999 -14.362
  365    HA3  GLY  48           1HA      GLY  48  11.878   8.638 -14.763
  366    H    CYS  49           H        CYS  49  13.463   9.632 -13.593
  367    HA   CYS  49           HA       CYS  49  14.779   7.963 -11.559
  368    HB2  CYS  49           2HB      CYS  49  16.853   9.118 -12.136
  369    HB3  CYS  49           1HB      CYS  49  16.130   8.395 -13.570
  370    HG   CYS  49           HG       CYS  49  16.078  11.452 -12.993
  371    H    PHE  50           H        PHE  50  13.126  10.909 -12.058
  372    HA   PHE  50           HA       PHE  50  14.267  12.688 -10.279
  373    HB2  PHE  50           2HB      PHE  50  11.418  12.165 -11.121
  374    HB3  PHE  50           1HB      PHE  50  11.749  13.353  -9.868
  375    HD1  PHE  50           1HD      PHE  50  14.169  12.847 -12.551
  376    HD2  PHE  50           2HD      PHE  50  10.811  15.117 -11.251
  377    HE1  PHE  50           1HE      PHE  50  14.642  14.532 -14.281
  378    HE2  PHE  50           2HE      PHE  50  11.278  16.805 -12.979
  379    HZ   PHE  50           HZ       PHE  50  13.195  16.513 -14.498
  380    H    SER  51           H        SER  51  11.345  10.654  -9.346
  381    HA   SER  51           HA       SER  51  12.409   9.445  -7.115
  382    HB2  SER  51           2HB      SER  51  12.026  12.286  -6.696
  383    HB3  SER  51           1HB      SER  51  11.009  11.352  -5.597
  384    HG   SER  51           HG       SER  51  12.894  10.212  -4.960
  385    H    THR  52           H        THR  52   9.557  11.463  -7.812
  386    HA   THR  52           HA       THR  52   7.353  10.987  -7.956
  387    HB   THR  52           HB       THR  52   7.314   8.117  -7.915
  388    HG1  THR  52           1HG      THR  52   9.223   7.774  -8.717
  389   HG21  THR  52          3HG2      THR  52   7.010   8.841 -10.537
  390   HG22  THR  52          1HG2      THR  52   6.474  10.284  -9.675
  391   HG23  THR  52          2HG2      THR  52   5.714   8.726  -9.346
  392    H    PHE  53           H        PHE  53   8.756   8.419  -5.954
  393    HA   PHE  53           HA       PHE  53   7.772   9.335  -3.508
  394    HB2  PHE  53           2HB      PHE  53   5.920   7.565  -3.243
  395    HB3  PHE  53           1HB      PHE  53   5.538   9.014  -4.172
  396    HD1  PHE  53           1HD      PHE  53   6.426   5.437  -4.442
  397    HD2  PHE  53           2HD      PHE  53   4.922   8.876  -6.441
  398    HE1  PHE  53           1HE      PHE  53   5.756   4.028  -6.337
  399    HE2  PHE  53           2HE      PHE  53   4.243   7.473  -8.346
  400    HZ   PHE  53           HZ       PHE  53   4.660   5.046  -8.297
  401    H    GLN  54           H        GLN  54  10.171   8.385  -3.732
  402    HA   GLN  54           HA       GLN  54  10.883   5.811  -3.937
  403    HB2  GLN  54           2HB      GLN  54  12.287   7.838  -3.297
  404    HB3  GLN  54           1HB      GLN  54  11.889   7.453  -1.631
  405    HG2  GLN  54           2HG      GLN  54  12.805   5.114  -2.191
  406    HG3  GLN  54           1HG      GLN  54  13.533   5.904  -3.589
  407   HE21  GLN  54          1HE2      GLN  54  15.495   6.667  -3.313
  408   HE22  GLN  54          2HE2      GLN  54  16.220   7.104  -1.806
  409    HA   PRO  55           HA       PRO  55   8.353   3.732  -0.839
  410    HB2  PRO  55           2HB      PRO  55   9.842   1.331  -1.622
  411    HB3  PRO  55           1HB      PRO  55   8.114   1.669  -1.744
  412    HG2  PRO  55           2HG      PRO  55   9.703   1.547  -3.915
  413    HG3  PRO  55           1HG      PRO  55   8.323   2.658  -3.819
  414    HD2  PRO  55           2HD      PRO  55  11.244   3.222  -3.428
  415    HD3  PRO  55           1HD      PRO  55  10.015   4.172  -4.296
  416    H    THR  56           H        THR  56  11.824   2.995  -1.176
  417    HA   THR  56           HA       THR  56  12.411   1.679   1.127
  418    HB   THR  56           HB       THR  56  14.542   3.255   1.142
  419    HG1  THR  56           1HG      THR  56  13.381   4.764  -0.306
  420   HG21  THR  56          3HG2      THR  56  15.059   2.086  -1.251
  421   HG22  THR  56          1HG2      THR  56  13.750   1.078  -0.636
  422   HG23  THR  56          2HG2      THR  56  15.216   1.296   0.318
  423    H    THR  57           H        THR  57  11.929   5.308   0.878
  424    HA   THR  57           HA       THR  57  12.588   6.031   3.435
  425    HB   THR  57           HB       THR  57  11.879   7.598   1.664
  426    HG1  THR  57           1HG      THR  57  11.139   9.027   3.080
  427   HG21  THR  57          3HG2      THR  57   9.034   7.419   2.301
  428   HG22  THR  57          1HG2      THR  57   9.658   6.070   1.353
  429   HG23  THR  57          2HG2      THR  57   9.843   7.722   0.763
  430    H    GLY  58           H        GLY  58   9.751   4.259   2.380
  431    HA2  GLY  58           2HA      GLY  58   8.973   2.803   4.351
  432    HA3  GLY  58           1HA      GLY  58   8.738   4.345   5.142
  433    H    HIS  59           H        HIS  59   7.632   2.604   2.131
  434    HA   HIS  59           HA       HIS  59   5.318   4.320   2.037
  435    HB2  HIS  59           2HB      HIS  59   6.544   2.346   0.272
  436    HB3  HIS  59           1HB      HIS  59   4.793   2.179   0.342
  437    HD1  HIS  59           1HD      HIS  59   6.762   5.411   0.425
  438    HD2  HIS  59           2HD      HIS  59   4.049   3.396  -2.015
  439    HE1  HIS  59           1HE      HIS  59   6.174   7.024  -1.410
  440    HE2  HIS  59           2HE      HIS  59   4.543   5.781  -2.875
  441    H    ARG  60           H        ARG  60   3.226   3.758   2.440
  442    HA   ARG  60           HA       ARG  60   2.771   1.280   3.966
  443    HB2  ARG  60           2HB      ARG  60   1.320   2.718   5.489
  444    HB3  ARG  60           1HB      ARG  60   3.035   3.034   5.543
  445    HG2  ARG  60           2HG      ARG  60   2.405   4.831   3.709
  446    HG3  ARG  60           1HG      ARG  60   0.866   4.763   4.540
  447    HD2  ARG  60           2HD      ARG  60   3.410   5.040   6.083
  448    HD3  ARG  60           1HD      ARG  60   2.668   6.447   5.329
  449    HE   ARG  60           HE       ARG  60   0.874   6.284   6.815
  450   HH11  ARG  60          1HH1      ARG  60   3.192   3.720   7.351
  451   HH12  ARG  60          2HH1      ARG  60   2.560   3.310   8.907
  452   HH21  ARG  60          1HH2      ARG  60   0.051   5.740   8.863
  453   HH22  ARG  60          2HH2      ARG  60   0.780   4.452   9.765
  454    H    LEU  61           H        LEU  61   0.223   0.806   4.048
  455    HA   LEU  61           HA       LEU  61  -0.909   1.513   1.427
  456    HB2  LEU  61           2HB      LEU  61  -0.808  -1.048   2.941
  457    HB3  LEU  61           1HB      LEU  61  -2.178  -0.767   1.900
  458    HG   LEU  61           HG       LEU  61   0.014  -2.015   1.053
  459   HD11  LEU  61          1HD1      LEU  61  -1.983  -0.358  -0.321
  460   HD12  LEU  61          2HD1      LEU  61  -1.518  -2.041  -0.580
  461   HD13  LEU  61          3HD1      LEU  61  -0.538  -0.742  -1.247
  462   HD21  LEU  61          3HD2      LEU  61   1.376   0.016   1.578
  463   HD22  LEU  61          1HD2      LEU  61   0.566   0.809   0.232
  464   HD23  LEU  61          2HD2      LEU  61   1.547  -0.626  -0.055
  465    H    CYS  62           H        CYS  62  -3.511   1.487   1.305
  466    HA   CYS  62           HA       CYS  62  -4.456   2.548   3.839
  467    HB2  CYS  62           2HB      CYS  62  -5.914   4.041   2.644
  468    HB3  CYS  62           1HB      CYS  62  -4.334   4.111   1.948
  469    H    SER  63           H        SER  63  -6.659   2.366   4.494
  470    HA   SER  63           HA       SER  63  -7.414   0.192   5.531
  471    HB2  SER  63           2HB      SER  63  -8.628   2.660   4.861
  472    HB3  SER  63           1HB      SER  63  -9.854   1.418   4.688
  473    HG   SER  63           HG       SER  63  -9.020   0.685   6.847
  474    H    VAL  64           H        VAL  64  -9.663   1.019   3.129
  475    HA   VAL  64           HA       VAL  64 -11.039  -1.289   2.960
  476    HB   VAL  64           HB       VAL  64 -12.031  -0.309   0.880
  477   HG11  VAL  64          1HG1      VAL  64 -12.523   0.287   3.369
  478   HG12  VAL  64          2HG1      VAL  64 -13.136   1.347   2.100
  479   HG13  VAL  64          3HG1      VAL  64 -11.678   1.792   2.993
  480   HG21  VAL  64          3HG2      VAL  64 -11.235   1.841   0.159
  481   HG22  VAL  64          1HG2      VAL  64  -9.886   0.705   0.123
  482   HG23  VAL  64          2HG2      VAL  64 -10.023   1.868   1.445
  483    H    HIS  65           H        HIS  65  -8.288  -2.127   2.287
  484    HA   HIS  65           HA       HIS  65  -8.721  -3.204  -0.443
  485    HB2  HIS  65           2HB      HIS  65  -6.240  -3.791   1.081
  486    HB3  HIS  65           1HB      HIS  65  -6.480  -3.623  -0.651
  487    HD1  HIS  65           1HD      HIS  65  -8.097  -0.814   0.179
  488    HD2  HIS  65           2HD      HIS  65  -4.188  -1.953   0.669
  489    HE1  HIS  65           1HE      HIS  65  -6.860   1.304   0.567
  490    H    PHE  66           H        PHE  66  -7.678  -4.606   2.760
  491    HA   PHE  66           HA       PHE  66  -7.913  -7.219   1.808
  492    HB2  PHE  66           2HB      PHE  66  -8.178  -6.518   4.729
  493    HB3  PHE  66           1HB      PHE  66  -7.359  -7.894   3.995
  494    HD1  PHE  66           1HD      PHE  66  -7.098  -4.251   4.648
  495    HD2  PHE  66           2HD      PHE  66  -5.086  -7.785   3.375
  496    HE1  PHE  66           1HE      PHE  66  -4.943  -3.078   4.797
  497    HE2  PHE  66           2HE      PHE  66  -2.930  -6.622   3.535
  498    HZ   PHE  66           HZ       PHE  66  -2.850  -4.253   4.229
  499    H    GLN  67           H        GLN  67  -9.593  -8.858   2.960
  500    HA   GLN  67           HA       GLN  67 -12.168  -7.535   2.734
  501    HB2  GLN  67           2HB      GLN  67 -12.433 -10.391   3.055
  502    HB3  GLN  67           1HB      GLN  67 -12.866  -9.390   1.677
  503    HG2  GLN  67           2HG      GLN  67 -10.165 -10.608   2.205
  504    HG3  GLN  67           1HG      GLN  67 -11.353 -11.172   1.032
  505   HE21  GLN  67          1HE2      GLN  67  -8.608  -9.406   1.416
  506   HE22  GLN  67          2HE2      GLN  67  -8.689  -8.428  -0.004
  507    H    GLY  68           H        GLY  68 -13.779  -7.885   4.744
  508    HA2  GLY  68           2HA      GLY  68 -14.082  -8.009   7.017
  509    HA3  GLY  68           1HA      GLY  68 -13.208  -9.531   6.869
  510    H    GLY  69           H        GLY  69 -12.631  -8.619   9.217
  511    HA2  GLY  69           2HA      GLY  69 -10.325  -6.797   8.976
  512    HA3  GLY  69           1HA      GLY  69 -11.246  -7.073  10.446
  513    H    ARG  70           H        ARG  70  -8.341  -7.574   9.138
  514    HA   ARG  70           HA       ARG  70  -6.831  -8.808  10.713
  515    HB2  ARG  70           2HB      ARG  70  -8.466 -10.424  11.501
  516    HB3  ARG  70           1HB      ARG  70  -8.657 -11.077   9.881
  517    HG2  ARG  70           2HG      ARG  70  -7.218 -12.629  10.615
  518    HG3  ARG  70           1HG      ARG  70  -5.997 -11.412  10.242
  519    HD2  ARG  70           2HD      ARG  70  -6.590 -10.617  12.704
  520    HD3  ARG  70           1HD      ARG  70  -7.054 -12.311  12.868
  521    HE   ARG  70           HE       ARG  70  -4.415 -11.278  12.777
  522   HH11  ARG  70          1HH1      ARG  70  -6.342 -14.006  11.769
  523   HH12  ARG  70          2HH1      ARG  70  -5.005 -15.104  11.748
  524   HH21  ARG  70          1HH2      ARG  70  -2.651 -12.719  12.747
  525   HH22  ARG  70          2HH2      ARG  70  -2.908 -14.373  12.302
  526    H    LYS  71           H        LYS  71  -8.209  -9.427   7.569
  527    HA   LYS  71           HA       LYS  71  -7.263  -9.696   5.530
  528    HB2  LYS  71           2HB      LYS  71  -5.461  -8.422   5.185
  529    HB3  LYS  71           1HB      LYS  71  -5.441  -8.122   6.909
  530    HG2  LYS  71           2HG      LYS  71  -3.877 -10.000   7.193
  531    HG3  LYS  71           1HG      LYS  71  -3.876 -10.240   5.446
  532    HD2  LYS  71           2HD      LYS  71  -1.922  -8.967   6.161
  533    HD3  LYS  71           1HD      LYS  71  -2.968  -7.976   5.143
  534    HE2  LYS  71           2HE      LYS  71  -3.762  -7.695   7.883
  535    HE3  LYS  71           1HE      LYS  71  -2.019  -7.428   7.745
  536    HZ1  LYS  71           3HZ      LYS  71  -2.493  -5.825   5.958
  537    HZ2  LYS  71           1HZ      LYS  71  -3.164  -5.367   7.442
  538    HZ3  LYS  71           2HZ      LYS  71  -4.151  -6.023   6.236
  539    H    THR  72           H        THR  72  -7.786 -11.837   5.319
  540    HA   THR  72           HA       THR  72  -5.772 -13.684   4.898
  541    HB   THR  72           HB       THR  72  -6.633 -15.192   6.980
  542    HG1  THR  72           1HG      THR  72  -6.233 -12.742   8.258
  543   HG21  THR  72          3HG2      THR  72  -4.521 -13.718   8.067
  544   HG22  THR  72          1HG2      THR  72  -4.259 -13.749   6.322
  545   HG23  THR  72          2HG2      THR  72  -4.442 -15.262   7.215
  546    H    TYR  73           H        TYR  73  -6.868 -16.098   5.363
  547    HA   TYR  73           HA       TYR  73  -8.575 -17.552   4.890
  548    HB2  TYR  73           2HB      TYR  73 -10.039 -15.254   5.431
  549    HB3  TYR  73           1HB      TYR  73 -10.557 -15.705   3.811
  550    HD1  TYR  73           1HD      TYR  73 -10.341 -16.832   7.314
  551    HD2  TYR  73           2HD      TYR  73 -11.923 -17.631   3.448
  552    HE1  TYR  73           1HE      TYR  73 -11.834 -18.528   8.284
  553    HE2  TYR  73           2HE      TYR  73 -13.422 -19.329   4.406
  554    HH   TYR  73           HH       TYR  73 -14.169 -19.560   7.550
  555    H    THR  74           H        THR  74  -7.194 -15.264   2.829
  556    HA   THR  74           HA       THR  74  -6.905 -16.945   0.662
  557    HB   THR  74           HB       THR  74  -8.657 -15.210  -0.685
  558    HG1  THR  74           1HG      THR  74 -10.264 -16.471   1.204
  559   HG21  THR  74          3HG2      THR  74  -8.248 -17.520  -1.325
  560   HG22  THR  74          1HG2      THR  74  -9.974 -17.201  -1.162
  561   HG23  THR  74          2HG2      THR  74  -9.117 -18.081   0.103
  562    H    VAL  75           H        VAL  75  -7.309 -13.663   1.794
  563    HA   VAL  75           HA       VAL  75  -5.556 -12.703  -0.341
  564    HB   VAL  75           HB       VAL  75  -6.847 -10.777   1.521
  565   HG11  VAL  75          1HG1      VAL  75  -5.420 -10.055  -0.346
  566   HG12  VAL  75          2HG1      VAL  75  -7.082  -9.502  -0.551
  567   HG13  VAL  75          3HG1      VAL  75  -6.493 -10.883  -1.477
  568   HG21  VAL  75          3HG2      VAL  75  -8.795 -11.057  -0.358
  569   HG22  VAL  75          1HG2      VAL  75  -8.861 -11.724   1.271
  570   HG23  VAL  75          2HG2      VAL  75  -8.341 -12.736  -0.075
  571    H    ARG  76           H        ARG  76  -3.476 -12.057   0.058
  572    HA   ARG  76           HA       ARG  76  -2.786 -11.467   2.860
  573    HB2  ARG  76           2HB      ARG  76  -0.493 -12.355   2.336
  574    HB3  ARG  76           1HB      ARG  76  -1.758 -13.549   2.453
  575    HG2  ARG  76           2HG      ARG  76  -1.273 -14.319   0.444
  576    HG3  ARG  76           1HG      ARG  76  -1.568 -12.725  -0.263
  577    HD2  ARG  76           2HD      ARG  76   0.959 -14.083   0.390
  578    HD3  ARG  76           1HD      ARG  76   0.602 -12.896  -0.859
  579    HE   ARG  76           HE       ARG  76   1.169 -11.190   0.612
  580   HH11  ARG  76          1HH1      ARG  76   1.246 -14.275   2.247
  581   HH12  ARG  76          2HH1      ARG  76   2.051 -13.650   3.646
  582   HH21  ARG  76          1HH2      ARG  76   2.198 -10.366   2.462
  583   HH22  ARG  76          2HH2      ARG  76   2.590 -11.432   3.770
  584    H    VAL  77           H        VAL  77  -2.274 -10.646  -0.532
  585    HA   VAL  77           HA       VAL  77  -0.672  -8.329   0.270
  586    HB   VAL  77           HB       VAL  77   0.483  -8.503  -1.696
  587   HG11  VAL  77          1HG1      VAL  77   0.944 -10.639  -2.270
  588   HG12  VAL  77          2HG1      VAL  77  -0.755 -11.100  -2.379
  589   HG13  VAL  77          3HG1      VAL  77   0.018 -10.950  -0.805
  590   HG21  VAL  77          3HG2      VAL  77  -0.545  -8.970  -3.876
  591   HG22  VAL  77          1HG2      VAL  77  -1.329  -7.637  -3.028
  592   HG23  VAL  77          2HG2      VAL  77  -2.096  -9.223  -3.073
  593    HA   PRO  78           HA       PRO  78  -4.385  -5.788  -0.133
  594    HB2  PRO  78           2HB      PRO  78  -2.257  -3.777  -0.687
  595    HB3  PRO  78           1HB      PRO  78  -3.666  -3.639   0.358
  596    HG2  PRO  78           2HG      PRO  78  -1.359  -4.067   1.486
  597    HG3  PRO  78           1HG      PRO  78  -2.707  -5.121   1.965
  598    HD2  PRO  78           2HD      PRO  78  -0.521  -5.655  -0.003
  599    HD3  PRO  78           1HD      PRO  78  -1.079  -6.695   1.326
  600    H    THR  79           H        THR  79  -3.561  -7.098  -2.779
  601    HA   THR  79           HA       THR  79  -4.048  -4.614  -4.259
  602    HB   THR  79           HB       THR  79  -3.667  -7.170  -5.722
  603    HG1  THR  79           1HG      THR  79  -1.658  -7.442  -5.153
  604   HG21  THR  79          3HG2      THR  79  -2.262  -4.572  -6.195
  605   HG22  THR  79          1HG2      THR  79  -3.903  -4.863  -6.774
  606   HG23  THR  79          2HG2      THR  79  -2.579  -5.887  -7.326
  607    H    ILE  80           H        ILE  80  -6.068  -4.187  -4.299
  608    HA   ILE  80           HA       ILE  80  -7.988  -6.203  -5.252
  609    HB   ILE  80           HB       ILE  80  -8.093  -4.762  -2.753
  610   HG12  ILE  80          2HG1      ILE  80 -10.483  -6.117  -2.942
  611   HG13  ILE  80          1HG1      ILE  80  -9.459  -6.990  -4.083
  612   HG21  ILE  80          1HG2      ILE  80 -10.518  -4.002  -2.975
  613   HG22  ILE  80          2HG2      ILE  80 -10.214  -3.963  -4.711
  614   HG23  ILE  80          3HG2      ILE  80  -9.261  -2.951  -3.623
  615   HD11  ILE  80          3HD1      ILE  80  -8.497  -8.058  -2.405
  616   HD12  ILE  80          1HD1      ILE  80  -9.570  -7.220  -1.279
  617   HD13  ILE  80          2HD1      ILE  80  -7.994  -6.529  -1.683
  618    H    PHE  81           H        PHE  81  -7.914  -5.459  -7.458
  619    HA   PHE  81           HA       PHE  81  -9.219  -2.959  -7.944
  620    HB2  PHE  81           2HB      PHE  81  -6.499  -2.921  -9.189
  621    HB3  PHE  81           1HB      PHE  81  -7.537  -1.582  -8.740
  622    HD1  PHE  81           2HD      PHE  81  -7.810  -1.305  -6.059
  623    HD2  PHE  81           1HD      PHE  81  -4.529  -3.177  -8.033
  624    HE1  PHE  81           2HE      PHE  81  -6.420  -0.958  -4.074
  625    HE2  PHE  81           1HE      PHE  81  -3.117  -2.793  -6.039
  626    HZ   PHE  81           HZ       PHE  81  -4.084  -1.707  -4.026
  Start of MODEL    9
    1    H1   GLY   1           1HT      GLY   1   4.113  17.302   0.026
    2    H2   GLY   1           2HT      GLY   1   5.070  18.393  -0.842
    3    H3   GLY   1           3HT      GLY   1   3.844  18.966   0.173
    4    HA2  GLY   1           1HA      GLY   1   6.513  17.994   0.833
    5    HA3  GLY   1           2HA      GLY   1   5.591  19.303   1.557
    6    H    SER   2           H        SER   2   3.210  17.537   1.834
    7    HA   SER   2           HA       SER   2   3.648  16.676   4.467
    8    HB2  SER   2           2HB      SER   2   1.466  15.216   3.678
    9    HB3  SER   2           1HB      SER   2   1.405  16.888   4.234
   10    HG   SER   2           HG       SER   2   1.045  15.853   1.712
   11    HA   PRO   3           HA       PRO   3   5.249  12.586   4.098
   12    HB2  PRO   3           2HB      PRO   3   3.865  11.144   5.910
   13    HB3  PRO   3           1HB      PRO   3   5.007  12.408   6.382
   14    HG2  PRO   3           2HG      PRO   3   2.021  12.525   6.197
   15    HG3  PRO   3           1HG      PRO   3   3.089  13.167   7.458
   16    HD2  PRO   3           2HD      PRO   3   2.025  14.707   5.482
   17    HD3  PRO   3           1HD      PRO   3   3.587  15.056   6.249
   18    H    GLY   4           H        GLY   4   3.720  12.886   1.906
   19    HA2  GLY   4           2HA      GLY   4   1.959  10.522   1.855
   20    HA3  GLY   4           1HA      GLY   4   1.814  11.899   0.764
   21    H    PHE   5           H        PHE   5   1.875   9.621  -0.637
   22    HA   PHE   5           HA       PHE   5   4.408   9.728  -1.981
   23    HB2  PHE   5           2HB      PHE   5   3.634   7.283  -0.413
   24    HB3  PHE   5           1HB      PHE   5   4.750   7.219  -1.764
   25    HD1  PHE   5           1HD      PHE   5   6.350   9.654  -1.357
   26    HD2  PHE   5           2HD      PHE   5   4.858   6.839   1.463
   27    HE1  PHE   5           1HE      PHE   5   8.189  10.223   0.176
   28    HE2  PHE   5           2HE      PHE   5   6.691   7.407   3.003
   29    HZ   PHE   5           HZ       PHE   5   8.358   9.102   2.361
   30    H    THR   6           H        THR   6   1.407   7.870  -1.668
   31    HA   THR   6           HA       THR   6  -0.207   7.893  -3.511
   32    HB   THR   6           HB       THR   6   2.249   7.272  -5.169
   33    HG1  THR   6           1HG      THR   6   2.199   9.397  -5.124
   34   HG21  THR   6          3HG2      THR   6   0.502   7.616  -7.059
   35   HG22  THR   6          1HG2      THR   6  -0.646   7.091  -5.827
   36   HG23  THR   6          2HG2      THR   6   0.688   6.037  -6.296
   37    H    CYS   7           H        CYS   7  -1.380   6.156  -2.921
   38    HA   CYS   7           HA       CYS   7  -0.122   3.588  -2.432
   39    HB2  CYS   7           2HB      CYS   7  -1.835   4.170  -0.824
   40    HB3  CYS   7           1HB      CYS   7  -3.028   4.475  -2.075
   41    H    CYS   8           H        CYS   8  -0.782   4.999  -5.225
   42    HA   CYS   8           HA       CYS   8  -1.414   4.270  -7.304
   43    HB2  CYS   8           2HB      CYS   8   0.373   2.693  -7.008
   44    HB3  CYS   8           1HB      CYS   8  -0.596   1.682  -5.951
   45    HG   CYS   8           HG       CYS   8  -0.303   0.998  -8.669
   46    H    VAL   9           H        VAL   9  -3.206   4.597  -5.111
   47    HA   VAL   9           HA       VAL   9  -5.280   2.656  -5.066
   48    HB   VAL   9           HB       VAL   9  -5.034   3.903  -3.095
   49   HG11  VAL   9          1HG1      VAL   9  -3.741   5.687  -3.369
   50   HG12  VAL   9          2HG1      VAL   9  -5.272   6.558  -3.465
   51   HG13  VAL   9          3HG1      VAL   9  -4.435   6.083  -4.940
   52   HG21  VAL   9          3HG2      VAL   9  -7.000   5.377  -2.796
   53   HG22  VAL   9          1HG2      VAL   9  -7.411   3.829  -3.535
   54   HG23  VAL   9          2HG2      VAL   9  -7.309   5.270  -4.538
   55    HA   PRO  10           HA       PRO  10  -7.074   4.453  -8.845
   56    HB2  PRO  10           2HB      PRO  10  -8.422   2.269  -9.622
   57    HB3  PRO  10           1HB      PRO  10  -6.670   2.379  -9.838
   58    HG2  PRO  10           2HG      PRO  10  -8.231   0.963  -7.710
   59    HG3  PRO  10           1HG      PRO  10  -6.809   0.405  -8.613
   60    HD2  PRO  10           2HD      PRO  10  -6.692   1.456  -6.084
   61    HD3  PRO  10           1HD      PRO  10  -5.354   1.520  -7.243
   62    H    GLY  11           H        GLY  11  -8.478   2.722  -6.175
   63    HA2  GLY  11           2HA      GLY  11 -10.660   4.576  -6.014
   64    HA3  GLY  11           1HA      GLY  11 -11.153   2.953  -6.470
   65    H    CYS  12           H        CYS  12  -8.438   2.670  -4.465
   66    HA   CYS  12           HA       CYS  12 -10.158   1.767  -2.376
   67    HB2  CYS  12           2HB      CYS  12  -8.014   1.268  -1.093
   68    HB3  CYS  12           1HB      CYS  12  -8.326   0.350  -2.547
   69    H    TYR  13           H        TYR  13 -10.926   2.762  -0.807
   70    HA   TYR  13           HA       TYR  13 -11.573   4.876   0.052
   71    HB2  TYR  13           2HB      TYR  13 -10.836   2.821   1.518
   72    HB3  TYR  13           1HB      TYR  13  -9.700   4.011   2.123
   73    HD1  TYR  13           1HD      TYR  13 -13.081   4.963   0.991
   74    HD2  TYR  13           2HD      TYR  13 -10.645   4.025   4.352
   75    HE1  TYR  13           1HE      TYR  13 -14.812   5.844   2.490
   76    HE2  TYR  13           2HE      TYR  13 -12.371   4.905   5.855
   77    HH   TYR  13           HH       TYR  13 -14.774   5.326   5.852
   78    H    ASN  14           H        ASN  14  -8.126   4.605   0.759
   79    HA   ASN  14           HA       ASN  14  -7.958   7.519   0.511
   80    HB2  ASN  14           2HB      ASN  14  -5.886   6.684   2.168
   81    HB3  ASN  14           1HB      ASN  14  -7.290   7.620   2.612
   82   HD21  ASN  14          1HD2      ASN  14  -9.302   6.235   2.899
   83   HD22  ASN  14          2HD2      ASN  14  -9.103   4.785   3.811
   84    H    ASN  15           H        ASN  15  -5.725   8.445  -0.080
   85    HA   ASN  15           HA       ASN  15  -4.370   6.497  -1.790
   86    HB2  ASN  15           2HB      ASN  15  -5.288   8.415  -3.022
   87    HB3  ASN  15           1HB      ASN  15  -4.431   9.525  -1.961
   88   HD21  ASN  15          1HD2      ASN  15  -4.367   8.003  -4.895
   89   HD22  ASN  15          2HD2      ASN  15  -2.684   8.155  -5.259
   90    H    SER  16           H        SER  16  -1.789   6.831  -1.876
   91    HA   SER  16           HA       SER  16  -0.910   7.046   0.812
   92    HB2  SER  16           2HB      SER  16   0.116   5.256  -0.462
   93    HB3  SER  16           1HB      SER  16   0.466   6.321  -1.781
   94    HG   SER  16           HG       SER  16   1.672   6.346   0.772
   95    H    HIS  17           H        HIS  17  -1.326   9.427  -1.630
   96    HA   HIS  17           HA       HIS  17   0.285  11.281  -0.064
   97    HB2  HIS  17           2HB      HIS  17   1.805  11.844  -1.642
   98    HB3  HIS  17           1HB      HIS  17   1.460  10.249  -2.290
   99    HD1  HIS  17           1HD      HIS  17  -0.189  10.172  -4.374
  100    HD2  HIS  17           2HD      HIS  17   1.122  13.953  -3.260
  101    HE1  HIS  17           1HE      HIS  17  -0.704  11.665  -6.330
  102    HE2  HIS  17           2HE      HIS  17  -0.060  13.975  -5.560
  103    H    ARG  18           H        ARG  18  -2.643  10.734  -1.501
  104    HA   ARG  18           HA       ARG  18  -3.023  13.563  -2.217
  105    HB2  ARG  18           2HB      ARG  18  -3.585  11.778  -3.880
  106    HB3  ARG  18           1HB      ARG  18  -4.863  11.247  -2.797
  107    HG2  ARG  18           2HG      ARG  18  -5.319  13.966  -3.099
  108    HG3  ARG  18           1HG      ARG  18  -4.833  13.419  -4.703
  109    HD2  ARG  18           2HD      ARG  18  -6.569  11.449  -3.778
  110    HD3  ARG  18           1HD      ARG  18  -7.305  12.969  -3.270
  111    HE   ARG  18           HE       ARG  18  -6.710  13.464  -5.841
  112   HH11  ARG  18          1HH1      ARG  18  -8.328  10.773  -4.310
  113   HH12  ARG  18          2HH1      ARG  18  -9.325  10.431  -5.683
  114   HH21  ARG  18          1HH2      ARG  18  -8.027  13.012  -7.646
  115   HH22  ARG  18          2HH2      ARG  18  -9.155  11.700  -7.575
  116    H    ASP  19           H        ASP  19  -3.166  12.182   0.562
  117    HA   ASP  19           HA       ASP  19  -5.297  13.788   1.559
  118    HB2  ASP  19           2HB      ASP  19  -5.732  10.850   1.946
  119    HB3  ASP  19           1HB      ASP  19  -6.797  12.181   2.356
  120    H    LYS  20           H        LYS  20  -3.866  10.758   2.668
  121    HA   LYS  20           HA       LYS  20  -2.623  10.248   4.491
  122    HB2  LYS  20           2HB      LYS  20  -0.845  11.564   4.882
  123    HB3  LYS  20           1HB      LYS  20  -1.461  12.495   3.528
  124    HG2  LYS  20           2HG      LYS  20  -2.792  13.755   5.416
  125    HG3  LYS  20           1HG      LYS  20  -1.510  13.110   6.439
  126    HD2  LYS  20           2HD      LYS  20  -0.918  15.332   5.647
  127    HD3  LYS  20           1HD      LYS  20   0.170  14.125   4.960
  128    HE2  LYS  20           2HE      LYS  20  -0.301  14.977   2.956
  129    HE3  LYS  20           1HE      LYS  20  -1.924  14.318   3.131
  130    HZ1  LYS  20           3HZ      LYS  20  -1.409  16.888   4.405
  131    HZ2  LYS  20           1HZ      LYS  20  -2.791  16.335   3.598
  132    HZ3  LYS  20           2HZ      LYS  20  -1.456  16.880   2.715
  133    H    ALA  21           H        ALA  21  -5.487  11.578   4.639
  134    HA   ALA  21           HA       ALA  21  -5.422  12.024   7.552
  135    HB1  ALA  21           1HB      ALA  21  -7.058  13.152   5.359
  136    HB2  ALA  21           2HB      ALA  21  -6.388  13.930   6.793
  137    HB3  ALA  21           3HB      ALA  21  -7.836  12.933   6.926
  138    H    LEU  22           H        LEU  22  -5.745   9.364   5.893
  139    HA   LEU  22           HA       LEU  22  -8.152   8.514   7.338
  140    HB2  LEU  22           2HB      LEU  22  -7.319   7.593   4.568
  141    HB3  LEU  22           1HB      LEU  22  -8.710   6.960   5.472
  142    HG   LEU  22           HG       LEU  22  -9.414   8.540   3.805
  143   HD11  LEU  22          1HD1      LEU  22 -10.221  10.339   5.710
  144   HD12  LEU  22          2HD1      LEU  22  -9.870   8.901   6.665
  145   HD13  LEU  22          3HD1      LEU  22 -11.026   8.815   5.334
  146   HD21  LEU  22          3HD2      LEU  22  -7.134   9.901   4.353
  147   HD22  LEU  22          1HD2      LEU  22  -8.371  10.912   5.107
  148   HD23  LEU  22          2HD2      LEU  22  -8.503  10.489   3.403
  149    H    HIS  23           H        HIS  23  -6.694   5.548   6.095
  150    HA   HIS  23           HA       HIS  23  -5.209   5.388   8.594
  151    HB2  HIS  23           2HB      HIS  23  -7.542   4.050   7.998
  152    HB3  HIS  23           1HB      HIS  23  -6.316   2.864   7.571
  153    HD1  HIS  23           1HD      HIS  23  -8.313   3.805  10.326
  154    HD2  HIS  23           2HD      HIS  23  -4.340   2.666   9.906
  155    HE1  HIS  23           1HE      HIS  23  -7.591   3.033  12.608
  156    HE2  HIS  23           2HE      HIS  23  -5.227   2.224  12.295
  157    H    PHE  24           H        PHE  24  -3.098   4.222   8.426
  158    HA   PHE  24           HA       PHE  24  -2.544   3.220   5.739
  159    HB2  PHE  24           2HB      PHE  24  -0.710   4.915   7.422
  160    HB3  PHE  24           1HB      PHE  24  -0.245   4.121   5.928
  161    HD1  PHE  24           2HD      PHE  24  -2.445   6.718   7.364
  162    HD2  PHE  24           1HD      PHE  24  -0.802   5.048   3.809
  163    HE1  PHE  24           2HE      PHE  24  -3.261   8.644   6.062
  164    HE2  PHE  24           1HE      PHE  24  -1.604   6.959   2.526
  165    HZ   PHE  24           HZ       PHE  24  -2.836   8.750   3.633
  166    H    TYR  25           H        TYR  25  -1.764   1.007   5.778
  167    HA   TYR  25           HA       TYR  25  -0.962  -0.084   8.330
  168    HB2  TYR  25           2HB      TYR  25  -1.233  -1.391   5.601
  169    HB3  TYR  25           1HB      TYR  25  -0.781  -2.245   7.071
  170    HD1  TYR  25           1HD      TYR  25  -3.480   0.133   6.018
  171    HD2  TYR  25           2HD      TYR  25  -2.455  -3.460   8.051
  172    HE1  TYR  25           1HE      TYR  25  -5.852  -0.241   6.538
  173    HE2  TYR  25           2HE      TYR  25  -4.824  -3.846   8.576
  174    HH   TYR  25           HH       TYR  25  -6.900  -2.528   8.802
  175    H    THR  26           H        THR  26   1.246  -1.242   8.548
  176    HA   THR  26           HA       THR  26   3.194   0.249   6.941
  177    HB   THR  26           HB       THR  26   4.409   0.540   8.813
  178    HG1  THR  26           1HG      THR  26   4.972  -1.201  10.192
  179   HG21  THR  26          3HG2      THR  26   3.346   0.534  10.870
  180   HG22  THR  26          1HG2      THR  26   2.366  -0.878  10.470
  181   HG23  THR  26          2HG2      THR  26   2.017   0.679   9.718
  182    H    PHE  27           H        PHE  27   5.433  -0.947   6.814
  183    HA   PHE  27           HA       PHE  27   4.936  -3.217   5.196
  184    HB2  PHE  27           2HB      PHE  27   6.696  -1.120   5.306
  185    HB3  PHE  27           1HB      PHE  27   7.701  -2.535   5.438
  186    HD1  PHE  27           1HD      PHE  27   4.702  -3.080   3.620
  187    HD2  PHE  27           2HD      PHE  27   8.660  -1.573   3.261
  188    HE1  PHE  27           1HE      PHE  27   4.560  -3.310   1.196
  189    HE2  PHE  27           2HE      PHE  27   8.543  -1.839   0.828
  190    HZ   PHE  27           HZ       PHE  27   6.473  -2.696  -0.219
  191    HA   PRO  28           HA       PRO  28   5.978  -6.607   8.111
  192    HB2  PRO  28           2HB      PRO  28   7.065  -7.496   5.407
  193    HB3  PRO  28           1HB      PRO  28   6.355  -8.529   6.650
  194    HG2  PRO  28           2HG      PRO  28   4.804  -7.780   4.763
  195    HG3  PRO  28           1HG      PRO  28   4.232  -7.470   6.408
  196    HD2  PRO  28           2HD      PRO  28   5.367  -5.560   4.414
  197    HD3  PRO  28           1HD      PRO  28   4.054  -5.346   5.566
  198    H    LYS  29           H        LYS  29   8.081  -7.906   8.640
  199    HA   LYS  29           HA       LYS  29  10.290  -6.053   8.751
  200    HB2  LYS  29           2HB      LYS  29  11.302  -8.301   9.857
  201    HB3  LYS  29           1HB      LYS  29  10.356  -7.118  10.745
  202    HG2  LYS  29           2HG      LYS  29   8.453  -8.455  10.732
  203    HG3  LYS  29           1HG      LYS  29   9.040  -9.442   9.393
  204    HD2  LYS  29           2HD      LYS  29  10.513  -9.387  11.998
  205    HD3  LYS  29           1HD      LYS  29   9.089 -10.411  11.799
  206    HE2  LYS  29           2HE      LYS  29  10.583 -10.903   9.522
  207    HE3  LYS  29           1HE      LYS  29  11.796 -10.761  10.796
  208    HZ1  LYS  29           3HZ      LYS  29  10.954 -13.043  10.485
  209    HZ2  LYS  29           1HZ      LYS  29   9.410 -12.523  10.941
  210    HZ3  LYS  29           2HZ      LYS  29  10.687 -12.456  12.049
  211    H    ASP  30           H        ASP  30   9.387  -8.817   6.916
  212    HA   ASP  30           HA       ASP  30  12.051  -9.372   5.935
  213    HB2  ASP  30           2HB      ASP  30   9.976 -10.518   4.293
  214    HB3  ASP  30           1HB      ASP  30  11.118 -11.358   5.335
  215    H    ALA  31           H        ALA  31  12.999  -8.025   4.469
  216    HA   ALA  31           HA       ALA  31  11.844  -5.948   3.203
  217    HB1  ALA  31           1HB      ALA  31  13.811  -6.286   1.491
  218    HB2  ALA  31           2HB      ALA  31  14.307  -7.515   2.658
  219    HB3  ALA  31           3HB      ALA  31  14.102  -5.846   3.169
  220    H    GLU  32           H        GLU  32  12.419  -9.071   1.403
  221    HA   GLU  32           HA       GLU  32  11.082  -8.203  -0.902
  222    HB2  GLU  32           2HB      GLU  32  12.471 -10.149  -0.945
  223    HB3  GLU  32           1HB      GLU  32  11.482 -11.033   0.144
  224    HG2  GLU  32           2HG      GLU  32  10.131 -10.072  -2.281
  225    HG3  GLU  32           1HG      GLU  32  11.397 -11.272  -2.535
  226    H    LEU  33           H        LEU  33   9.489 -10.317   1.644
  227    HA   LEU  33           HA       LEU  33   7.075 -10.425   0.476
  228    HB2  LEU  33           2HB      LEU  33   7.681 -11.084   2.885
  229    HB3  LEU  33           1HB      LEU  33   7.332  -9.440   3.315
  230    HG   LEU  33           HG       LEU  33   5.173  -9.841   3.448
  231   HD11  LEU  33          1HD1      LEU  33   3.907 -11.075   1.633
  232   HD12  LEU  33          2HD1      LEU  33   5.429 -11.145   0.754
  233   HD13  LEU  33          3HD1      LEU  33   4.712  -9.587   1.149
  234   HD21  LEU  33          3HD2      LEU  33   4.484 -12.292   3.346
  235   HD22  LEU  33          1HD2      LEU  33   5.680 -11.799   4.540
  236   HD23  LEU  33          2HD2      LEU  33   6.195 -12.603   3.058
  237    H    ARG  34           H        ARG  34   8.549  -7.613   1.923
  238    HA   ARG  34           HA       ARG  34   6.180  -6.010   1.594
  239    HB2  ARG  34           2HB      ARG  34   8.040  -4.110   1.899
  240    HB3  ARG  34           1HB      ARG  34   7.247  -4.922   3.228
  241    HG2  ARG  34           2HG      ARG  34   9.143  -5.869   3.912
  242    HG3  ARG  34           1HG      ARG  34   9.636  -6.240   2.274
  243    HD2  ARG  34           2HD      ARG  34  11.066  -4.543   2.284
  244    HD3  ARG  34           1HD      ARG  34   9.729  -3.431   2.548
  245    HE   ARG  34           HE       ARG  34  10.617  -4.706   4.957
  246   HH11  ARG  34          1HH1      ARG  34  11.204  -2.067   2.749
  247   HH12  ARG  34          2HH1      ARG  34  11.983  -1.077   3.938
  248   HH21  ARG  34          1HH2      ARG  34  11.644  -3.402   6.527
  249   HH22  ARG  34          2HH2      ARG  34  12.232  -1.833   6.080
  250    H    ARG  35           H        ARG  35   9.229  -6.270  -0.117
  251    HA   ARG  35           HA       ARG  35   8.639  -4.283  -1.947
  252    HB2  ARG  35           2HB      ARG  35  10.347  -5.059  -3.307
  253    HB3  ARG  35           1HB      ARG  35  10.847  -5.611  -1.722
  254    HG2  ARG  35           2HG      ARG  35  11.297  -7.327  -3.289
  255    HG3  ARG  35           1HG      ARG  35   9.941  -7.867  -2.316
  256    HD2  ARG  35           2HD      ARG  35   8.497  -7.809  -4.066
  257    HD3  ARG  35           1HD      ARG  35   9.277  -6.406  -4.794
  258    HE   ARG  35           HE       ARG  35  11.107  -8.314  -5.196
  259   HH11  ARG  35          1HH1      ARG  35   7.662  -8.270  -5.767
  260   HH12  ARG  35          2HH1      ARG  35   7.742  -9.389  -7.085
  261   HH21  ARG  35          1HH2      ARG  35  11.211  -9.784  -6.927
  262   HH22  ARG  35          2HH2      ARG  35   9.756 -10.250  -7.745
  263    H    LEU  36           H        LEU  36   7.411  -7.607  -1.605
  264    HA   LEU  36           HA       LEU  36   6.160  -7.570  -4.211
  265    HB2  LEU  36           2HB      LEU  36   5.273  -9.087  -1.744
  266    HB3  LEU  36           1HB      LEU  36   4.635  -9.296  -3.359
  267    HG   LEU  36           HG       LEU  36   7.516  -9.587  -3.328
  268   HD11  LEU  36          1HD1      LEU  36   5.956 -10.950  -1.245
  269   HD12  LEU  36          2HD1      LEU  36   7.684 -10.613  -1.339
  270   HD13  LEU  36          3HD1      LEU  36   7.006 -11.988  -2.208
  271   HD21  LEU  36          3HD2      LEU  36   5.460 -10.389  -4.891
  272   HD22  LEU  36          1HD2      LEU  36   5.764 -11.861  -3.967
  273   HD23  LEU  36          2HD2      LEU  36   7.062 -11.123  -4.906
  274    H    TRP  37           H        TRP  37   5.104  -6.524  -1.041
  275    HA   TRP  37           HA       TRP  37   2.548  -5.703  -1.781
  276    HB2  TRP  37           2HB      TRP  37   4.517  -4.841   0.314
  277    HB3  TRP  37           1HB      TRP  37   2.998  -3.969   0.098
  278    HD1  TRP  37           HD       TRP  37   3.268  -7.748  -0.337
  279    HE1  TRP  37           1HE      TRP  37   1.821  -8.854   1.537
  280    HE3  TRP  37           3HE      TRP  37   2.136  -3.600   2.371
  281    HZ2  TRP  37           2HZ      TRP  37   0.407  -8.017   3.869
  282    HZ3  TRP  37           3HZ      TRP  37   0.767  -3.795   4.381
  283    HH2  TRP  37           HH       TRP  37  -0.092  -5.949   5.126
  284    H    LEU  38           H        LEU  38   5.760  -4.031  -1.915
  285    HA   LEU  38           HA       LEU  38   5.133  -1.487  -2.533
  286    HB2  LEU  38           2HB      LEU  38   7.196  -3.275  -3.849
  287    HB3  LEU  38           1HB      LEU  38   7.067  -1.579  -4.168
  288    HG   LEU  38           HG       LEU  38   7.686  -2.845  -1.526
  289   HD11  LEU  38          1HD1      LEU  38   9.812  -1.640  -1.769
  290   HD12  LEU  38          2HD1      LEU  38   9.312  -1.111  -3.375
  291   HD13  LEU  38          3HD1      LEU  38   9.564  -2.826  -3.051
  292   HD21  LEU  38          3HD2      LEU  38   7.157   0.022  -2.256
  293   HD22  LEU  38          1HD2      LEU  38   8.000  -0.464  -0.786
  294   HD23  LEU  38          2HD2      LEU  38   6.329  -0.958  -1.049
  295    H    LYS  39           H        LYS  39   5.143  -4.295  -4.865
  296    HA   LYS  39           HA       LYS  39   4.457  -3.050  -7.143
  297    HB2  LYS  39           2HB      LYS  39   4.167  -5.713  -5.983
  298    HB3  LYS  39           1HB      LYS  39   3.059  -5.403  -7.291
  299    HG2  LYS  39           2HG      LYS  39   5.388  -6.460  -7.734
  300    HG3  LYS  39           1HG      LYS  39   4.716  -5.278  -8.858
  301    HD2  LYS  39           2HD      LYS  39   6.276  -4.057  -6.714
  302    HD3  LYS  39           1HD      LYS  39   7.213  -5.184  -7.692
  303    HE2  LYS  39           2HE      LYS  39   5.643  -2.800  -8.659
  304    HE3  LYS  39           1HE      LYS  39   7.394  -2.990  -8.654
  305    HZ1  LYS  39           3HZ      LYS  39   7.029  -3.608 -10.769
  306    HZ2  LYS  39           1HZ      LYS  39   5.420  -4.057 -10.496
  307    HZ3  LYS  39           2HZ      LYS  39   6.676  -5.113 -10.081
  308    H    ASN  40           H        ASN  40   1.936  -4.516  -5.066
  309    HA   ASN  40           HA       ASN  40  -0.107  -3.373  -6.655
  310    HB2  ASN  40           2HB      ASN  40   0.044  -5.132  -4.425
  311    HB3  ASN  40           1HB      ASN  40  -1.241  -3.993  -4.156
  312   HD21  ASN  40          1HD2      ASN  40  -0.027  -6.623  -5.989
  313   HD22  ASN  40          2HD2      ASN  40  -1.439  -6.945  -6.925
  314    H    VAL  41           H        VAL  41   1.608  -2.105  -3.955
  315    HA   VAL  41           HA       VAL  41  -0.410  -0.144  -3.429
  316    HB   VAL  41           HB       VAL  41   1.541  -1.090  -1.808
  317   HG11  VAL  41          1HG1      VAL  41   2.310   1.769  -2.384
  318   HG12  VAL  41          2HG1      VAL  41   3.191   0.407  -3.061
  319   HG13  VAL  41          3HG1      VAL  41   3.116   0.622  -1.313
  320   HG21  VAL  41          3HG2      VAL  41  -0.306  -0.218  -0.788
  321   HG22  VAL  41          1HG2      VAL  41  -0.339   1.201  -1.829
  322   HG23  VAL  41          2HG2      VAL  41   0.820   1.113  -0.509
  323    H    SER  42           H        SER  42   2.322  -0.190  -5.621
  324    HA   SER  42           HA       SER  42   1.824   1.953  -7.078
  325    HB2  SER  42           2HB      SER  42   1.458   3.774  -5.695
  326    HB3  SER  42           1HB      SER  42   2.265   3.031  -4.295
  327    HG   SER  42           HG       SER  42   3.859   4.284  -4.746
  328    H    ARG  43           H        ARG  43   4.882   2.581  -5.151
  329    HA   ARG  43           HA       ARG  43   7.038   2.271  -5.767
  330    HB2  ARG  43           2HB      ARG  43   6.408  -0.068  -5.310
  331    HB3  ARG  43           1HB      ARG  43   5.953  -0.267  -6.996
  332    HG2  ARG  43           2HG      ARG  43   8.193  -0.083  -7.724
  333    HG3  ARG  43           1HG      ARG  43   8.730   0.509  -6.152
  334    HD2  ARG  43           2HD      ARG  43   8.907  -1.562  -5.307
  335    HD3  ARG  43           1HD      ARG  43   7.399  -2.092  -6.049
  336    HE   ARG  43           HE       ARG  43   9.115  -1.960  -8.140
  337   HH11  ARG  43          1HH1      ARG  43   9.254  -3.527  -5.022
  338   HH12  ARG  43          2HH1      ARG  43  10.228  -4.841  -5.586
  339   HH21  ARG  43          1HH2      ARG  43  10.392  -3.694  -8.883
  340   HH22  ARG  43          2HH2      ARG  43  10.874  -4.937  -7.779
  341    H    ALA  44           H        ALA  44   5.905   4.043  -7.448
  342    HA   ALA  44           HA       ALA  44   6.188   3.309 -10.214
  343    HB1  ALA  44           1HB      ALA  44   4.632   5.059  -9.481
  344    HB2  ALA  44           2HB      ALA  44   5.788   5.681 -10.660
  345    HB3  ALA  44           3HB      ALA  44   5.990   6.050  -8.946
  346    H    GLY  45           H        GLY  45   8.612   2.393  -9.775
  347    HA2  GLY  45           2HA      GLY  45  10.568   3.481 -11.073
  348    HA3  GLY  45           1HA      GLY  45  10.489   4.651  -9.787
  349    H    VAL  46           H        VAL  46  10.887   1.131 -10.251
  350    HA   VAL  46           HA       VAL  46  11.941   0.689  -7.655
  351    HB   VAL  46           HB       VAL  46  10.898  -1.098  -8.955
  352   HG11  VAL  46          1HG1      VAL  46  13.322  -1.349 -10.677
  353   HG12  VAL  46          2HG1      VAL  46  12.052  -0.212 -11.128
  354   HG13  VAL  46          3HG1      VAL  46  11.680  -1.926 -10.952
  355   HG21  VAL  46          3HG2      VAL  46  12.283  -2.811  -8.223
  356   HG22  VAL  46          1HG2      VAL  46  12.780  -1.457  -7.210
  357   HG23  VAL  46          2HG2      VAL  46  13.756  -1.924  -8.603
  358    H    SER  47           H        SER  47  13.477   2.791  -8.245
  359    HA   SER  47           HA       SER  47  16.135   1.621  -8.407
  360    HB2  SER  47           2HB      SER  47  16.882   2.658 -10.363
  361    HB3  SER  47           1HB      SER  47  15.249   2.170 -10.816
  362    HG   SER  47           HG       SER  47  15.007   4.199 -11.299
  363    H    GLY  48           H        GLY  48  14.466   4.975  -8.690
  364    HA2  GLY  48           2HA      GLY  48  14.578   6.426  -6.760
  365    HA3  GLY  48           1HA      GLY  48  16.129   5.706  -6.355
  366    H    CYS  49           H        CYS  49  14.693   8.385  -7.601
  367    HA   CYS  49           HA       CYS  49  17.204   9.246  -8.848
  368    HB2  CYS  49           2HB      CYS  49  14.512   9.911 -10.044
  369    HB3  CYS  49           1HB      CYS  49  16.103  10.215 -10.732
  370    HG   CYS  49           HG       CYS  49  14.699   7.455 -10.670
  371    H    PHE  50           H        PHE  50  16.674   9.892  -6.308
  372    HA   PHE  50           HA       PHE  50  16.618  11.661  -4.870
  373    HB2  PHE  50           2HB      PHE  50  17.867  12.884  -6.599
  374    HB3  PHE  50           1HB      PHE  50  16.369  13.305  -7.422
  375    HD1  PHE  50           1HD      PHE  50  18.492  13.957  -4.519
  376    HD2  PHE  50           2HD      PHE  50  14.907  15.011  -6.554
  377    HE1  PHE  50           1HE      PHE  50  18.323  15.997  -3.154
  378    HE2  PHE  50           2HE      PHE  50  14.731  17.054  -5.192
  379    HZ   PHE  50           HZ       PHE  50  16.441  17.548  -3.490
  380    H    SER  51           H        SER  51  14.280  12.574  -7.569
  381    HA   SER  51           HA       SER  51  12.343  13.411  -5.621
  382    HB2  SER  51           2HB      SER  51  12.791  14.036  -8.243
  383    HB3  SER  51           1HB      SER  51  11.426  12.929  -8.386
  384    HG   SER  51           HG       SER  51  11.565  15.307  -6.848
  385    H    THR  52           H        THR  52  10.005  12.385  -7.028
  386    HA   THR  52           HA       THR  52   8.596  10.607  -7.071
  387    HB   THR  52           HB       THR  52   9.389   8.504  -7.617
  388    HG1  THR  52           1HG      THR  52  10.544   7.604  -6.131
  389   HG21  THR  52          3HG2      THR  52  10.851   8.841  -9.269
  390   HG22  THR  52          1HG2      THR  52  12.088   9.458  -8.172
  391   HG23  THR  52          2HG2      THR  52  10.824  10.534  -8.771
  392    H    PHE  53           H        PHE  53   8.033   8.523  -5.575
  393    HA   PHE  53           HA       PHE  53   8.352   9.484  -2.821
  394    HB2  PHE  53           2HB      PHE  53   6.364   7.907  -2.436
  395    HB3  PHE  53           1HB      PHE  53   6.032   9.377  -3.350
  396    HD1  PHE  53           2HD      PHE  53   6.799   5.776  -3.700
  397    HD2  PHE  53           1HD      PHE  53   5.119   9.244  -5.496
  398    HE1  PHE  53           2HE      PHE  53   5.899   4.392  -5.511
  399    HE2  PHE  53           1HE      PHE  53   4.211   7.863  -7.320
  400    HZ   PHE  53           HZ       PHE  53   4.592   5.427  -7.317
  401    H    GLN  54           H        GLN  54  10.428   7.993  -4.083
  402    HA   GLN  54           HA       GLN  54  11.064   5.557  -4.095
  403    HB2  GLN  54           2HB      GLN  54  12.688   7.355  -3.573
  404    HB3  GLN  54           1HB      GLN  54  12.264   7.213  -1.875
  405    HG2  GLN  54           2HG      GLN  54  12.953   4.728  -2.187
  406    HG3  GLN  54           1HG      GLN  54  13.808   5.338  -3.603
  407   HE21  GLN  54          1HE2      GLN  54  13.330   6.203  -0.189
  408   HE22  GLN  54          2HE2      GLN  54  14.984   6.601   0.114
  409    HA   PRO  55           HA       PRO  55   8.797   3.310  -0.915
  410    HB2  PRO  55           2HB      PRO  55  10.308   0.952  -1.724
  411    HB3  PRO  55           1HB      PRO  55   8.578   1.270  -1.837
  412    HG2  PRO  55           2HG      PRO  55  10.198   1.170  -4.013
  413    HG3  PRO  55           1HG      PRO  55   8.730   2.160  -3.938
  414    HD2  PRO  55           2HD      PRO  55  11.587   2.970  -3.670
  415    HD3  PRO  55           1HD      PRO  55  10.232   3.831  -4.433
  416    H    THR  56           H        THR  56  12.289   3.100  -1.335
  417    HA   THR  56           HA       THR  56  13.098   1.677   0.873
  418    HB   THR  56           HB       THR  56  14.573   4.222   0.509
  419    HG1  THR  56           1HG      THR  56  14.209   2.437  -1.664
  420   HG21  THR  56          3HG2      THR  56  16.371   2.949   0.836
  421   HG22  THR  56          1HG2      THR  56  15.815   1.705  -0.283
  422   HG23  THR  56          2HG2      THR  56  15.218   1.727   1.376
  423    H    THR  57           H        THR  57  11.935   5.137   0.788
  424    HA   THR  57           HA       THR  57  12.533   5.829   3.407
  425    HB   THR  57           HB       THR  57  11.678   7.383   1.685
  426    HG1  THR  57           1HG      THR  57  10.279   7.231   4.134
  427   HG21  THR  57          3HG2      THR  57   9.646   7.325   0.751
  428   HG22  THR  57          1HG2      THR  57   8.863   6.809   2.245
  429   HG23  THR  57          2HG2      THR  57   9.676   5.626   1.222
  430    H    GLY  58           H        GLY  58  10.011   3.743   2.170
  431    HA2  GLY  58           2HA      GLY  58   9.288   2.083   3.943
  432    HA3  GLY  58           1HA      GLY  58   8.977   3.497   4.921
  433    H    HIS  59           H        HIS  59   7.769   1.830   1.898
  434    HA   HIS  59           HA       HIS  59   5.512   3.613   1.859
  435    HB2  HIS  59           2HB      HIS  59   6.610   1.610   0.072
  436    HB3  HIS  59           1HB      HIS  59   4.867   1.426   0.231
  437    HD1  HIS  59           1HD      HIS  59   6.886   4.624   0.150
  438    HD2  HIS  59           2HD      HIS  59   3.959   2.663  -2.093
  439    HE1  HIS  59           1HE      HIS  59   6.222   6.234  -1.654
  440    HE2  HIS  59           2HE      HIS  59   4.469   5.028  -3.001
  441    H    ARG  60           H        ARG  60   3.552   3.303   2.546
  442    HA   ARG  60           HA       ARG  60   2.948   0.941   4.221
  443    HB2  ARG  60           2HB      ARG  60   1.632   2.429   5.582
  444    HB3  ARG  60           1HB      ARG  60   3.166   3.215   5.308
  445    HG2  ARG  60           2HG      ARG  60   1.895   4.311   3.294
  446    HG3  ARG  60           1HG      ARG  60   0.485   3.931   4.280
  447    HD2  ARG  60           2HD      ARG  60   0.884   5.796   5.430
  448    HD3  ARG  60           1HD      ARG  60   2.344   5.030   6.048
  449    HE   ARG  60           HE       ARG  60   2.730   6.230   3.480
  450   HH11  ARG  60          1HH1      ARG  60   2.620   6.860   6.910
  451   HH12  ARG  60          2HH1      ARG  60   3.616   8.273   6.808
  452   HH21  ARG  60          1HH2      ARG  60   4.042   8.086   3.345
  453   HH22  ARG  60          2HH2      ARG  60   4.424   8.970   4.784
  454    H    LEU  61           H        LEU  61   0.369   0.564   4.237
  455    HA   LEU  61           HA       LEU  61  -0.567   0.945   1.473
  456    HB2  LEU  61           2HB      LEU  61  -1.107  -1.290   3.442
  457    HB3  LEU  61           1HB      LEU  61  -2.012  -1.105   1.969
  458    HG   LEU  61           HG       LEU  61   0.434  -2.432   2.381
  459   HD11  LEU  61          1HD1      LEU  61   0.096  -3.405   0.310
  460   HD12  LEU  61          2HD1      LEU  61  -0.867  -2.048  -0.258
  461   HD13  LEU  61          3HD1      LEU  61  -1.506  -3.133   0.983
  462   HD21  LEU  61          3HD2      LEU  61   1.485  -1.372   0.202
  463   HD22  LEU  61          1HD2      LEU  61   1.866  -0.758   1.808
  464   HD23  LEU  61          2HD2      LEU  61   0.674   0.053   0.828
  465    H    CYS  62           H        CYS  62  -3.100   1.247   1.246
  466    HA   CYS  62           HA       CYS  62  -4.024   2.589   3.642
  467    HB2  CYS  62           2HB      CYS  62  -4.701   4.368   2.407
  468    HB3  CYS  62           1HB      CYS  62  -3.452   3.739   1.366
  469    H    SER  63           H        SER  63  -6.600   2.851   3.532
  470    HA   SER  63           HA       SER  63  -7.615   0.936   4.865
  471    HB2  SER  63           2HB      SER  63  -8.621   3.218   3.472
  472    HB3  SER  63           1HB      SER  63  -9.853   1.965   3.459
  473    HG   SER  63           HG       SER  63 -10.089   2.182   5.546
  474    H    VAL  64           H        VAL  64  -9.519   1.183   2.130
  475    HA   VAL  64           HA       VAL  64 -10.708  -1.274   2.420
  476    HB   VAL  64           HB       VAL  64 -11.673  -0.937   0.143
  477   HG11  VAL  64          1HG1      VAL  64 -11.790   0.884   2.462
  478   HG12  VAL  64          2HG1      VAL  64 -13.076  -0.022   1.663
  479   HG13  VAL  64          3HG1      VAL  64 -12.500   1.493   0.967
  480   HG21  VAL  64          3HG2      VAL  64  -9.707   0.175  -0.799
  481   HG22  VAL  64          1HG2      VAL  64  -9.982   1.548   0.278
  482   HG23  VAL  64          2HG2      VAL  64 -11.171   1.142  -0.969
  483    H    HIS  65           H        HIS  65  -7.722  -1.775   1.763
  484    HA   HIS  65           HA       HIS  65  -8.145  -3.476  -0.584
  485    HB2  HIS  65           2HB      HIS  65  -5.504  -3.544   0.756
  486    HB3  HIS  65           1HB      HIS  65  -5.897  -3.512  -0.963
  487    HD1  HIS  65           1HD      HIS  65  -7.776  -0.848  -0.039
  488    HD2  HIS  65           2HD      HIS  65  -3.673  -1.412  -0.034
  489    HE1  HIS  65           1HE      HIS  65  -6.805   1.398   0.360
  490    H    PHE  66           H        PHE  66  -6.904  -4.034   2.780
  491    HA   PHE  66           HA       PHE  66  -6.983  -6.824   2.537
  492    HB2  PHE  66           2HB      PHE  66  -7.227  -5.172   5.074
  493    HB3  PHE  66           1HB      PHE  66  -6.634  -6.824   4.951
  494    HD1  PHE  66           2HD      PHE  66  -5.821  -3.273   4.414
  495    HD2  PHE  66           1HD      PHE  66  -4.450  -7.317   4.122
  496    HE1  PHE  66           2HE      PHE  66  -3.502  -2.486   4.132
  497    HE2  PHE  66           1HE      PHE  66  -2.142  -6.517   3.848
  498    HZ   PHE  66           HZ       PHE  66  -1.665  -4.108   3.846
  499    H    GLN  67           H        GLN  67  -8.617  -8.229   4.022
  500    HA   GLN  67           HA       GLN  67 -11.283  -7.278   3.401
  501    HB2  GLN  67           2HB      GLN  67 -10.399  -9.630   2.970
  502    HB3  GLN  67           1HB      GLN  67 -10.546  -9.891   4.703
  503    HG2  GLN  67           2HG      GLN  67 -12.953  -8.779   3.505
  504    HG3  GLN  67           1HG      GLN  67 -12.493 -10.340   2.826
  505   HE21  GLN  67          1HE2      GLN  67 -14.711  -9.435   4.639
  506   HE22  GLN  67          2HE2      GLN  67 -14.640 -10.520   5.984
  507    H    GLY  68           H        GLY  68 -12.098  -5.782   5.310
  508    HA2  GLY  68           2HA      GLY  68 -12.685  -5.367   7.470
  509    HA3  GLY  68           1HA      GLY  68 -12.421  -7.064   7.826
  510    H    GLY  69           H        GLY  69  -9.932  -7.676   8.008
  511    HA2  GLY  69           2HA      GLY  69  -7.771  -6.271   8.329
  512    HA3  GLY  69           1HA      GLY  69  -8.702  -5.565   9.641
  513    H    ARG  70           H        ARG  70  -6.205  -7.361   9.378
  514    HA   ARG  70           HA       ARG  70  -5.631  -8.456  11.569
  515    HB2  ARG  70           2HB      ARG  70  -7.858  -9.227  12.132
  516    HB3  ARG  70           1HB      ARG  70  -7.926 -10.219  10.683
  517    HG2  ARG  70           2HG      ARG  70  -7.495 -11.458  12.809
  518    HG3  ARG  70           1HG      ARG  70  -6.302 -11.726  11.539
  519    HD2  ARG  70           2HD      ARG  70  -5.517 -11.293  13.980
  520    HD3  ARG  70           1HD      ARG  70  -4.666 -10.530  12.641
  521    HE   ARG  70           HE       ARG  70  -6.783  -8.938  13.789
  522   HH11  ARG  70          1HH1      ARG  70  -3.387  -9.743  13.903
  523   HH12  ARG  70          2HH1      ARG  70  -2.932  -8.254  14.658
  524   HH21  ARG  70          1HH2      ARG  70  -6.182  -6.978  14.784
  525   HH22  ARG  70          2HH2      ARG  70  -4.516  -6.686  15.158
  526    H    LYS  71           H        LYS  71  -6.323  -9.402   8.296
  527    HA   LYS  71           HA       LYS  71  -5.102 -10.554   6.752
  528    HB2  LYS  71           2HB      LYS  71  -3.312  -9.068   7.870
  529    HB3  LYS  71           1HB      LYS  71  -2.786 -10.543   8.664
  530    HG2  LYS  71           2HG      LYS  71  -1.858 -11.379   6.788
  531    HG3  LYS  71           1HG      LYS  71  -3.108 -10.715   5.739
  532    HD2  LYS  71           2HD      LYS  71  -0.696  -9.775   5.590
  533    HD3  LYS  71           1HD      LYS  71  -2.057  -8.656   5.570
  534    HE2  LYS  71           2HE      LYS  71  -1.744  -8.217   7.955
  535    HE3  LYS  71           1HE      LYS  71  -0.404  -9.366   7.995
  536    HZ1  LYS  71           3HZ      LYS  71  -0.485  -6.647   6.980
  537    HZ2  LYS  71           1HZ      LYS  71   0.397  -7.748   6.046
  538    HZ3  LYS  71           2HZ      LYS  71   0.795  -7.507   7.672
  539    H    THR  72           H        THR  72  -6.454 -12.388   7.144
  540    HA   THR  72           HA       THR  72  -5.947 -14.372   9.052
  541    HB   THR  72           HB       THR  72  -7.093 -15.813   7.091
  542    HG1  THR  72           1HG      THR  72  -8.413 -14.391   5.878
  543   HG21  THR  72          3HG2      THR  72  -8.040 -14.349   9.315
  544   HG22  THR  72          1HG2      THR  72  -8.784 -15.727   8.504
  545   HG23  THR  72          2HG2      THR  72  -9.158 -14.086   7.976
  546    H    TYR  73           H        TYR  73  -5.632 -16.773   7.897
  547    HA   TYR  73           HA       TYR  73  -2.844 -16.676   7.032
  548    HB2  TYR  73           2HB      TYR  73  -3.757 -19.371   7.301
  549    HB3  TYR  73           1HB      TYR  73  -2.607 -18.500   8.305
  550    HD1  TYR  73           2HD      TYR  73  -6.147 -19.442   7.922
  551    HD2  TYR  73           1HD      TYR  73  -3.233 -17.671  10.465
  552    HE1  TYR  73           2HE      TYR  73  -7.731 -19.544   9.799
  553    HE2  TYR  73           1HE      TYR  73  -4.809 -17.769  12.351
  554    HH   TYR  73           HH       TYR  73  -6.785 -18.978  13.038
  555    H    THR  74           H        THR  74  -4.462 -15.764   5.074
  556    HA   THR  74           HA       THR  74  -4.103 -17.790   3.020
  557    HB   THR  74           HB       THR  74  -6.595 -16.678   2.374
  558    HG1  THR  74           1HG      THR  74  -7.757 -16.659   4.137
  559   HG21  THR  74          3HG2      THR  74  -6.062 -18.919   1.792
  560   HG22  THR  74          1HG2      THR  74  -7.472 -18.957   2.850
  561   HG23  THR  74          2HG2      THR  74  -5.881 -19.376   3.485
  562    H    VAL  75           H        VAL  75  -5.123 -14.482   3.794
  563    HA   VAL  75           HA       VAL  75  -4.577 -13.512   1.132
  564    HB   VAL  75           HB       VAL  75  -6.354 -12.569   2.597
  565   HG11  VAL  75          1HG1      VAL  75  -4.586 -12.728   4.602
  566   HG12  VAL  75          2HG1      VAL  75  -6.036 -11.724   4.643
  567   HG13  VAL  75          3HG1      VAL  75  -4.478 -11.007   4.228
  568   HG21  VAL  75          3HG2      VAL  75  -5.440 -11.126   0.803
  569   HG22  VAL  75          1HG2      VAL  75  -4.296 -10.448   1.969
  570   HG23  VAL  75          2HG2      VAL  75  -6.023 -10.223   2.192
  571    H    ARG  76           H        ARG  76  -2.312 -13.908   0.710
  572    HA   ARG  76           HA       ARG  76  -0.359 -12.998   2.623
  573    HB2  ARG  76           2HB      ARG  76  -0.364 -14.710   0.369
  574    HB3  ARG  76           1HB      ARG  76   0.765 -13.417   0.003
  575    HG2  ARG  76           2HG      ARG  76   1.965 -13.872   2.079
  576    HG3  ARG  76           1HG      ARG  76   0.823 -15.163   2.455
  577    HD2  ARG  76           2HD      ARG  76   2.990 -15.922   1.448
  578    HD3  ARG  76           1HD      ARG  76   1.541 -16.456   0.597
  579    HE   ARG  76           HE       ARG  76   2.222 -15.259  -1.226
  580   HH11  ARG  76          1HH1      ARG  76   3.978 -14.119   1.569
  581   HH12  ARG  76          2HH1      ARG  76   5.019 -13.088   0.649
  582   HH21  ARG  76          1HH2      ARG  76   3.590 -13.902  -2.435
  583   HH22  ARG  76          2HH2      ARG  76   4.798 -12.963  -1.625
  584    H    VAL  77           H        VAL  77  -1.372 -11.943  -0.645
  585    HA   VAL  77           HA       VAL  77  -0.379  -9.273   0.083
  586    HB   VAL  77           HB       VAL  77   1.113  -9.546  -1.597
  587   HG11  VAL  77          1HG1      VAL  77   0.363 -11.064  -3.670
  588   HG12  VAL  77          2HG1      VAL  77  -0.601 -11.799  -2.389
  589   HG13  VAL  77          3HG1      VAL  77   1.154 -11.693  -2.224
  590   HG21  VAL  77          3HG2      VAL  77   0.310  -8.801  -3.804
  591   HG22  VAL  77          1HG2      VAL  77  -0.331  -7.819  -2.491
  592   HG23  VAL  77          2HG2      VAL  77  -1.350  -9.031  -3.261
  593    HA   PRO  78           HA       PRO  78  -4.709  -8.205  -0.408
  594    HB2  PRO  78           2HB      PRO  78  -3.531  -5.488  -0.565
  595    HB3  PRO  78           1HB      PRO  78  -4.817  -6.092   0.473
  596    HG2  PRO  78           2HG      PRO  78  -2.445  -5.647   1.504
  597    HG3  PRO  78           1HG      PRO  78  -3.283  -7.160   1.915
  598    HD2  PRO  78           2HD      PRO  78  -1.117  -6.696  -0.114
  599    HD3  PRO  78           1HD      PRO  78  -1.231  -7.958   1.134
  600    H    THR  79           H        THR  79  -4.544  -9.120  -2.899
  601    HA   THR  79           HA       THR  79  -4.420  -6.601  -4.424
  602    HB   THR  79           HB       THR  79  -3.496  -7.775  -6.137
  603    HG1  THR  79           1HG      THR  79  -5.586  -9.676  -5.897
  604   HG21  THR  79          3HG2      THR  79  -3.601  -9.973  -4.137
  605   HG22  THR  79          1HG2      THR  79  -2.219  -9.181  -4.892
  606   HG23  THR  79          2HG2      THR  79  -3.182 -10.335  -5.809
  607    H    ILE  80           H        ILE  80  -6.105  -5.687  -4.228
  608    HA   ILE  80           HA       ILE  80  -8.680  -6.761  -5.102
  609    HB   ILE  80           HB       ILE  80  -7.996  -5.076  -2.701
  610   HG12  ILE  80          2HG1      ILE  80 -10.167  -6.528  -2.024
  611   HG13  ILE  80          1HG1      ILE  80  -9.496  -7.547  -3.292
  612   HG21  ILE  80          1HG2      ILE  80 -10.083  -4.059  -2.492
  613   HG22  ILE  80          2HG2      ILE  80 -10.801  -5.041  -3.763
  614   HG23  ILE  80          3HG2      ILE  80  -9.644  -3.778  -4.168
  615   HD11  ILE  80          3HD1      ILE  80  -8.774  -7.527  -0.633
  616   HD12  ILE  80          1HD1      ILE  80  -7.469  -6.648  -1.433
  617   HD13  ILE  80          2HD1      ILE  80  -7.884  -8.280  -1.959
  618    H    PHE  81           H        PHE  81  -9.652  -5.155  -6.689
  619    HA   PHE  81           HA       PHE  81  -9.557  -3.365  -8.123
  620    HB2  PHE  81           2HB      PHE  81  -8.106  -1.344  -7.464
  621    HB3  PHE  81           1HB      PHE  81  -9.422  -1.752  -6.375
  622    HD1  PHE  81           1HD      PHE  81  -5.719  -2.093  -6.816
  623    HD2  PHE  81           2HD      PHE  81  -9.005  -2.125  -4.097
  624    HE1  PHE  81           1HE      PHE  81  -4.157  -2.273  -4.924
  625    HE2  PHE  81           2HE      PHE  81  -7.444  -2.310  -2.209
  626    HZ   PHE  81           HZ       PHE  81  -5.011  -2.413  -2.609
  Start of MODEL   10
    1    H1   GLY   1           1HT      GLY   1   8.927  14.624  -4.174
    2    H2   GLY   1           2HT      GLY   1   7.365  15.226  -4.415
    3    H3   GLY   1           3HT      GLY   1   7.696  14.248  -3.074
    4    HA2  GLY   1           1HA      GLY   1   9.484  16.202  -2.706
    5    HA3  GLY   1           2HA      GLY   1   8.168  17.080  -3.471
    6    H    SER   2           H        SER   2   5.990  16.768  -2.501
    7    HA   SER   2           HA       SER   2   6.001  17.411   0.214
    8    HB2  SER   2           2HB      SER   2   3.788  17.798  -0.091
    9    HB3  SER   2           1HB      SER   2   4.138  17.488  -1.789
   10    HG   SER   2           HG       SER   2   2.744  15.966   0.033
   11    HA   PRO   3           HA       PRO   3   5.979  13.602   2.436
   12    HB2  PRO   3           2HB      PRO   3   3.954  13.846   4.225
   13    HB3  PRO   3           1HB      PRO   3   5.463  14.760   4.352
   14    HG2  PRO   3           2HG      PRO   3   2.809  15.625   3.272
   15    HG3  PRO   3           1HG      PRO   3   3.928  16.507   4.326
   16    HD2  PRO   3           2HD      PRO   3   3.764  16.966   1.663
   17    HD3  PRO   3           1HD      PRO   3   5.279  17.144   2.571
   18    H    GLY   4           H        GLY   4   4.914  12.997   0.051
   19    HA2  GLY   4           2HA      GLY   4   2.521  11.410   0.732
   20    HA3  GLY   4           1HA      GLY   4   2.723  12.194  -0.831
   21    H    PHE   5           H        PHE   5   2.242   9.622  -1.228
   22    HA   PHE   5           HA       PHE   5   4.810   8.505  -1.994
   23    HB2  PHE   5           2HB      PHE   5   2.947   7.010  -0.147
   24    HB3  PHE   5           1HB      PHE   5   4.438   6.388  -0.828
   25    HD1  PHE   5           2HD      PHE   5   6.594   7.746  -0.277
   26    HD2  PHE   5           1HD      PHE   5   2.961   7.999   1.924
   27    HE1  PHE   5           2HE      PHE   5   7.830   8.636   1.655
   28    HE2  PHE   5           1HE      PHE   5   4.191   8.888   3.862
   29    HZ   PHE   5           HZ       PHE   5   6.628   9.208   3.729
   30    H    THR   6           H        THR   6   1.304   8.111  -1.955
   31    HA   THR   6           HA       THR   6  -0.154   7.598  -3.656
   32    HB   THR   6           HB       THR   6   0.506   7.212  -5.854
   33    HG1  THR   6           1HG      THR   6   1.767   5.437  -5.712
   34   HG21  THR   6          3HG2      THR   6   1.694   9.023  -6.318
   35   HG22  THR   6          1HG2      THR   6   3.100   8.432  -5.434
   36   HG23  THR   6          2HG2      THR   6   1.804   9.263  -4.576
   37    H    CYS   7           H        CYS   7  -1.344   5.912  -2.866
   38    HA   CYS   7           HA       CYS   7  -0.108   3.344  -2.330
   39    HB2  CYS   7           2HB      CYS   7  -1.772   3.182  -0.807
   40    HB3  CYS   7           1HB      CYS   7  -2.572   4.621  -1.413
   41    H    CYS   8           H        CYS   8  -0.898   4.821  -5.091
   42    HA   CYS   8           HA       CYS   8  -1.433   4.135  -7.189
   43    HB2  CYS   8           2HB      CYS   8   0.283   2.529  -7.030
   44    HB3  CYS   8           1HB      CYS   8  -0.601   1.542  -5.878
   45    HG   CYS   8           HG       CYS   8  -0.681   1.257  -8.875
   46    H    VAL   9           H        VAL   9  -3.279   4.663  -5.287
   47    HA   VAL   9           HA       VAL   9  -5.401   2.789  -5.087
   48    HB   VAL   9           HB       VAL   9  -5.278   4.282  -3.313
   49   HG11  VAL   9          1HG1      VAL   9  -5.274   6.849  -3.906
   50   HG12  VAL   9          2HG1      VAL   9  -4.544   6.244  -5.392
   51   HG13  VAL   9          3HG1      VAL   9  -3.794   5.896  -3.836
   52   HG21  VAL   9          3HG2      VAL   9  -7.262   5.824  -4.957
   53   HG22  VAL   9          1HG2      VAL   9  -7.241   5.560  -3.207
   54   HG23  VAL   9          2HG2      VAL   9  -7.614   4.223  -4.308
   55    HA   PRO  10           HA       PRO  10  -6.937   3.993  -9.206
   56    HB2  PRO  10           2HB      PRO  10  -8.364   1.753  -9.633
   57    HB3  PRO  10           1HB      PRO  10  -6.606   1.776  -9.825
   58    HG2  PRO  10           2HG      PRO  10  -8.244   0.796  -7.512
   59    HG3  PRO  10           1HG      PRO  10  -6.837   0.045  -8.286
   60    HD2  PRO  10           2HD      PRO  10  -6.658   1.472  -5.971
   61    HD3  PRO  10           1HD      PRO  10  -5.347   1.361  -7.157
   62    H    GLY  11           H        GLY  11  -8.728   2.463  -6.585
   63    HA2  GLY  11           2HA      GLY  11 -10.724   4.545  -6.626
   64    HA3  GLY  11           1HA      GLY  11 -11.320   2.965  -7.114
   65    H    CYS  12           H        CYS  12  -8.752   2.894  -4.827
   66    HA   CYS  12           HA       CYS  12 -10.349   1.606  -2.912
   67    HB2  CYS  12           2HB      CYS  12  -8.422   1.322  -1.649
   68    HB3  CYS  12           1HB      CYS  12  -7.754   1.513  -3.258
   69    H    TYR  13           H        TYR  13  -9.391   2.964  -0.477
   70    HA   TYR  13           HA       TYR  13 -11.493   4.937  -0.306
   71    HB2  TYR  13           2HB      TYR  13 -10.707   3.029   1.383
   72    HB3  TYR  13           1HB      TYR  13  -9.809   4.392   2.029
   73    HD1  TYR  13           1HD      TYR  13 -12.226   6.281   0.940
   74    HD2  TYR  13           2HD      TYR  13 -11.882   2.972   3.595
   75    HE1  TYR  13           1HE      TYR  13 -14.234   7.041   2.138
   76    HE2  TYR  13           2HE      TYR  13 -13.890   3.722   4.796
   77    HH   TYR  13           HH       TYR  13 -15.118   5.895   5.151
   78    H    ASN  14           H        ASN  14  -8.130   4.712   0.271
   79    HA   ASN  14           HA       ASN  14  -7.822   7.608   0.429
   80    HB2  ASN  14           2HB      ASN  14  -5.707   6.403   1.768
   81    HB3  ASN  14           1HB      ASN  14  -7.017   7.313   2.469
   82   HD21  ASN  14          1HD2      ASN  14  -7.084   4.146   0.913
   83   HD22  ASN  14          2HD2      ASN  14  -7.669   3.298   2.272
   84    H    ASN  15           H        ASN  15  -5.612   8.507  -0.224
   85    HA   ASN  15           HA       ASN  15  -4.331   6.700  -2.150
   86    HB2  ASN  15           2HB      ASN  15  -3.636   9.582  -2.265
   87    HB3  ASN  15           1HB      ASN  15  -3.937   8.457  -3.582
   88   HD21  ASN  15          1HD2      ASN  15  -6.518   7.625  -2.761
   89   HD22  ASN  15          2HD2      ASN  15  -7.598   8.948  -2.996
   90    H    SER  16           H        SER  16  -1.720   7.115  -2.223
   91    HA   SER  16           HA       SER  16  -0.967   7.319   0.576
   92    HB2  SER  16           2HB      SER  16  -0.366   5.204  -0.850
   93    HB3  SER  16           1HB      SER  16   0.834   6.194  -1.610
   94    HG   SER  16           HG       SER  16   1.874   5.305   0.066
   95    H    HIS  17           H        HIS  17  -1.311   9.652  -1.541
   96    HA   HIS  17           HA       HIS  17   0.961  11.118  -0.537
   97    HB2  HIS  17           2HB      HIS  17   2.114  11.542  -2.493
   98    HB3  HIS  17           1HB      HIS  17   1.620   9.882  -2.778
   99    HD1  HIS  17           1HD      HIS  17  -0.919   9.873  -4.095
  100    HD2  HIS  17           2HD      HIS  17   1.678  13.068  -4.658
  101    HE1  HIS  17           1HE      HIS  17  -1.656  10.969  -6.234
  102    HE2  HIS  17           2HE      HIS  17  -0.022  12.852  -6.596
  103    H    ARG  18           H        ARG  18  -2.130  11.215  -0.719
  104    HA   ARG  18           HA       ARG  18  -2.243  13.915  -1.856
  105    HB2  ARG  18           2HB      ARG  18  -3.762  12.818  -3.132
  106    HB3  ARG  18           1HB      ARG  18  -4.204  11.672  -1.879
  107    HG2  ARG  18           2HG      ARG  18  -5.971  12.912  -1.267
  108    HG3  ARG  18           1HG      ARG  18  -5.026  14.404  -1.250
  109    HD2  ARG  18           2HD      ARG  18  -5.465  13.372  -3.930
  110    HD3  ARG  18           1HD      ARG  18  -6.975  13.711  -3.082
  111    HE   ARG  18           HE       ARG  18  -5.196  15.879  -2.774
  112   HH11  ARG  18          1HH1      ARG  18  -7.212  14.347  -5.177
  113   HH12  ARG  18          2HH1      ARG  18  -7.470  15.805  -6.073
  114   HH21  ARG  18          1HH2      ARG  18  -5.534  17.799  -3.953
  115   HH22  ARG  18          2HH2      ARG  18  -6.516  17.765  -5.378
  116    H    ASP  19           H        ASP  19  -4.301  12.334   0.694
  117    HA   ASP  19           HA       ASP  19  -4.222  14.842   2.123
  118    HB2  ASP  19           2HB      ASP  19  -5.926  12.472   2.152
  119    HB3  ASP  19           1HB      ASP  19  -5.753  13.303   3.690
  120    H    LYS  20           H        LYS  20  -2.918  11.615   2.687
  121    HA   LYS  20           HA       LYS  20  -1.638  10.769   4.317
  122    HB2  LYS  20           2HB      LYS  20   0.186  12.052   4.006
  123    HB3  LYS  20           1HB      LYS  20  -0.744  13.534   3.916
  124    HG2  LYS  20           2HG      LYS  20   0.722  13.779   5.734
  125    HG3  LYS  20           1HG      LYS  20  -0.859  13.458   6.446
  126    HD2  LYS  20           2HD      LYS  20   0.254  11.912   7.650
  127    HD3  LYS  20           1HD      LYS  20   0.127  10.936   6.186
  128    HE2  LYS  20           2HE      LYS  20   2.333  10.959   5.897
  129    HE3  LYS  20           1HE      LYS  20   2.392  12.715   6.043
  130    HZ1  LYS  20           3HZ      LYS  20   3.494  11.014   7.792
  131    HZ2  LYS  20           1HZ      LYS  20   2.000  11.301   8.535
  132    HZ3  LYS  20           2HZ      LYS  20   3.029  12.594   8.174
  133    H    ALA  21           H        ALA  21  -4.396  12.205   4.858
  134    HA   ALA  21           HA       ALA  21  -4.187  12.089   7.803
  135    HB1  ALA  21           1HB      ALA  21  -6.468  13.376   7.570
  136    HB2  ALA  21           2HB      ALA  21  -5.812  13.806   5.990
  137    HB3  ALA  21           3HB      ALA  21  -4.930  14.231   7.458
  138    H    LEU  22           H        LEU  22  -4.588   9.875   5.857
  139    HA   LEU  22           HA       LEU  22  -7.251   8.917   6.658
  140    HB2  LEU  22           2HB      LEU  22  -5.720   7.637   4.425
  141    HB3  LEU  22           1HB      LEU  22  -7.454   7.908   4.575
  142    HG   LEU  22           HG       LEU  22  -5.836  10.343   4.247
  143   HD11  LEU  22          1HD1      LEU  22  -6.304   9.170   1.657
  144   HD12  LEU  22          2HD1      LEU  22  -5.208   8.176   2.615
  145   HD13  LEU  22          3HD1      LEU  22  -4.831   9.870   2.326
  146   HD21  LEU  22          3HD2      LEU  22  -7.918  11.040   3.888
  147   HD22  LEU  22          1HD2      LEU  22  -8.523   9.386   3.831
  148   HD23  LEU  22          2HD2      LEU  22  -7.899  10.146   2.366
  149    H    HIS  23           H        HIS  23  -6.778   6.054   6.281
  150    HA   HIS  23           HA       HIS  23  -5.010   5.619   8.538
  151    HB2  HIS  23           2HB      HIS  23  -7.496   4.603   7.787
  152    HB3  HIS  23           1HB      HIS  23  -6.389   3.272   7.479
  153    HD1  HIS  23           1HD      HIS  23  -5.903   5.675  10.332
  154    HD2  HIS  23           2HD      HIS  23  -7.172   1.774   9.675
  155    HE1  HIS  23           1HE      HIS  23  -6.070   4.630  12.613
  156    HE2  HIS  23           2HE      HIS  23  -6.941   2.302  12.196
  157    H    PHE  24           H        PHE  24  -2.932   4.491   8.227
  158    HA   PHE  24           HA       PHE  24  -2.588   3.281   5.599
  159    HB2  PHE  24           2HB      PHE  24  -0.599   4.996   7.072
  160    HB3  PHE  24           1HB      PHE  24  -0.282   4.152   5.563
  161    HD1  PHE  24           2HD      PHE  24  -2.848   6.479   6.971
  162    HD2  PHE  24           1HD      PHE  24  -0.428   5.451   3.610
  163    HE1  PHE  24           2HE      PHE  24  -3.751   8.384   5.709
  164    HE2  PHE  24           1HE      PHE  24  -1.334   7.344   2.372
  165    HZ   PHE  24           HZ       PHE  24  -2.997   8.818   3.400
  166    H    TYR  25           H        TYR  25  -1.705   1.095   5.648
  167    HA   TYR  25           HA       TYR  25  -0.968   0.005   8.222
  168    HB2  TYR  25           2HB      TYR  25  -1.167  -1.287   5.473
  169    HB3  TYR  25           1HB      TYR  25  -0.685  -2.148   6.918
  170    HD1  TYR  25           1HD      TYR  25  -3.470   0.257   6.194
  171    HD2  TYR  25           2HD      TYR  25  -2.313  -3.596   7.581
  172    HE1  TYR  25           1HE      TYR  25  -5.825  -0.268   6.676
  173    HE2  TYR  25           2HE      TYR  25  -4.659  -4.141   8.072
  174    HH   TYR  25           HH       TYR  25  -6.924  -3.384   7.300
  175    H    THR  26           H        THR  26   1.228  -1.147   8.518
  176    HA   THR  26           HA       THR  26   3.250   0.256   6.909
  177    HB   THR  26           HB       THR  26   4.489   0.519   8.791
  178    HG1  THR  26           1HG      THR  26   5.355  -1.322   9.296
  179   HG21  THR  26          3HG2      THR  26   3.380   0.648  10.854
  180   HG22  THR  26          1HG2      THR  26   2.206  -0.586  10.390
  181   HG23  THR  26          2HG2      THR  26   2.162   1.006   9.628
  182    H    PHE  27           H        PHE  27   5.450  -1.086   6.855
  183    HA   PHE  27           HA       PHE  27   4.747  -3.362   5.335
  184    HB2  PHE  27           2HB      PHE  27   6.891  -1.510   5.483
  185    HB3  PHE  27           1HB      PHE  27   7.457  -3.124   5.132
  186    HD1  PHE  27           1HD      PHE  27   4.155  -2.010   4.076
  187    HD2  PHE  27           2HD      PHE  27   8.227  -2.472   2.941
  188    HE1  PHE  27           1HE      PHE  27   3.537  -1.732   1.731
  189    HE2  PHE  27           2HE      PHE  27   7.614  -2.219   0.612
  190    HZ   PHE  27           HZ       PHE  27   5.242  -1.841  -0.026
  191    HA   PRO  28           HA       PRO  28   5.842  -6.907   7.980
  192    HB2  PRO  28           2HB      PRO  28   7.064  -7.631   5.292
  193    HB3  PRO  28           1HB      PRO  28   6.259  -8.717   6.420
  194    HG2  PRO  28           2HG      PRO  28   4.915  -7.793   4.399
  195    HG3  PRO  28           1HG      PRO  28   4.155  -7.744   5.994
  196    HD2  PRO  28           2HD      PRO  28   5.261  -5.546   4.347
  197    HD3  PRO  28           1HD      PRO  28   3.940  -5.546   5.506
  198    H    LYS  29           H        LYS  29   7.983  -8.195   8.450
  199    HA   LYS  29           HA       LYS  29  10.164  -6.280   8.606
  200    HB2  LYS  29           2HB      LYS  29  10.695  -8.946   9.691
  201    HB3  LYS  29           1HB      LYS  29  10.824  -7.374  10.460
  202    HG2  LYS  29           2HG      LYS  29   8.411  -7.384  10.878
  203    HG3  LYS  29           1HG      LYS  29   8.295  -8.972  10.117
  204    HD2  LYS  29           2HD      LYS  29  10.295  -9.314  11.982
  205    HD3  LYS  29           1HD      LYS  29   9.157  -8.245  12.804
  206    HE2  LYS  29           2HE      LYS  29   8.761 -10.707  13.135
  207    HE3  LYS  29           1HE      LYS  29   7.378  -9.791  12.536
  208    HZ1  LYS  29           3HZ      LYS  29   9.163 -11.069  10.590
  209    HZ2  LYS  29           1HZ      LYS  29   7.501 -10.763  10.490
  210    HZ3  LYS  29           2HZ      LYS  29   8.071 -12.041  11.440
  211    H    ASP  30           H        ASP  30   9.256  -8.992   6.736
  212    HA   ASP  30           HA       ASP  30  11.940  -9.696   5.902
  213    HB2  ASP  30           2HB      ASP  30   9.926 -10.721   4.136
  214    HB3  ASP  30           1HB      ASP  30  10.929 -11.624   5.260
  215    H    ALA  31           H        ALA  31  13.054  -8.412   4.493
  216    HA   ALA  31           HA       ALA  31  12.137  -6.260   3.169
  217    HB1  ALA  31           1HB      ALA  31  14.124  -6.834   1.516
  218    HB2  ALA  31           2HB      ALA  31  14.472  -8.037   2.763
  219    HB3  ALA  31           3HB      ALA  31  14.380  -6.334   3.182
  220    H    GLU  32           H        GLU  32  12.620  -9.349   1.234
  221    HA   GLU  32           HA       GLU  32  11.336  -8.393  -1.060
  222    HB2  GLU  32           2HB      GLU  32  12.514 -10.416  -1.224
  223    HB3  GLU  32           1HB      GLU  32  11.646 -11.215   0.025
  224    HG2  GLU  32           2HG      GLU  32  10.320 -10.352  -2.525
  225    HG3  GLU  32           1HG      GLU  32  11.186 -11.881  -2.394
  226    H    LEU  33           H        LEU  33   9.524 -10.491   1.359
  227    HA   LEU  33           HA       LEU  33   7.130 -10.279   0.175
  228    HB2  LEU  33           2HB      LEU  33   7.746 -11.094   2.579
  229    HB3  LEU  33           1HB      LEU  33   7.367  -9.470   3.066
  230    HG   LEU  33           HG       LEU  33   5.240  -9.975   3.221
  231   HD11  LEU  33          1HD1      LEU  33   3.909 -10.745   1.280
  232   HD12  LEU  33          2HD1      LEU  33   5.404 -10.958   0.374
  233   HD13  LEU  33          3HD1      LEU  33   4.921  -9.352   0.914
  234   HD21  LEU  33          3HD2      LEU  33   6.293 -12.633   2.421
  235   HD22  LEU  33          1HD2      LEU  33   4.560 -12.401   2.635
  236   HD23  LEU  33          2HD2      LEU  33   5.659 -12.096   3.976
  237    H    ARG  34           H        ARG  34   8.870  -7.779   1.765
  238    HA   ARG  34           HA       ARG  34   6.956  -5.737   1.797
  239    HB2  ARG  34           2HB      ARG  34   8.565  -4.375   2.644
  240    HB3  ARG  34           1HB      ARG  34   9.404  -5.893   2.870
  241    HG2  ARG  34           2HG      ARG  34  11.110  -4.907   1.844
  242    HG3  ARG  34           1HG      ARG  34  10.208  -5.100   0.352
  243    HD2  ARG  34           2HD      ARG  34  10.534  -2.883   0.213
  244    HD3  ARG  34           1HD      ARG  34   9.108  -2.840   1.238
  245    HE   ARG  34           HE       ARG  34  10.392  -1.990   2.915
  246   HH11  ARG  34          1HH1      ARG  34  12.488  -3.554   0.603
  247   HH12  ARG  34          2HH1      ARG  34  13.944  -3.035   1.385
  248   HH21  ARG  34          1HH2      ARG  34  12.306  -1.307   3.943
  249   HH22  ARG  34          2HH2      ARG  34  13.842  -1.762   3.282
  250    H    ARG  35           H        ARG  35   9.587  -6.221  -0.511
  251    HA   ARG  35           HA       ARG  35   8.741  -4.213  -2.226
  252    HB2  ARG  35           2HB      ARG  35  10.180  -5.068  -3.877
  253    HB3  ARG  35           1HB      ARG  35  10.958  -5.420  -2.349
  254    HG2  ARG  35           2HG      ARG  35  11.275  -7.281  -3.758
  255    HG3  ARG  35           1HG      ARG  35  10.099  -7.768  -2.552
  256    HD2  ARG  35           2HD      ARG  35   8.590  -8.224  -4.135
  257    HD3  ARG  35           1HD      ARG  35   8.788  -6.624  -4.851
  258    HE   ARG  35           HE       ARG  35  10.878  -8.513  -5.488
  259   HH11  ARG  35          1HH1      ARG  35   7.789  -7.185  -6.434
  260   HH12  ARG  35          2HH1      ARG  35   7.971  -7.626  -8.099
  261   HH21  ARG  35          1HH2      ARG  35  11.113  -9.094  -7.677
  262   HH22  ARG  35          2HH2      ARG  35   9.855  -8.710  -8.804
  263    H    LEU  36           H        LEU  36   7.601  -7.526  -1.749
  264    HA   LEU  36           HA       LEU  36   6.045  -7.546  -4.197
  265    HB2  LEU  36           2HB      LEU  36   5.653  -8.958  -1.565
  266    HB3  LEU  36           1HB      LEU  36   4.496  -9.103  -2.865
  267    HG   LEU  36           HG       LEU  36   7.380  -9.981  -2.894
  268   HD11  LEU  36          1HD1      LEU  36   5.732 -11.430  -1.726
  269   HD12  LEU  36          2HD1      LEU  36   6.491 -12.189  -3.124
  270   HD13  LEU  36          3HD1      LEU  36   4.845 -11.568  -3.244
  271   HD21  LEU  36          3HD2      LEU  36   6.650 -10.912  -5.184
  272   HD22  LEU  36          1HD2      LEU  36   7.082  -9.205  -5.067
  273   HD23  LEU  36          2HD2      LEU  36   5.386  -9.684  -5.109
  274    H    TRP  37           H        TRP  37   5.247  -6.384  -0.942
  275    HA   TRP  37           HA       TRP  37   2.644  -5.590  -1.665
  276    HB2  TRP  37           2HB      TRP  37   4.566  -4.780   0.483
  277    HB3  TRP  37           1HB      TRP  37   3.073  -3.874   0.242
  278    HD1  TRP  37           HD       TRP  37   3.221  -7.629  -0.317
  279    HE1  TRP  37           1HE      TRP  37   1.797  -8.789   1.542
  280    HE3  TRP  37           3HE      TRP  37   2.052  -3.560   2.455
  281    HZ2  TRP  37           2HZ      TRP  37   0.321  -7.981   3.867
  282    HZ3  TRP  37           3HZ      TRP  37   0.677  -3.784   4.434
  283    HH2  TRP  37           HH       TRP  37  -0.194  -5.908   5.107
  284    H    LEU  38           H        LEU  38   5.865  -3.994  -1.949
  285    HA   LEU  38           HA       LEU  38   5.212  -1.396  -2.519
  286    HB2  LEU  38           2HB      LEU  38   7.116  -3.222  -4.030
  287    HB3  LEU  38           1HB      LEU  38   6.976  -1.526  -4.332
  288    HG   LEU  38           HG       LEU  38   8.006  -2.875  -1.884
  289   HD11  LEU  38          1HD1      LEU  38  10.021  -2.057  -2.463
  290   HD12  LEU  38          2HD1      LEU  38   9.344  -0.581  -3.150
  291   HD13  LEU  38          3HD1      LEU  38   9.308  -2.079  -4.077
  292   HD21  LEU  38          3HD2      LEU  38   8.130  -0.701  -0.798
  293   HD22  LEU  38          1HD2      LEU  38   6.460  -1.131  -1.147
  294   HD23  LEU  38          2HD2      LEU  38   7.295   0.039  -2.164
  295    H    LYS  39           H        LYS  39   4.978  -4.294  -4.713
  296    HA   LYS  39           HA       LYS  39   3.931  -3.075  -6.888
  297    HB2  LYS  39           2HB      LYS  39   3.426  -5.880  -5.845
  298    HB3  LYS  39           1HB      LYS  39   3.130  -5.345  -7.473
  299    HG2  LYS  39           2HG      LYS  39   5.805  -4.707  -6.686
  300    HG3  LYS  39           1HG      LYS  39   5.457  -6.405  -6.391
  301    HD2  LYS  39           2HD      LYS  39   6.380  -6.031  -8.635
  302    HD3  LYS  39           1HD      LYS  39   4.751  -6.703  -8.682
  303    HE2  LYS  39           2HE      LYS  39   4.740  -5.023 -10.315
  304    HE3  LYS  39           1HE      LYS  39   3.953  -4.285  -8.922
  305    HZ1  LYS  39           3HZ      LYS  39   5.482  -2.717  -9.765
  306    HZ2  LYS  39           1HZ      LYS  39   6.729  -3.857  -9.867
  307    HZ3  LYS  39           2HZ      LYS  39   6.182  -3.333  -8.354
  308    H    ASN  40           H        ASN  40   1.882  -4.524  -4.296
  309    HA   ASN  40           HA       ASN  40  -0.519  -3.759  -5.507
  310    HB2  ASN  40           2HB      ASN  40  -0.750  -3.822  -2.612
  311    HB3  ASN  40           1HB      ASN  40  -1.492  -4.847  -3.824
  312   HD21  ASN  40          1HD2      ASN  40   0.415  -6.251  -4.930
  313   HD22  ASN  40          2HD2      ASN  40   1.291  -7.179  -3.766
  314    H    VAL  41           H        VAL  41   1.520  -2.081  -3.242
  315    HA   VAL  41           HA       VAL  41  -0.433  -0.046  -2.874
  316    HB   VAL  41           HB       VAL  41   1.487  -0.820  -1.195
  317   HG11  VAL  41          1HG1      VAL  41   2.520   1.882  -1.809
  318   HG12  VAL  41          2HG1      VAL  41   3.080   0.576  -2.848
  319   HG13  VAL  41          3HG1      VAL  41   3.342   0.492  -1.107
  320   HG21  VAL  41          3HG2      VAL  41   0.720   1.996  -0.885
  321   HG22  VAL  41          1HG2      VAL  41   0.409   0.614   0.158
  322   HG23  VAL  41          2HG2      VAL  41  -0.619   0.903  -1.240
  323    H    SER  42           H        SER  42   2.119  -0.413  -5.223
  324    HA   SER  42           HA       SER  42   1.435   1.557  -6.841
  325    HB2  SER  42           2HB      SER  42   1.217   3.485  -5.565
  326    HB3  SER  42           1HB      SER  42   2.304   2.909  -4.293
  327    HG   SER  42           HG       SER  42   3.001   4.048  -6.805
  328    H    ARG  43           H        ARG  43   4.724   2.460  -5.565
  329    HA   ARG  43           HA       ARG  43   6.660   2.320  -6.820
  330    HB2  ARG  43           2HB      ARG  43   6.626   0.403  -5.214
  331    HB3  ARG  43           1HB      ARG  43   6.007  -0.612  -6.508
  332    HG2  ARG  43           2HG      ARG  43   8.146  -1.102  -6.892
  333    HG3  ARG  43           1HG      ARG  43   8.221   0.482  -7.667
  334    HD2  ARG  43           2HD      ARG  43   8.579   0.441  -4.739
  335    HD3  ARG  43           1HD      ARG  43   9.870  -0.294  -5.685
  336    HE   ARG  43           HE       ARG  43   9.141   2.513  -5.598
  337   HH11  ARG  43          1HH1      ARG  43  10.962   0.014  -7.222
  338   HH12  ARG  43          2HH1      ARG  43  12.062   1.127  -7.963
  339   HH21  ARG  43          1HH2      ARG  43  10.587   3.973  -6.575
  340   HH22  ARG  43          2HH2      ARG  43  11.850   3.371  -7.597
  341    H    ALA  44           H        ALA  44   4.458   2.680  -8.573
  342    HA   ALA  44           HA       ALA  44   4.500   0.787 -10.707
  343    HB1  ALA  44           1HB      ALA  44   3.345   3.526 -10.337
  344    HB2  ALA  44           2HB      ALA  44   2.522   1.980 -10.548
  345    HB3  ALA  44           3HB      ALA  44   3.315   2.750 -11.923
  346    H    GLY  45           H        GLY  45   7.134   0.875 -10.847
  347    HA2  GLY  45           2HA      GLY  45   7.714   2.902 -12.903
  348    HA3  GLY  45           1HA      GLY  45   8.876   2.559 -11.651
  349    H    VAL  46           H        VAL  46   9.583   0.168 -11.589
  350    HA   VAL  46           HA       VAL  46  10.810  -1.424 -12.697
  351    HB   VAL  46           HB       VAL  46   8.555  -2.064 -14.487
  352   HG11  VAL  46          1HG1      VAL  46  10.433  -3.574 -14.100
  353   HG12  VAL  46          2HG1      VAL  46   8.905  -4.289 -13.583
  354   HG13  VAL  46          3HG1      VAL  46  10.026  -3.640 -12.384
  355   HG21  VAL  46          3HG2      VAL  46   8.207  -1.931 -11.502
  356   HG22  VAL  46          1HG2      VAL  46   7.187  -2.903 -12.562
  357   HG23  VAL  46          2HG2      VAL  46   7.233  -1.150 -12.746
  358    H    SER  47           H        SER  47  11.445   0.996 -13.905
  359    HA   SER  47           HA       SER  47  12.407   0.100 -16.417
  360    HB2  SER  47           2HB      SER  47  10.928   0.948 -17.959
  361    HB3  SER  47           1HB      SER  47   9.781   0.630 -16.652
  362    HG   SER  47           HG       SER  47   9.862   2.822 -17.776
  363    H    GLY  48           H        GLY  48  11.165   3.410 -15.142
  364    HA2  GLY  48           2HA      GLY  48  13.883   4.379 -15.769
  365    HA3  GLY  48           1HA      GLY  48  12.445   5.378 -15.608
  366    H    CYS  49           H        CYS  49  12.680   2.973 -13.221
  367    HA   CYS  49           HA       CYS  49  13.380   2.946 -11.042
  368    HB2  CYS  49           2HB      CYS  49  15.299   4.529 -12.144
  369    HB3  CYS  49           1HB      CYS  49  14.569   5.645 -10.996
  370    HG   CYS  49           HG       CYS  49  16.597   4.155 -10.000
  371    H    PHE  50           H        PHE  50  11.631   5.525 -12.476
  372    HA   PHE  50           HA       PHE  50   9.910   6.824 -11.784
  373    HB2  PHE  50           2HB      PHE  50   9.654   4.391 -10.385
  374    HB3  PHE  50           1HB      PHE  50   9.433   5.639  -9.162
  375    HD1  PHE  50           1HD      PHE  50   8.490   5.695 -12.757
  376    HD2  PHE  50           2HD      PHE  50   7.158   5.607  -8.716
  377    HE1  PHE  50           1HE      PHE  50   6.174   6.027 -13.518
  378    HE2  PHE  50           2HE      PHE  50   4.839   5.937  -9.469
  379    HZ   PHE  50           HZ       PHE  50   4.344   6.148 -11.872
  380    H    SER  51           H        SER  51  11.359   6.003  -8.506
  381    HA   SER  51           HA       SER  51  12.287   7.347  -6.937
  382    HB2  SER  51           2HB      SER  51  13.655   7.986  -9.114
  383    HB3  SER  51           1HB      SER  51  12.831   9.531  -8.899
  384    HG   SER  51           HG       SER  51  14.686   8.249  -7.227
  385    H    THR  52           H        THR  52   9.494   8.033  -8.451
  386    HA   THR  52           HA       THR  52   8.935  10.689  -7.702
  387    HB   THR  52           HB       THR  52   6.599  10.110  -8.128
  388    HG1  THR  52           1HG      THR  52   6.126   7.898  -8.647
  389   HG21  THR  52          3HG2      THR  52   6.833   9.948 -10.340
  390   HG22  THR  52          1HG2      THR  52   7.742   8.440 -10.232
  391   HG23  THR  52          2HG2      THR  52   8.566   9.987 -10.015
  392    H    PHE  53           H        PHE  53   8.859   7.686  -5.919
  393    HA   PHE  53           HA       PHE  53   8.431   9.107  -3.449
  394    HB2  PHE  53           2HB      PHE  53   6.478   7.518  -2.867
  395    HB3  PHE  53           1HB      PHE  53   6.125   8.896  -3.902
  396    HD1  PHE  53           2HD      PHE  53   6.993   5.280  -4.040
  397    HD2  PHE  53           1HD      PHE  53   5.103   8.573  -5.954
  398    HE1  PHE  53           2HE      PHE  53   6.120   3.768  -5.753
  399    HE2  PHE  53           1HE      PHE  53   4.218   7.060  -7.681
  400    HZ   PHE  53           HZ       PHE  53   4.726   4.651  -7.579
  401    H    GLN  54           H        GLN  54  10.701   7.851  -4.013
  402    HA   GLN  54           HA       GLN  54  11.375   5.342  -3.925
  403    HB2  GLN  54           2HB      GLN  54  12.871   7.286  -3.423
  404    HB3  GLN  54           1HB      GLN  54  12.364   7.174  -1.744
  405    HG2  GLN  54           2HG      GLN  54  13.174   4.712  -1.951
  406    HG3  GLN  54           1HG      GLN  54  14.077   5.325  -3.333
  407   HE21  GLN  54          1HE2      GLN  54  16.104   5.262  -2.573
  408   HE22  GLN  54          2HE2      GLN  54  16.663   6.122  -1.182
  409    HA   PRO  55           HA       PRO  55   8.906   3.372  -0.707
  410    HB2  PRO  55           2HB      PRO  55  10.381   0.927  -1.297
  411    HB3  PRO  55           1HB      PRO  55   8.670   1.284  -1.529
  412    HG2  PRO  55           2HG      PRO  55  10.405   1.002  -3.600
  413    HG3  PRO  55           1HG      PRO  55   8.970   2.039  -3.671
  414    HD2  PRO  55           2HD      PRO  55  11.834   2.784  -3.253
  415    HD3  PRO  55           1HD      PRO  55  10.573   3.618  -4.189
  416    H    THR  56           H        THR  56  12.387   3.235  -1.006
  417    HA   THR  56           HA       THR  56  13.190   1.917   1.278
  418    HB   THR  56           HB       THR  56  14.484   4.557   0.660
  419    HG1  THR  56           1HG      THR  56  15.440   3.584  -1.193
  420   HG21  THR  56          3HG2      THR  56  15.839   3.405   2.084
  421   HG22  THR  56          1HG2      THR  56  16.467   2.856   0.531
  422   HG23  THR  56          2HG2      THR  56  15.361   1.831   1.447
  423    H    THR  57           H        THR  57  11.958   5.346   0.984
  424    HA   THR  57           HA       THR  57  12.394   6.145   3.608
  425    HB   THR  57           HB       THR  57  11.615   7.623   1.773
  426    HG1  THR  57           1HG      THR  57  10.032   7.554   4.118
  427   HG21  THR  57          3HG2      THR  57   9.671   5.818   1.269
  428   HG22  THR  57          1HG2      THR  57   9.627   7.504   0.750
  429   HG23  THR  57          2HG2      THR  57   8.784   7.009   2.219
  430    H    GLY  58           H        GLY  58   9.912   4.073   2.239
  431    HA2  GLY  58           2HA      GLY  58   9.146   2.404   4.002
  432    HA3  GLY  58           1HA      GLY  58   8.742   3.826   4.930
  433    H    HIS  59           H        HIS  59   7.772   2.095   1.850
  434    HA   HIS  59           HA       HIS  59   5.435   3.779   1.705
  435    HB2  HIS  59           2HB      HIS  59   6.657   1.749  -0.022
  436    HB3  HIS  59           1HB      HIS  59   4.907   1.625   0.047
  437    HD1  HIS  59           1HD      HIS  59   7.086   4.716  -0.080
  438    HD2  HIS  59           2HD      HIS  59   4.049   2.844  -2.250
  439    HE1  HIS  59           1HE      HIS  59   6.500   6.297  -1.934
  440    HE2  HIS  59           2HE      HIS  59   4.606   5.196  -3.167
  441    H    ARG  60           H        ARG  60   3.497   3.367   2.394
  442    HA   ARG  60           HA       ARG  60   3.022   1.004   4.109
  443    HB2  ARG  60           2HB      ARG  60   1.558   2.532   5.379
  444    HB3  ARG  60           1HB      ARG  60   3.179   3.165   5.230
  445    HG2  ARG  60           2HG      ARG  60   1.617   4.127   3.042
  446    HG3  ARG  60           1HG      ARG  60   0.789   4.457   4.558
  447    HD2  ARG  60           2HD      ARG  60   3.497   5.055   4.995
  448    HD3  ARG  60           1HD      ARG  60   3.084   5.748   3.431
  449    HE   ARG  60           HE       ARG  60   1.130   6.770   4.719
  450   HH11  ARG  60          1HH1      ARG  60   4.272   6.156   6.131
  451   HH12  ARG  60          2HH1      ARG  60   4.126   7.425   7.298
  452   HH21  ARG  60          1HH2      ARG  60   0.949   8.433   6.255
  453   HH22  ARG  60          2HH2      ARG  60   2.245   8.713   7.371
  454    H    LEU  61           H        LEU  61   0.470   0.539   4.211
  455    HA   LEU  61           HA       LEU  61  -0.608   0.541   1.467
  456    HB2  LEU  61           2HB      LEU  61  -0.048  -1.492   3.269
  457    HB3  LEU  61           1HB      LEU  61  -1.763  -1.271   3.486
  458    HG   LEU  61           HG       LEU  61  -0.557  -2.939   1.686
  459   HD11  LEU  61          1HD1      LEU  61  -2.915  -3.029   0.739
  460   HD12  LEU  61          2HD1      LEU  61  -3.292  -1.867   2.014
  461   HD13  LEU  61          3HD1      LEU  61  -2.642  -3.445   2.421
  462   HD21  LEU  61          3HD2      LEU  61  -1.321  -2.098  -0.512
  463   HD22  LEU  61          1HD2      LEU  61   0.098  -1.296   0.153
  464   HD23  LEU  61          2HD2      LEU  61  -1.476  -0.503   0.224
  465    H    CYS  62           H        CYS  62  -3.208   0.806   1.364
  466    HA   CYS  62           HA       CYS  62  -4.055   2.022   3.831
  467    HB2  CYS  62           2HB      CYS  62  -4.336   4.113   3.062
  468    HB3  CYS  62           1HB      CYS  62  -3.005   3.564   2.126
  469    H    SER  63           H        SER  63  -6.583   2.806   3.665
  470    HA   SER  63           HA       SER  63  -7.952   0.991   4.693
  471    HB2  SER  63           2HB      SER  63  -8.722   3.442   3.367
  472    HB3  SER  63           1HB      SER  63 -10.031   2.274   3.372
  473    HG   SER  63           HG       SER  63  -8.515   2.903   5.682
  474    H    VAL  64           H        VAL  64  -9.546   1.627   1.805
  475    HA   VAL  64           HA       VAL  64 -10.813  -0.900   2.016
  476    HB   VAL  64           HB       VAL  64 -12.262  -0.372   0.230
  477   HG11  VAL  64          1HG1      VAL  64 -13.231   0.868   1.795
  478   HG12  VAL  64          2HG1      VAL  64 -12.482   2.270   1.025
  479   HG13  VAL  64          3HG1      VAL  64 -11.683   1.472   2.382
  480   HG21  VAL  64          3HG2      VAL  64 -10.054   1.289  -0.666
  481   HG22  VAL  64          1HG2      VAL  64 -11.619   2.095  -0.748
  482   HG23  VAL  64          2HG2      VAL  64 -11.373   0.559  -1.579
  483    H    HIS  65           H        HIS  65  -8.220  -1.617   1.508
  484    HA   HIS  65           HA       HIS  65  -8.730  -3.228  -0.889
  485    HB2  HIS  65           2HB      HIS  65  -5.980  -2.866  -1.009
  486    HB3  HIS  65           1HB      HIS  65  -7.188  -2.143  -2.063
  487    HD1  HIS  65           1HD      HIS  65  -8.331   0.033  -0.413
  488    HD2  HIS  65           2HD      HIS  65  -4.274  -0.820  -0.507
  489    HE1  HIS  65           1HE      HIS  65  -7.203   2.084   0.430
  490    H    PHE  66           H        PHE  66  -9.214  -4.067   1.635
  491    HA   PHE  66           HA       PHE  66  -7.085  -6.045   2.016
  492    HB2  PHE  66           2HB      PHE  66  -8.145  -4.084   3.931
  493    HB3  PHE  66           1HB      PHE  66  -8.135  -5.723   4.561
  494    HD1  PHE  66           1HD      PHE  66  -5.839  -7.013   3.984
  495    HD2  PHE  66           2HD      PHE  66  -6.321  -2.804   4.360
  496    HE1  PHE  66           1HE      PHE  66  -3.443  -6.788   4.488
  497    HE2  PHE  66           2HE      PHE  66  -3.928  -2.569   4.866
  498    HZ   PHE  66           HZ       PHE  66  -2.489  -4.564   4.929
  499    H    GLN  67           H        GLN  67  -8.040  -8.069   3.358
  500    HA   GLN  67           HA       GLN  67 -10.758  -8.524   2.371
  501    HB2  GLN  67           2HB      GLN  67  -8.411 -10.256   2.939
  502    HB3  GLN  67           1HB      GLN  67 -10.012 -10.956   3.127
  503    HG2  GLN  67           2HG      GLN  67  -9.035 -11.346   0.904
  504    HG3  GLN  67           1HG      GLN  67 -10.559 -10.461   0.845
  505   HE21  GLN  67          1HE2      GLN  67  -7.293  -9.323   1.585
  506   HE22  GLN  67          2HE2      GLN  67  -7.207  -8.183   0.290
  507    H    GLY  68           H        GLY  68 -12.296  -7.929   4.321
  508    HA2  GLY  68           2HA      GLY  68 -13.120  -8.178   6.420
  509    HA3  GLY  68           1HA      GLY  68 -12.127  -9.614   6.580
  510    H    GLY  69           H        GLY  69  -9.658  -9.075   7.040
  511    HA2  GLY  69           2HA      GLY  69  -8.358  -7.029   7.868
  512    HA3  GLY  69           1HA      GLY  69  -9.660  -6.918   9.045
  513    H    ARG  70           H        ARG  70  -7.009  -7.149   9.814
  514    HA   ARG  70           HA       ARG  70  -5.799  -8.225  11.402
  515    HB2  ARG  70           2HB      ARG  70  -7.575  -8.917  12.703
  516    HB3  ARG  70           1HB      ARG  70  -8.282  -9.886  11.429
  517    HG2  ARG  70           2HG      ARG  70  -7.515 -11.361  13.113
  518    HG3  ARG  70           1HG      ARG  70  -6.418 -11.524  11.744
  519    HD2  ARG  70           2HD      ARG  70  -5.558 -11.272  14.245
  520    HD3  ARG  70           1HD      ARG  70  -4.664 -10.624  12.877
  521    HE   ARG  70           HE       ARG  70  -6.363  -9.053  14.699
  522   HH11  ARG  70          1HH1      ARG  70  -3.782  -9.234  12.344
  523   HH12  ARG  70          2HH1      ARG  70  -3.299  -7.590  12.570
  524   HH21  ARG  70          1HH2      ARG  70  -5.722  -6.890  14.984
  525   HH22  ARG  70          2HH2      ARG  70  -4.398  -6.261  14.063
  526    H    LYS  71           H        LYS  71  -6.404  -9.386   8.346
  527    HA   LYS  71           HA       LYS  71  -5.323 -10.832   6.954
  528    HB2  LYS  71           2HB      LYS  71  -3.448  -9.418   8.323
  529    HB3  LYS  71           1HB      LYS  71  -2.951 -11.053   8.687
  530    HG2  LYS  71           2HG      LYS  71  -2.254 -11.467   6.582
  531    HG3  LYS  71           1HG      LYS  71  -3.533 -10.508   5.844
  532    HD2  LYS  71           2HD      LYS  71  -0.869  -9.643   6.893
  533    HD3  LYS  71           1HD      LYS  71  -1.634  -9.269   5.349
  534    HE2  LYS  71           2HE      LYS  71  -3.384  -8.057   6.928
  535    HE3  LYS  71           1HE      LYS  71  -1.995  -8.004   8.010
  536    HZ1  LYS  71           3HZ      LYS  71  -2.423  -6.101   6.324
  537    HZ2  LYS  71           1HZ      LYS  71  -1.650  -7.143   5.236
  538    HZ3  LYS  71           2HZ      LYS  71  -0.848  -6.629   6.637
  539    H    THR  72           H        THR  72  -6.741 -12.582   7.395
  540    HA   THR  72           HA       THR  72  -6.332 -14.417   9.512
  541    HB   THR  72           HB       THR  72  -7.854 -15.899   8.202
  542    HG1  THR  72           1HG      THR  72  -7.910 -13.771   6.334
  543   HG21  THR  72          3HG2      THR  72  -8.929 -13.103   8.185
  544   HG22  THR  72          1HG2      THR  72  -8.701 -14.026   9.669
  545   HG23  THR  72          2HG2      THR  72  -9.802 -14.616   8.423
  546    H    TYR  73           H        TYR  73  -6.054 -15.230   6.054
  547    HA   TYR  73           HA       TYR  73  -3.383 -16.167   6.250
  548    HB2  TYR  73           2HB      TYR  73  -4.505 -17.932   7.569
  549    HB3  TYR  73           1HB      TYR  73  -5.524 -18.299   6.182
  550    HD1  TYR  73           1HD      TYR  73  -4.283 -18.968   3.995
  551    HD2  TYR  73           2HD      TYR  73  -2.503 -19.075   7.857
  552    HE1  TYR  73           1HE      TYR  73  -2.593 -20.549   3.164
  553    HE2  TYR  73           2HE      TYR  73  -0.806 -20.654   7.038
  554    HH   TYR  73           HH       TYR  73  -0.695 -22.394   5.096
  555    H    THR  74           H        THR  74  -6.473 -16.363   4.570
  556    HA   THR  74           HA       THR  74  -5.315 -17.111   2.058
  557    HB   THR  74           HB       THR  74  -7.798 -16.046   1.475
  558    HG1  THR  74           1HG      THR  74  -8.595 -15.733   3.420
  559   HG21  THR  74          3HG2      THR  74  -7.500 -18.843   2.498
  560   HG22  THR  74          1HG2      THR  74  -6.823 -18.339   0.951
  561   HG23  THR  74          2HG2      THR  74  -8.561 -18.230   1.230
  562    H    VAL  75           H        VAL  75  -5.157 -14.280   3.731
  563    HA   VAL  75           HA       VAL  75  -5.154 -12.611   1.298
  564    HB   VAL  75           HB       VAL  75  -6.695 -11.673   2.820
  565   HG11  VAL  75          1HG1      VAL  75  -6.311 -13.008   4.735
  566   HG12  VAL  75          2HG1      VAL  75  -6.162 -11.326   5.241
  567   HG13  VAL  75          3HG1      VAL  75  -4.715 -12.303   4.991
  568   HG21  VAL  75          3HG2      VAL  75  -5.705  -9.610   3.761
  569   HG22  VAL  75          1HG2      VAL  75  -5.253  -9.871   2.081
  570   HG23  VAL  75          2HG2      VAL  75  -4.100 -10.213   3.379
  571    H    ARG  76           H        ARG  76  -2.981 -13.063   0.572
  572    HA   ARG  76           HA       ARG  76  -0.868 -12.656   2.539
  573    HB2  ARG  76           2HB      ARG  76  -0.726 -14.590   1.021
  574    HB3  ARG  76           1HB      ARG  76  -0.660 -13.506  -0.359
  575    HG2  ARG  76           2HG      ARG  76   1.374 -12.616   1.303
  576    HG3  ARG  76           1HG      ARG  76   1.447 -14.376   1.411
  577    HD2  ARG  76           2HD      ARG  76   1.073 -13.916  -1.282
  578    HD3  ARG  76           1HD      ARG  76   2.145 -12.607  -0.795
  579    HE   ARG  76           HE       ARG  76   3.177 -14.928   0.304
  580   HH11  ARG  76          1HH1      ARG  76   2.544 -13.654  -2.881
  581   HH12  ARG  76          2HH1      ARG  76   3.815 -14.560  -3.631
  582   HH21  ARG  76          1HH2      ARG  76   4.849 -16.120  -0.680
  583   HH22  ARG  76          2HH2      ARG  76   5.123 -15.961  -2.383
  584    H    VAL  77           H        VAL  77  -1.933 -11.210  -0.570
  585    HA   VAL  77           HA       VAL  77  -0.484  -8.803   0.257
  586    HB   VAL  77           HB       VAL  77   0.509  -8.427  -1.870
  587   HG11  VAL  77          1HG1      VAL  77   2.076 -10.017  -1.801
  588   HG12  VAL  77          2HG1      VAL  77   0.913 -11.316  -2.068
  589   HG13  VAL  77          3HG1      VAL  77   1.153 -10.666  -0.448
  590   HG21  VAL  77          3HG2      VAL  77  -1.301 -10.591  -2.913
  591   HG22  VAL  77          1HG2      VAL  77   0.030  -9.880  -3.825
  592   HG23  VAL  77          2HG2      VAL  77  -1.325  -8.874  -3.316
  593    HA   PRO  78           HA       PRO  78  -4.578  -7.006  -0.305
  594    HB2  PRO  78           2HB      PRO  78  -2.851  -4.581  -0.392
  595    HB3  PRO  78           1HB      PRO  78  -4.334  -4.852   0.520
  596    HG2  PRO  78           2HG      PRO  78  -2.072  -4.981   1.811
  597    HG3  PRO  78           1HG      PRO  78  -3.208  -6.328   2.035
  598    HD2  PRO  78           2HD      PRO  78  -0.817  -6.153   0.223
  599    HD3  PRO  78           1HD      PRO  78  -1.242  -7.436   1.392
  600    H    THR  79           H        THR  79  -3.601  -7.889  -2.955
  601    HA   THR  79           HA       THR  79  -4.122  -5.270  -4.181
  602    HB   THR  79           HB       THR  79  -2.059  -6.298  -4.983
  603    HG1  THR  79           1HG      THR  79  -3.275  -5.095  -6.484
  604   HG21  THR  79          3HG2      THR  79  -3.211  -8.389  -6.583
  605   HG22  THR  79          1HG2      THR  79  -3.449  -8.695  -4.862
  606   HG23  THR  79          2HG2      THR  79  -1.824  -8.434  -5.495
  607    H    ILE  80           H        ILE  80  -6.053  -4.970  -4.374
  608    HA   ILE  80           HA       ILE  80  -7.744  -6.818  -5.903
  609    HB   ILE  80           HB       ILE  80  -8.653  -5.092  -3.588
  610   HG12  ILE  80          2HG1      ILE  80  -9.456  -7.514  -2.878
  611   HG13  ILE  80          1HG1      ILE  80  -8.139  -8.017  -3.932
  612   HG21  ILE  80          1HG2      ILE  80 -10.508  -4.989  -4.906
  613   HG22  ILE  80          2HG2      ILE  80 -10.813  -6.535  -4.116
  614   HG23  ILE  80          3HG2      ILE  80 -10.136  -6.497  -5.744
  615   HD11  ILE  80          3HD1      ILE  80  -8.017  -7.168  -1.247
  616   HD12  ILE  80          1HD1      ILE  80  -7.188  -5.957  -2.223
  617   HD13  ILE  80          2HD1      ILE  80  -6.693  -7.647  -2.308
  618    H    PHE  81           H        PHE  81  -7.530  -5.681  -7.923
  619    HA   PHE  81           HA       PHE  81  -9.108  -3.367  -8.210
  620    HB2  PHE  81           2HB      PHE  81  -6.396  -2.495  -9.005
  621    HB3  PHE  81           1HB      PHE  81  -7.722  -1.569  -8.328
  622    HD1  PHE  81           2HD      PHE  81  -7.997  -1.459  -5.821
  623    HD2  PHE  81           1HD      PHE  81  -4.615  -3.268  -7.679
  624    HE1  PHE  81           2HE      PHE  81  -6.786  -1.365  -3.695
  625    HE2  PHE  81           1HE      PHE  81  -3.384  -3.141  -5.557
  626    HZ   PHE  81           HZ       PHE  81  -4.482  -2.229  -3.522
  Start of MODEL   11
    1    H1   GLY   1           1HT      GLY   1   6.030  15.783  -5.731
    2    H2   GLY   1           2HT      GLY   1   7.409  15.783  -6.710
    3    H3   GLY   1           3HT      GLY   1   6.194  16.932  -6.961
    4    HA2  GLY   1           1HA      GLY   1   8.261  16.822  -4.890
    5    HA3  GLY   1           2HA      GLY   1   7.689  18.200  -5.819
    6    H    SER   2           H        SER   2   6.757  15.941  -3.254
    7    HA   SER   2           HA       SER   2   5.852  17.963  -1.527
    8    HB2  SER   2           2HB      SER   2   3.928  17.119  -3.505
    9    HB3  SER   2           1HB      SER   2   3.363  16.687  -1.893
   10    HG   SER   2           HG       SER   2   3.122  18.994  -2.957
   11    HA   PRO   3           HA       PRO   3   5.952  14.626   1.355
   12    HB2  PRO   3           2HB      PRO   3   3.989  15.178   3.124
   13    HB3  PRO   3           1HB      PRO   3   5.452  16.161   2.998
   14    HG2  PRO   3           2HG      PRO   3   2.726  16.666   1.868
   15    HG3  PRO   3           1HG      PRO   3   3.831  17.796   2.674
   16    HD2  PRO   3           2HD      PRO   3   3.562  17.656  -0.030
   17    HD3  PRO   3           1HD      PRO   3   5.073  18.134   0.769
   18    H    GLY   4           H        GLY   4   4.829  13.572  -0.851
   19    HA2  GLY   4           2HA      GLY   4   2.743  11.857   0.285
   20    HA3  GLY   4           1HA      GLY   4   2.417  12.670  -1.245
   21    H    PHE   5           H        PHE   5   2.204  10.041  -1.583
   22    HA   PHE   5           HA       PHE   5   4.638   9.356  -3.016
   23    HB2  PHE   5           2HB      PHE   5   3.464   7.314  -1.156
   24    HB3  PHE   5           1HB      PHE   5   5.003   7.281  -1.992
   25    HD1  PHE   5           1HD      PHE   5   6.737   9.064  -1.323
   26    HD2  PHE   5           2HD      PHE   5   3.337   8.061   1.037
   27    HE1  PHE   5           1HE      PHE   5   7.836  10.017   0.659
   28    HE2  PHE   5           2HE      PHE   5   4.431   9.015   3.021
   29    HZ   PHE   5           HZ       PHE   5   6.682   9.997   2.835
   30    H    THR   6           H        THR   6   1.318   8.440  -2.272
   31    HA   THR   6           HA       THR   6  -0.376   7.962  -3.785
   32    HB   THR   6           HB       THR   6   1.644   7.021  -5.801
   33    HG1  THR   6           1HG      THR   6   2.309   9.000  -5.894
   34   HG21  THR   6          3HG2      THR   6  -1.105   7.026  -5.850
   35   HG22  THR   6          1HG2      THR   6  -0.033   6.921  -7.247
   36   HG23  THR   6          2HG2      THR   6  -0.673   8.485  -6.741
   37    H    CYS   7           H        CYS   7  -1.377   6.240  -2.873
   38    HA   CYS   7           HA       CYS   7  -0.031   3.731  -2.441
   39    HB2  CYS   7           2HB      CYS   7  -1.660   4.064  -0.770
   40    HB3  CYS   7           1HB      CYS   7  -2.894   4.639  -1.885
   41    H    CYS   8           H        CYS   8  -0.876   5.119  -5.211
   42    HA   CYS   8           HA       CYS   8  -1.503   4.378  -7.271
   43    HB2  CYS   8           2HB      CYS   8   0.330   2.857  -7.031
   44    HB3  CYS   8           1HB      CYS   8  -0.581   1.809  -5.958
   45    HG   CYS   8           HG       CYS   8  -0.487   0.753  -8.355
   46    H    VAL   9           H        VAL   9  -3.244   4.710  -5.099
   47    HA   VAL   9           HA       VAL   9  -5.249   2.711  -4.929
   48    HB   VAL   9           HB       VAL   9  -4.994   4.086  -3.040
   49   HG11  VAL   9          1HG1      VAL   9  -4.666   6.243  -5.029
   50   HG12  VAL   9          2HG1      VAL   9  -3.744   5.885  -3.569
   51   HG13  VAL   9          3HG1      VAL   9  -5.312   6.685  -3.449
   52   HG21  VAL   9          3HG2      VAL   9  -7.448   3.919  -3.890
   53   HG22  VAL   9          1HG2      VAL   9  -7.259   5.641  -4.213
   54   HG23  VAL   9          2HG2      VAL   9  -7.046   5.027  -2.567
   55    HA   PRO  10           HA       PRO  10  -7.102   4.265  -8.777
   56    HB2  PRO  10           2HB      PRO  10  -8.134   1.954  -9.605
   57    HB3  PRO  10           1HB      PRO  10  -6.389   2.232  -9.692
   58    HG2  PRO  10           2HG      PRO  10  -7.959   0.689  -7.661
   59    HG3  PRO  10           1HG      PRO  10  -6.426   0.264  -8.446
   60    HD2  PRO  10           2HD      PRO  10  -6.627   1.378  -5.931
   61    HD3  PRO  10           1HD      PRO  10  -5.200   1.495  -6.971
   62    H    GLY  11           H        GLY  11  -8.431   2.372  -6.162
   63    HA2  GLY  11           2HA      GLY  11 -10.806   3.977  -6.139
   64    HA3  GLY  11           1HA      GLY  11 -11.092   2.316  -6.621
   65    H    CYS  12           H        CYS  12  -8.490   2.493  -4.364
   66    HA   CYS  12           HA       CYS  12 -10.141   1.170  -2.491
   67    HB2  CYS  12           2HB      CYS  12  -8.033   1.733  -0.898
   68    HB3  CYS  12           1HB      CYS  12  -8.147   0.342  -1.937
   69    H    TYR  13           H        TYR  13  -8.723   2.888  -0.167
   70    HA   TYR  13           HA       TYR  13 -11.062   4.604   0.020
   71    HB2  TYR  13           2HB      TYR  13 -10.708   3.002   1.810
   72    HB3  TYR  13           1HB      TYR  13  -9.170   3.765   2.181
   73    HD1  TYR  13           2HD      TYR  13 -11.961   5.880   1.180
   74    HD2  TYR  13           1HD      TYR  13  -9.956   4.139   4.505
   75    HE1  TYR  13           2HE      TYR  13 -13.116   7.439   2.685
   76    HE2  TYR  13           1HE      TYR  13 -11.108   5.693   6.019
   77    HH   TYR  13           HH       TYR  13 -12.220   7.828   5.971
   78    H    ASN  14           H        ASN  14  -7.657   4.787   0.791
   79    HA   ASN  14           HA       ASN  14  -7.685   7.692   0.436
   80    HB2  ASN  14           2HB      ASN  14  -5.586   7.278   1.986
   81    HB3  ASN  14           1HB      ASN  14  -7.097   7.788   2.588
   82   HD21  ASN  14          1HD2      ASN  14  -8.547   5.507   2.656
   83   HD22  ASN  14          2HD2      ASN  14  -7.790   4.313   3.650
   84    H    ASN  15           H        ASN  15  -5.453   8.731  -0.241
   85    HA   ASN  15           HA       ASN  15  -4.112   6.729  -1.911
   86    HB2  ASN  15           2HB      ASN  15  -5.137   8.542  -3.192
   87    HB3  ASN  15           1HB      ASN  15  -4.287   9.738  -2.223
   88   HD21  ASN  15          1HD2      ASN  15  -4.283   8.118  -5.087
   89   HD22  ASN  15          2HD2      ASN  15  -2.624   8.325  -5.527
   90    H    SER  16           H        SER  16  -1.543   7.096  -2.132
   91    HA   SER  16           HA       SER  16  -0.556   7.574   0.502
   92    HB2  SER  16           2HB      SER  16   0.170   5.534  -0.851
   93    HB3  SER  16           1HB      SER  16   0.985   6.590  -1.954
   94    HG   SER  16           HG       SER  16   1.525   6.530   0.823
   95    H    HIS  17           H        HIS  17  -1.092   9.682  -2.084
   96    HA   HIS  17           HA       HIS  17   0.914  11.520  -1.028
   97    HB2  HIS  17           2HB      HIS  17   1.826  12.109  -3.089
   98    HB3  HIS  17           1HB      HIS  17   1.640  10.371  -3.261
   99    HD1  HIS  17           1HD      HIS  17  -0.739   9.693  -4.525
  100    HD2  HIS  17           2HD      HIS  17   0.780  13.510  -5.142
  101    HE1  HIS  17           1HE      HIS  17  -1.854  10.528  -6.617
  102    HE2  HIS  17           2HE      HIS  17  -0.881  12.820  -7.001
  103    H    ARG  18           H        ARG  18  -2.318  11.062  -1.725
  104    HA   ARG  18           HA       ARG  18  -2.686  13.940  -2.231
  105    HB2  ARG  18           2HB      ARG  18  -4.345  13.517  -3.698
  106    HB3  ARG  18           1HB      ARG  18  -3.542  11.963  -3.832
  107    HG2  ARG  18           2HG      ARG  18  -5.198  11.360  -1.849
  108    HG3  ARG  18           1HG      ARG  18  -6.132  12.666  -2.578
  109    HD2  ARG  18           2HD      ARG  18  -5.002  10.623  -4.403
  110    HD3  ARG  18           1HD      ARG  18  -6.343  10.129  -3.369
  111    HE   ARG  18           HE       ARG  18  -6.476  11.835  -5.652
  112   HH11  ARG  18          1HH1      ARG  18  -7.926  11.208  -2.540
  113   HH12  ARG  18          2HH1      ARG  18  -9.465  11.863  -2.987
  114   HH21  ARG  18          1HH2      ARG  18  -8.500  12.698  -6.239
  115   HH22  ARG  18          2HH2      ARG  18  -9.791  12.709  -5.086
  116    H    ASP  19           H        ASP  19  -2.506  12.397   0.403
  117    HA   ASP  19           HA       ASP  19  -4.482  13.924   1.722
  118    HB2  ASP  19           2HB      ASP  19  -6.182  12.486   1.450
  119    HB3  ASP  19           1HB      ASP  19  -5.121  11.151   1.025
  120    H    LYS  20           H        LYS  20  -2.904  10.830   2.489
  121    HA   LYS  20           HA       LYS  20  -1.414  10.231   4.102
  122    HB2  LYS  20           2HB      LYS  20   0.349  11.591   4.290
  123    HB3  LYS  20           1HB      LYS  20  -0.533  12.677   3.234
  124    HG2  LYS  20           2HG      LYS  20  -1.501  13.714   5.336
  125    HG3  LYS  20           1HG      LYS  20  -0.288  12.791   6.223
  126    HD2  LYS  20           2HD      LYS  20   0.809  14.246   3.944
  127    HD3  LYS  20           1HD      LYS  20   0.065  15.299   5.150
  128    HE2  LYS  20           2HE      LYS  20   1.590  14.765   6.759
  129    HE3  LYS  20           1HE      LYS  20   1.850  13.140   6.129
  130    HZ1  LYS  20           3HZ      LYS  20   3.735  14.784   5.871
  131    HZ2  LYS  20           1HZ      LYS  20   2.795  15.543   4.688
  132    HZ3  LYS  20           2HZ      LYS  20   3.279  13.936   4.479
  133    H    ALA  21           H        ALA  21  -4.239  11.440   4.712
  134    HA   ALA  21           HA       ALA  21  -3.949  11.701   7.613
  135    HB1  ALA  21           1HB      ALA  21  -5.695  13.138   7.667
  136    HB2  ALA  21           2HB      ALA  21  -6.505  12.392   6.290
  137    HB3  ALA  21           3HB      ALA  21  -5.110  13.439   6.031
  138    H    LEU  22           H        LEU  22  -5.944   9.753   5.277
  139    HA   LEU  22           HA       LEU  22  -7.648   8.650   7.175
  140    HB2  LEU  22           2HB      LEU  22  -6.867   7.267   4.596
  141    HB3  LEU  22           1HB      LEU  22  -8.448   7.309   5.375
  142    HG   LEU  22           HG       LEU  22  -7.331   9.040   3.344
  143   HD11  LEU  22          1HD1      LEU  22  -9.930   9.700   3.546
  144   HD12  LEU  22          2HD1      LEU  22  -9.946   8.107   4.299
  145   HD13  LEU  22          3HD1      LEU  22  -9.331   8.303   2.656
  146   HD21  LEU  22          3HD2      LEU  22  -8.196  10.258   5.886
  147   HD22  LEU  22          1HD2      LEU  22  -8.688  11.009   4.370
  148   HD23  LEU  22          2HD2      LEU  22  -6.984  10.769   4.721
  149    H    HIS  23           H        HIS  23  -7.007   5.584   6.625
  150    HA   HIS  23           HA       HIS  23  -4.998   5.512   8.691
  151    HB2  HIS  23           2HB      HIS  23  -7.362   4.122   8.238
  152    HB3  HIS  23           1HB      HIS  23  -6.116   2.950   7.832
  153    HD1  HIS  23           1HD      HIS  23  -6.283   5.494  10.666
  154    HD2  HIS  23           2HD      HIS  23  -5.836   1.412  10.036
  155    HE1  HIS  23           1HE      HIS  23  -5.908   4.498  12.944
  156    HE2  HIS  23           2HE      HIS  23  -5.558   2.038  12.528
  157    H    PHE  24           H        PHE  24  -2.944   4.308   8.397
  158    HA   PHE  24           HA       PHE  24  -2.520   3.342   5.680
  159    HB2  PHE  24           2HB      PHE  24  -0.647   4.998   7.355
  160    HB3  PHE  24           1HB      PHE  24  -0.173   4.188   5.877
  161    HD1  PHE  24           2HD      PHE  24  -2.239   6.888   7.284
  162    HD2  PHE  24           1HD      PHE  24  -0.775   5.083   3.717
  163    HE1  PHE  24           2HE      PHE  24  -2.954   8.855   5.984
  164    HE2  PHE  24           1HE      PHE  24  -1.466   7.037   2.425
  165    HZ   PHE  24           HZ       PHE  24  -2.566   8.934   3.541
  166    H    TYR  25           H        TYR  25  -1.745   1.116   5.664
  167    HA   TYR  25           HA       TYR  25  -0.976  -0.030   8.198
  168    HB2  TYR  25           2HB      TYR  25  -1.330  -1.217   5.433
  169    HB3  TYR  25           1HB      TYR  25  -0.718  -2.151   6.792
  170    HD1  TYR  25           1HD      TYR  25  -3.539   0.271   6.336
  171    HD2  TYR  25           2HD      TYR  25  -2.298  -3.586   7.634
  172    HE1  TYR  25           1HE      TYR  25  -5.844  -0.231   7.033
  173    HE2  TYR  25           2HE      TYR  25  -4.597  -4.101   8.333
  174    HH   TYR  25           HH       TYR  25  -6.634  -2.923   8.968
  175    H    THR  26           H        THR  26   1.210  -1.204   8.440
  176    HA   THR  26           HA       THR  26   3.208   0.261   6.871
  177    HB   THR  26           HB       THR  26   4.424   0.507   8.755
  178    HG1  THR  26           1HG      THR  26   5.383  -1.283   9.240
  179   HG21  THR  26          3HG2      THR  26   3.329   0.309  10.893
  180   HG22  THR  26          1HG2      THR  26   2.079  -0.715  10.186
  181   HG23  THR  26          2HG2      THR  26   2.217   0.974   9.698
  182    H    PHE  27           H        PHE  27   5.425  -0.995   6.758
  183    HA   PHE  27           HA       PHE  27   4.854  -3.240   5.155
  184    HB2  PHE  27           2HB      PHE  27   6.796  -1.266   5.341
  185    HB3  PHE  27           1HB      PHE  27   7.625  -2.800   5.296
  186    HD1  PHE  27           1HD      PHE  27   4.493  -2.855   3.584
  187    HD2  PHE  27           2HD      PHE  27   8.585  -1.747   3.181
  188    HE1  PHE  27           1HE      PHE  27   4.266  -2.896   1.158
  189    HE2  PHE  27           2HE      PHE  27   8.364  -1.800   0.753
  190    HZ   PHE  27           HZ       PHE  27   6.195  -2.372  -0.281
  191    HA   PRO  28           HA       PRO  28   5.749  -6.712   7.992
  192    HB2  PRO  28           2HB      PRO  28   6.924  -7.583   5.326
  193    HB3  PRO  28           1HB      PRO  28   6.101  -8.603   6.503
  194    HG2  PRO  28           2HG      PRO  28   4.739  -7.712   4.487
  195    HG3  PRO  28           1HG      PRO  28   4.021  -7.549   6.094
  196    HD2  PRO  28           2HD      PRO  28   5.194  -5.497   4.315
  197    HD3  PRO  28           1HD      PRO  28   3.897  -5.366   5.490
  198    H    LYS  29           H        LYS  29   7.829  -8.056   8.547
  199    HA   LYS  29           HA       LYS  29  10.077  -6.226   8.657
  200    HB2  LYS  29           2HB      LYS  29  10.884  -8.591   9.877
  201    HB3  LYS  29           1HB      LYS  29  10.272  -7.154  10.679
  202    HG2  LYS  29           2HG      LYS  29   8.037  -8.063  10.689
  203    HG3  LYS  29           1HG      LYS  29   8.570  -9.459   9.749
  204    HD2  LYS  29           2HD      LYS  29   9.094 -10.521  11.630
  205    HD3  LYS  29           1HD      LYS  29  10.254  -9.253  12.024
  206    HE2  LYS  29           2HE      LYS  29   7.777  -8.150  12.642
  207    HE3  LYS  29           1HE      LYS  29   7.663  -9.823  13.187
  208    HZ1  LYS  29           3HZ      LYS  29   9.523  -7.715  14.068
  209    HZ2  LYS  29           1HZ      LYS  29   9.941  -9.346  14.246
  210    HZ3  LYS  29           2HZ      LYS  29   8.554  -8.741  15.001
  211    H    ASP  30           H        ASP  30   9.111  -8.953   6.850
  212    HA   ASP  30           HA       ASP  30  11.781  -9.737   6.042
  213    HB2  ASP  30           2HB      ASP  30   9.751 -10.727   4.277
  214    HB3  ASP  30           1HB      ASP  30  10.719 -11.646   5.418
  215    H    ALA  31           H        ALA  31  12.924  -8.490   4.624
  216    HA   ALA  31           HA       ALA  31  12.039  -6.336   3.285
  217    HB1  ALA  31           1HB      ALA  31  14.284  -6.448   3.297
  218    HB2  ALA  31           2HB      ALA  31  14.017  -6.942   1.633
  219    HB3  ALA  31           3HB      ALA  31  14.346  -8.154   2.877
  220    H    GLU  32           H        GLU  32  12.466  -9.441   1.362
  221    HA   GLU  32           HA       GLU  32  11.190  -8.456  -0.916
  222    HB2  GLU  32           2HB      GLU  32  12.410 -10.527  -0.939
  223    HB3  GLU  32           1HB      GLU  32  11.291 -11.337   0.075
  224    HG2  GLU  32           2HG      GLU  32  10.127 -10.183  -2.354
  225    HG3  GLU  32           1HG      GLU  32  11.311 -11.460  -2.622
  226    H    LEU  33           H        LEU  33   9.330 -10.490   1.530
  227    HA   LEU  33           HA       LEU  33   6.947 -10.267   0.310
  228    HB2  LEU  33           2HB      LEU  33   7.524 -11.077   2.716
  229    HB3  LEU  33           1HB      LEU  33   7.182  -9.440   3.198
  230    HG   LEU  33           HG       LEU  33   5.013  -9.829   3.259
  231   HD11  LEU  33          1HD1      LEU  33   5.263 -11.122   0.551
  232   HD12  LEU  33          2HD1      LEU  33   4.748  -9.474   0.894
  233   HD13  LEU  33          3HD1      LEU  33   3.735 -10.834   1.379
  234   HD21  LEU  33          3HD2      LEU  33   5.463 -11.851   4.266
  235   HD22  LEU  33          1HD2      LEU  33   5.989 -12.590   2.755
  236   HD23  LEU  33          2HD2      LEU  33   4.284 -12.248   3.024
  237    H    ARG  34           H        ARG  34   8.708  -7.767   1.884
  238    HA   ARG  34           HA       ARG  34   6.815  -5.699   1.851
  239    HB2  ARG  34           2HB      ARG  34   8.453  -4.273   2.589
  240    HB3  ARG  34           1HB      ARG  34   9.170  -5.809   3.026
  241    HG2  ARG  34           2HG      ARG  34  10.960  -4.747   2.108
  242    HG3  ARG  34           1HG      ARG  34  10.333  -5.540   0.674
  243    HD2  ARG  34           2HD      ARG  34   9.102  -3.450   0.135
  244    HD3  ARG  34           1HD      ARG  34   9.924  -2.680   1.492
  245    HE   ARG  34           HE       ARG  34  10.999  -3.196  -1.095
  246   HH11  ARG  34          1HH1      ARG  34  11.847  -2.966   2.283
  247   HH12  ARG  34          2HH1      ARG  34  13.499  -2.552   1.966
  248   HH21  ARG  34          1HH2      ARG  34  13.169  -2.651  -1.512
  249   HH22  ARG  34          2HH2      ARG  34  14.250  -2.373  -0.187
  250    H    ARG  35           H        ARG  35   9.474  -6.259  -0.399
  251    HA   ARG  35           HA       ARG  35   8.685  -4.247  -2.129
  252    HB2  ARG  35           2HB      ARG  35  10.155  -5.119  -3.749
  253    HB3  ARG  35           1HB      ARG  35  10.897  -5.456  -2.200
  254    HG2  ARG  35           2HG      ARG  35  11.244  -7.335  -3.577
  255    HG3  ARG  35           1HG      ARG  35  10.032  -7.803  -2.398
  256    HD2  ARG  35           2HD      ARG  35   8.563  -8.264  -4.016
  257    HD3  ARG  35           1HD      ARG  35   8.791  -6.676  -4.744
  258    HE   ARG  35           HE       ARG  35  10.036  -9.158  -5.537
  259   HH11  ARG  35          1HH1      ARG  35  10.158  -5.672  -5.706
  260   HH12  ARG  35          2HH1      ARG  35  11.092  -5.654  -7.163
  261   HH21  ARG  35          1HH2      ARG  35  11.266  -9.132  -7.451
  262   HH22  ARG  35          2HH2      ARG  35  11.723  -7.615  -8.155
  263    H    LEU  36           H        LEU  36   7.509  -7.544  -1.659
  264    HA   LEU  36           HA       LEU  36   6.033  -7.576  -4.141
  265    HB2  LEU  36           2HB      LEU  36   5.517  -8.966  -1.520
  266    HB3  LEU  36           1HB      LEU  36   4.470  -9.142  -2.905
  267    HG   LEU  36           HG       LEU  36   7.255  -9.634  -3.575
  268   HD11  LEU  36          1HD1      LEU  36   5.991 -11.132  -1.323
  269   HD12  LEU  36          2HD1      LEU  36   7.648 -10.556  -1.498
  270   HD13  LEU  36          3HD1      LEU  36   7.096 -11.948  -2.429
  271   HD21  LEU  36          3HD2      LEU  36   4.855 -10.236  -4.638
  272   HD22  LEU  36          1HD2      LEU  36   5.213 -11.743  -3.794
  273   HD23  LEU  36          2HD2      LEU  36   6.339 -11.118  -5.000
  274    H    TRP  37           H        TRP  37   5.130  -6.378  -0.935
  275    HA   TRP  37           HA       TRP  37   2.548  -5.582  -1.730
  276    HB2  TRP  37           2HB      TRP  37   4.454  -4.686   0.410
  277    HB3  TRP  37           1HB      TRP  37   2.939  -3.827   0.136
  278    HD1  TRP  37           HD       TRP  37   3.153  -7.594  -0.294
  279    HE1  TRP  37           1HE      TRP  37   1.737  -8.712   1.596
  280    HE3  TRP  37           3HE      TRP  37   2.003  -3.441   2.410
  281    HZ2  TRP  37           2HZ      TRP  37   0.283  -7.855   3.913
  282    HZ3  TRP  37           3HZ      TRP  37   0.630  -3.648   4.417
  283    HH2  TRP  37           HH       TRP  37  -0.218  -5.792   5.155
  284    H    LEU  38           H        LEU  38   5.788  -3.986  -1.937
  285    HA   LEU  38           HA       LEU  38   5.210  -1.412  -2.546
  286    HB2  LEU  38           2HB      LEU  38   7.121  -3.287  -3.953
  287    HB3  LEU  38           1HB      LEU  38   7.012  -1.601  -4.334
  288    HG   LEU  38           HG       LEU  38   7.786  -2.779  -1.685
  289   HD11  LEU  38          1HD1      LEU  38   9.363  -1.013  -3.544
  290   HD12  LEU  38          2HD1      LEU  38   9.477  -2.773  -3.537
  291   HD13  LEU  38          3HD1      LEU  38   9.938  -1.855  -2.104
  292   HD21  LEU  38          3HD2      LEU  38   7.444   0.114  -2.463
  293   HD22  LEU  38          1HD2      LEU  38   8.115  -0.472  -0.942
  294   HD23  LEU  38          2HD2      LEU  38   6.429  -0.785  -1.338
  295    H    LYS  39           H        LYS  39   4.965  -4.269  -4.801
  296    HA   LYS  39           HA       LYS  39   4.067  -3.054  -7.044
  297    HB2  LYS  39           2HB      LYS  39   3.910  -5.688  -5.779
  298    HB3  LYS  39           1HB      LYS  39   2.674  -5.422  -6.978
  299    HG2  LYS  39           2HG      LYS  39   4.950  -6.491  -7.606
  300    HG3  LYS  39           1HG      LYS  39   4.179  -5.341  -8.703
  301    HD2  LYS  39           2HD      LYS  39   5.941  -4.084  -6.732
  302    HD3  LYS  39           1HD      LYS  39   6.770  -5.221  -7.792
  303    HE2  LYS  39           2HE      LYS  39   5.423  -3.968  -9.663
  304    HE3  LYS  39           1HE      LYS  39   5.363  -2.679  -8.460
  305    HZ1  LYS  39           3HZ      LYS  39   7.908  -3.167  -8.325
  306    HZ2  LYS  39           1HZ      LYS  39   7.290  -2.176  -9.551
  307    HZ3  LYS  39           2HZ      LYS  39   7.677  -3.789  -9.880
  308    H    ASN  40           H        ASN  40   1.823  -4.453  -4.646
  309    HA   ASN  40           HA       ASN  40  -0.483  -3.511  -5.885
  310    HB2  ASN  40           2HB      ASN  40  -1.273  -3.673  -3.270
  311    HB3  ASN  40           1HB      ASN  40  -1.217  -5.016  -4.401
  312   HD21  ASN  40          1HD2      ASN  40   0.392  -6.556  -4.198
  313   HD22  ASN  40          2HD2      ASN  40   1.395  -6.667  -2.801
  314    H    VAL  41           H        VAL  41   1.560  -1.903  -3.577
  315    HA   VAL  41           HA       VAL  41  -0.378   0.155  -3.136
  316    HB   VAL  41           HB       VAL  41   1.614  -0.656  -1.541
  317   HG11  VAL  41          1HG1      VAL  41   3.292   1.048  -1.364
  318   HG12  VAL  41          2HG1      VAL  41   2.536   1.985  -2.652
  319   HG13  VAL  41          3HG1      VAL  41   3.300   0.445  -3.016
  320   HG21  VAL  41          3HG2      VAL  41  -0.461   0.736  -1.120
  321   HG22  VAL  41          1HG2      VAL  41   0.519   2.147  -1.506
  322   HG23  VAL  41          2HG2      VAL  41   0.944   1.132  -0.136
  323    H    SER  42           H        SER  42   2.191  -0.171  -5.495
  324    HA   SER  42           HA       SER  42   1.509   1.883  -7.062
  325    HB2  SER  42           2HB      SER  42   1.492   3.817  -5.819
  326    HB3  SER  42           1HB      SER  42   2.421   3.102  -4.489
  327    HG   SER  42           HG       SER  42   3.574   3.934  -6.962
  328    H    ARG  43           H        ARG  43   4.912   2.500  -5.860
  329    HA   ARG  43           HA       ARG  43   6.095   0.415  -7.292
  330    HB2  ARG  43           2HB      ARG  43   4.872   2.035  -9.078
  331    HB3  ARG  43           1HB      ARG  43   6.440   2.823  -8.985
  332    HG2  ARG  43           2HG      ARG  43   7.508   1.120 -10.020
  333    HG3  ARG  43           1HG      ARG  43   6.462  -0.111  -9.313
  334    HD2  ARG  43           2HD      ARG  43   5.186  -0.164 -11.131
  335    HD3  ARG  43           1HD      ARG  43   4.958   1.584 -11.084
  336    HE   ARG  43           HE       ARG  43   6.536   1.793 -12.727
  337   HH11  ARG  43          1HH1      ARG  43   6.797  -1.390 -11.321
  338   HH12  ARG  43          2HH1      ARG  43   7.947  -1.950 -12.490
  339   HH21  ARG  43          1HH2      ARG  43   8.045   1.061 -14.265
  340   HH22  ARG  43          2HH2      ARG  43   8.657  -0.557 -14.164
  341    H    ALA  44           H        ALA  44   8.458   1.281  -8.163
  342    HA   ALA  44           HA       ALA  44   9.705   2.291  -5.771
  343    HB1  ALA  44           1HB      ALA  44  11.138   1.870  -8.374
  344    HB2  ALA  44           2HB      ALA  44  10.566   0.499  -7.421
  345    HB3  ALA  44           3HB      ALA  44  11.724   1.634  -6.725
  346    H    GLY  45           H        GLY  45   8.406   4.572  -6.025
  347    HA2  GLY  45           2HA      GLY  45   8.458   6.779  -6.618
  348    HA3  GLY  45           1HA      GLY  45  10.200   6.572  -6.569
  349    H    VAL  46           H        VAL  46   8.475   4.702  -8.895
  350    HA   VAL  46           HA       VAL  46   8.956   4.600 -11.163
  351    HB   VAL  46           HB       VAL  46   6.717   5.558 -10.913
  352   HG11  VAL  46          1HG1      VAL  46   6.274   7.896 -10.998
  353   HG12  VAL  46          2HG1      VAL  46   7.975   8.273 -11.268
  354   HG13  VAL  46          3HG1      VAL  46   7.450   7.628  -9.712
  355   HG21  VAL  46          3HG2      VAL  46   6.810   5.338 -13.128
  356   HG22  VAL  46          1HG2      VAL  46   8.455   5.970 -13.206
  357   HG23  VAL  46          2HG2      VAL  46   7.084   7.079 -13.186
  358    H    SER  47           H        SER  47  11.348   5.403 -10.201
  359    HA   SER  47           HA       SER  47  12.504   6.758 -12.386
  360    HB2  SER  47           2HB      SER  47  12.844   8.946 -11.668
  361    HB3  SER  47           1HB      SER  47  11.230   8.644 -11.030
  362    HG   SER  47           HG       SER  47  11.987   8.712  -9.052
  363    H    GLY  48           H        GLY  48  13.065   6.715  -8.670
  364    HA2  GLY  48           2HA      GLY  48  14.733   5.501  -7.601
  365    HA3  GLY  48           1HA      GLY  48  15.354   4.988  -9.162
  366    H    CYS  49           H        CYS  49  14.751   8.352  -8.532
  367    HA   CYS  49           HA       CYS  49  17.325   9.030  -7.560
  368    HB2  CYS  49           2HB      CYS  49  17.540   8.340 -10.134
  369    HB3  CYS  49           1HB      CYS  49  17.032  10.011 -10.356
  370    HG   CYS  49           HG       CYS  49  19.235  10.354  -8.586
  371    H    PHE  50           H        PHE  50  14.651  10.162  -9.603
  372    HA   PHE  50           HA       PHE  50  14.766  12.889  -9.140
  373    HB2  PHE  50           2HB      PHE  50  12.512  10.966  -9.667
  374    HB3  PHE  50           1HB      PHE  50  12.136  12.639  -9.268
  375    HD1  PHE  50           1HD      PHE  50  14.069  10.525 -11.621
  376    HD2  PHE  50           2HD      PHE  50  12.263  14.307 -10.889
  377    HE1  PHE  50           1HE      PHE  50  14.483  11.170 -13.958
  378    HE2  PHE  50           2HE      PHE  50  12.672  14.960 -13.227
  379    HZ   PHE  50           HZ       PHE  50  13.783  13.390 -14.765
  380    H    SER  51           H        SER  51  13.267  10.313  -7.022
  381    HA   SER  51           HA       SER  51  13.060  10.374  -4.738
  382    HB2  SER  51           2HB      SER  51  14.750  12.351  -4.823
  383    HB3  SER  51           1HB      SER  51  13.319  13.368  -4.658
  384    HG   SER  51           HG       SER  51  13.006  12.640  -2.666
  385    H    THR  52           H        THR  52  11.022  10.644  -6.769
  386    HA   THR  52           HA       THR  52   9.038  12.491  -5.975
  387    HB   THR  52           HB       THR  52   7.666  10.353  -7.099
  388    HG1  THR  52           1HG      THR  52  10.105  10.600  -8.501
  389   HG21  THR  52          3HG2      THR  52   7.106  11.894  -8.583
  390   HG22  THR  52          1HG2      THR  52   8.766  12.019  -9.167
  391   HG23  THR  52          2HG2      THR  52   8.240  12.988  -7.790
  392    H    PHE  53           H        PHE  53   9.276   9.007  -5.439
  393    HA   PHE  53           HA       PHE  53   8.345   9.258  -2.737
  394    HB2  PHE  53           2HB      PHE  53   6.295   8.055  -2.920
  395    HB3  PHE  53           1HB      PHE  53   6.216   9.372  -4.080
  396    HD1  PHE  53           1HD      PHE  53   6.433   8.878  -6.507
  397    HD2  PHE  53           2HD      PHE  53   6.230   5.798  -3.587
  398    HE1  PHE  53           1HE      PHE  53   5.861   7.247  -8.263
  399    HE2  PHE  53           2HE      PHE  53   5.664   4.169  -5.320
  400    HZ   PHE  53           HZ       PHE  53   5.473   4.884  -7.665
  401    H    GLN  54           H        GLN  54  10.733   8.270  -3.357
  402    HA   GLN  54           HA       GLN  54  10.999   5.623  -4.115
  403    HB2  GLN  54           2HB      GLN  54  12.628   7.616  -2.836
  404    HB3  GLN  54           1HB      GLN  54  12.911   6.053  -2.085
  405    HG2  GLN  54           2HG      GLN  54  13.237   6.795  -4.979
  406    HG3  GLN  54           1HG      GLN  54  14.486   6.306  -3.835
  407   HE21  GLN  54          1HE2      GLN  54  12.018   5.264  -5.991
  408   HE22  GLN  54          2HE2      GLN  54  12.323   3.568  -5.871
  409    HA   PRO  55           HA       PRO  55   9.063   3.423  -0.765
  410    HB2  PRO  55           2HB      PRO  55  10.448   1.014  -1.586
  411    HB3  PRO  55           1HB      PRO  55   8.737   1.413  -1.730
  412    HG2  PRO  55           2HG      PRO  55  10.433   1.211  -3.864
  413    HG3  PRO  55           1HG      PRO  55   8.970   2.209  -3.855
  414    HD2  PRO  55           2HD      PRO  55  11.824   3.024  -3.524
  415    HD3  PRO  55           1HD      PRO  55  10.494   3.862  -4.351
  416    H    THR  56           H        THR  56  12.450   3.725  -1.213
  417    HA   THR  56           HA       THR  56  13.604   2.111   0.700
  418    HB   THR  56           HB       THR  56  14.248   5.022   0.078
  419    HG1  THR  56           1HG      THR  56  14.333   3.363  -1.635
  420   HG21  THR  56          3HG2      THR  56  16.617   4.028   0.703
  421   HG22  THR  56          1HG2      THR  56  15.632   3.028   1.769
  422   HG23  THR  56          2HG2      THR  56  15.568   4.786   1.901
  423    H    THR  57           H        THR  57  12.004   5.364   1.239
  424    HA   THR  57           HA       THR  57  12.481   5.514   3.982
  425    HB   THR  57           HB       THR  57  11.648   7.408   2.722
  426    HG1  THR  57           1HG      THR  57   9.710   6.565   4.613
  427   HG21  THR  57          3HG2      THR  57   9.953   7.349   1.307
  428   HG22  THR  57          1HG2      THR  57   8.863   6.754   2.558
  429   HG23  THR  57          2HG2      THR  57   9.819   5.618   1.608
  430    H    GLY  58           H        GLY  58  10.341   3.467   2.204
  431    HA2  GLY  58           2HA      GLY  58   9.510   1.489   3.385
  432    HA3  GLY  58           1HA      GLY  58   9.230   2.525   4.760
  433    H    HIS  59           H        HIS  59   7.712   1.489   1.634
  434    HA   HIS  59           HA       HIS  59   5.689   3.504   1.929
  435    HB2  HIS  59           2HB      HIS  59   6.405   1.570  -0.110
  436    HB3  HIS  59           1HB      HIS  59   4.669   1.573   0.178
  437    HD1  HIS  59           1HD      HIS  59   6.960   4.546   0.338
  438    HD2  HIS  59           2HD      HIS  59   3.866   3.073  -2.055
  439    HE1  HIS  59           1HE      HIS  59   6.429   6.381  -1.276
  440    HE2  HIS  59           2HE      HIS  59   4.508   5.503  -2.662
  441    H    ARG  60           H        ARG  60   3.606   3.237   2.436
  442    HA   ARG  60           HA       ARG  60   2.937   0.940   4.164
  443    HB2  ARG  60           2HB      ARG  60   1.676   2.466   5.486
  444    HB3  ARG  60           1HB      ARG  60   3.156   3.320   5.107
  445    HG2  ARG  60           2HG      ARG  60   1.664   4.140   3.050
  446    HG3  ARG  60           1HG      ARG  60   0.398   3.869   4.243
  447    HD2  ARG  60           2HD      ARG  60   1.352   6.194   4.192
  448    HD3  ARG  60           1HD      ARG  60   1.388   5.403   5.765
  449    HE   ARG  60           HE       ARG  60   3.661   5.553   5.722
  450   HH11  ARG  60          1HH1      ARG  60   2.484   5.834   2.449
  451   HH12  ARG  60          2HH1      ARG  60   4.050   6.157   1.783
  452   HH21  ARG  60          1HH2      ARG  60   5.719   5.982   4.847
  453   HH22  ARG  60          2HH2      ARG  60   5.885   6.244   3.143
  454    H    LEU  61           H        LEU  61   0.372   0.594   4.138
  455    HA   LEU  61           HA       LEU  61  -0.556   0.890   1.344
  456    HB2  LEU  61           2HB      LEU  61  -1.103  -1.219   3.458
  457    HB3  LEU  61           1HB      LEU  61  -2.153  -1.041   2.086
  458    HG   LEU  61           HG       LEU  61   0.442  -2.315   2.310
  459   HD11  LEU  61          1HD1      LEU  61  -2.040  -3.074   1.542
  460   HD12  LEU  61          2HD1      LEU  61  -0.554  -3.980   1.275
  461   HD13  LEU  61          3HD1      LEU  61  -1.181  -2.933   0.007
  462   HD21  LEU  61          3HD2      LEU  61   1.291  -1.872   0.179
  463   HD22  LEU  61          1HD2      LEU  61   0.961  -0.308   0.915
  464   HD23  LEU  61          2HD2      LEU  61  -0.153  -0.974  -0.277
  465    H    CYS  62           H        CYS  62  -3.092   1.322   1.165
  466    HA   CYS  62           HA       CYS  62  -3.964   2.580   3.624
  467    HB2  CYS  62           2HB      CYS  62  -4.847   4.388   2.517
  468    HB3  CYS  62           1HB      CYS  62  -3.481   4.028   1.570
  469    H    SER  63           H        SER  63  -6.623   2.727   3.600
  470    HA   SER  63           HA       SER  63  -7.425   0.600   4.804
  471    HB2  SER  63           2HB      SER  63  -8.614   2.965   3.824
  472    HB3  SER  63           1HB      SER  63  -9.762   1.669   3.552
  473    HG   SER  63           HG       SER  63  -9.231   1.077   5.835
  474    H    VAL  64           H        VAL  64  -9.510   0.987   2.255
  475    HA   VAL  64           HA       VAL  64 -10.532  -1.540   2.296
  476    HB   VAL  64           HB       VAL  64 -11.655  -0.960   0.145
  477   HG11  VAL  64          1HG1      VAL  64 -13.003  -0.297   1.843
  478   HG12  VAL  64          2HG1      VAL  64 -12.525   1.314   1.306
  479   HG13  VAL  64          3HG1      VAL  64 -11.707   0.563   2.676
  480   HG21  VAL  64          3HG2      VAL  64 -11.240   1.124  -0.865
  481   HG22  VAL  64          1HG2      VAL  64  -9.657   0.386  -0.599
  482   HG23  VAL  64          2HG2      VAL  64 -10.232   1.651   0.487
  483    H    HIS  65           H        HIS  65  -7.699  -2.019   1.712
  484    HA   HIS  65           HA       HIS  65  -7.961  -3.194  -0.973
  485    HB2  HIS  65           2HB      HIS  65  -5.409  -3.348   0.531
  486    HB3  HIS  65           1HB      HIS  65  -5.676  -3.248  -1.206
  487    HD1  HIS  65           1HD      HIS  65  -7.699  -0.677  -0.149
  488    HD2  HIS  65           2HD      HIS  65  -3.597  -1.194  -0.128
  489    HE1  HIS  65           1HE      HIS  65  -6.750   1.561   0.374
  490    H    PHE  66           H        PHE  66  -8.992  -4.340   1.773
  491    HA   PHE  66           HA       PHE  66  -7.922  -7.008   1.213
  492    HB2  PHE  66           2HB      PHE  66  -8.588  -6.027   4.000
  493    HB3  PHE  66           1HB      PHE  66  -7.838  -7.549   3.569
  494    HD1  PHE  66           2HD      PHE  66  -7.232  -3.843   3.636
  495    HD2  PHE  66           1HD      PHE  66  -5.571  -7.765   3.336
  496    HE1  PHE  66           2HE      PHE  66  -4.958  -2.915   3.862
  497    HE2  PHE  66           1HE      PHE  66  -3.316  -6.825   3.571
  498    HZ   PHE  66           HZ       PHE  66  -2.993  -4.428   3.824
  499    H    GLN  67           H        GLN  67  -9.564  -8.845   1.991
  500    HA   GLN  67           HA       GLN  67 -12.279  -7.808   1.677
  501    HB2  GLN  67           2HB      GLN  67 -10.966  -9.879   0.420
  502    HB3  GLN  67           1HB      GLN  67 -11.921 -10.712   1.633
  503    HG2  GLN  67           2HG      GLN  67 -13.792 -10.420   0.494
  504    HG3  GLN  67           1HG      GLN  67 -13.489  -8.694   0.302
  505   HE21  GLN  67          1HE2      GLN  67 -11.188  -8.704  -1.177
  506   HE22  GLN  67          2HE2      GLN  67 -11.492  -9.398  -2.729
  507    H    GLY  68           H        GLY  68 -13.009  -7.490   4.125
  508    HA2  GLY  68           2HA      GLY  68 -13.120  -8.076   6.357
  509    HA3  GLY  68           1HA      GLY  68 -13.813  -9.518   5.630
  510    H    GLY  69           H        GLY  69 -12.888 -10.376   7.825
  511    HA2  GLY  69           2HA      GLY  69 -11.464 -11.945   8.677
  512    HA3  GLY  69           1HA      GLY  69 -10.512 -11.859   7.215
  513    H    ARG  70           H        ARG  70  -9.013  -9.745   7.115
  514    HA   ARG  70           HA       ARG  70  -7.749  -8.120   8.215
  515    HB2  ARG  70           2HB      ARG  70  -7.746  -7.761  10.486
  516    HB3  ARG  70           1HB      ARG  70  -9.312  -8.531  10.298
  517    HG2  ARG  70           2HG      ARG  70  -7.968 -10.720  10.817
  518    HG3  ARG  70           1HG      ARG  70  -6.809  -9.598  11.517
  519    HD2  ARG  70           2HD      ARG  70  -8.041  -9.663  13.372
  520    HD3  ARG  70           1HD      ARG  70  -9.244  -8.720  12.493
  521    HE   ARG  70           HE       ARG  70 -10.572 -10.583  12.370
  522   HH11  ARG  70          1HH1      ARG  70  -7.352 -11.546  13.313
  523   HH12  ARG  70          2HH1      ARG  70  -7.809 -13.179  13.668
  524   HH21  ARG  70          1HH2      ARG  70 -11.175 -12.730  12.837
  525   HH22  ARG  70          2HH2      ARG  70  -9.979 -13.850  13.397
  526    H    LYS  71           H        LYS  71  -7.090 -10.610   6.947
  527    HA   LYS  71           HA       LYS  71  -5.154 -11.699   6.418
  528    HB2  LYS  71           2HB      LYS  71  -4.200  -9.610   8.043
  529    HB3  LYS  71           1HB      LYS  71  -3.429 -11.081   8.621
  530    HG2  LYS  71           2HG      LYS  71  -2.043 -11.076   6.883
  531    HG3  LYS  71           1HG      LYS  71  -3.394 -11.072   5.766
  532    HD2  LYS  71           2HD      LYS  71  -2.717  -8.513   7.094
  533    HD3  LYS  71           1HD      LYS  71  -1.663  -9.081   5.791
  534    HE2  LYS  71           2HE      LYS  71  -4.623  -9.131   5.410
  535    HE3  LYS  71           1HE      LYS  71  -3.764  -7.599   5.274
  536    HZ1  LYS  71           3HZ      LYS  71  -3.130 -10.058   3.731
  537    HZ2  LYS  71           1HZ      LYS  71  -2.349  -8.564   3.576
  538    HZ3  LYS  71           2HZ      LYS  71  -3.972  -8.722   3.126
  539    H    THR  72           H        THR  72  -6.151 -13.620   6.808
  540    HA   THR  72           HA       THR  72  -5.093 -15.181   8.983
  541    HB   THR  72           HB       THR  72  -6.969 -14.422  10.202
  542    HG1  THR  72           1HG      THR  72  -7.925 -16.766   8.932
  543   HG21  THR  72          3HG2      THR  72  -8.311 -14.333   7.595
  544   HG22  THR  72          1HG2      THR  72  -8.524 -13.323   9.028
  545   HG23  THR  72          2HG2      THR  72  -9.308 -14.901   8.935
  546    H    TYR  73           H        TYR  73  -4.266 -15.725   6.696
  547    HA   TYR  73           HA       TYR  73  -4.029 -17.417   5.186
  548    HB2  TYR  73           2HB      TYR  73  -5.368 -18.748   7.022
  549    HB3  TYR  73           1HB      TYR  73  -6.705 -18.589   5.890
  550    HD1  TYR  73           1HD      TYR  73  -3.084 -19.163   5.212
  551    HD2  TYR  73           2HD      TYR  73  -7.035 -20.734   5.045
  552    HE1  TYR  73           1HE      TYR  73  -2.253 -21.111   3.963
  553    HE2  TYR  73           2HE      TYR  73  -6.213 -22.685   3.796
  554    HH   TYR  73           HH       TYR  73  -4.088 -23.099   2.217
  555    H    THR  74           H        THR  74  -5.584 -18.425   3.259
  556    HA   THR  74           HA       THR  74  -6.782 -17.975   1.395
  557    HB   THR  74           HB       THR  74  -8.395 -15.735   2.109
  558    HG1  THR  74           1HG      THR  74  -8.185 -17.715   4.131
  559   HG21  THR  74          3HG2      THR  74  -9.448 -17.251   0.763
  560   HG22  THR  74          1HG2      THR  74 -10.136 -17.658   2.335
  561   HG23  THR  74          2HG2      THR  74  -8.838 -18.643   1.661
  562    H    VAL  75           H        VAL  75  -6.026 -14.851   3.008
  563    HA   VAL  75           HA       VAL  75  -5.093 -13.913   0.387
  564    HB   VAL  75           HB       VAL  75  -5.699 -11.892   2.473
  565   HG11  VAL  75          1HG1      VAL  75  -5.706 -10.530   0.699
  566   HG12  VAL  75          2HG1      VAL  75  -6.786 -11.588  -0.213
  567   HG13  VAL  75          3HG1      VAL  75  -5.054 -11.894  -0.205
  568   HG21  VAL  75          3HG2      VAL  75  -8.051 -11.859   2.112
  569   HG22  VAL  75          1HG2      VAL  75  -7.615 -13.494   2.616
  570   HG23  VAL  75          2HG2      VAL  75  -7.948 -13.157   0.916
  571    H    ARG  76           H        ARG  76  -2.944 -13.615   0.210
  572    HA   ARG  76           HA       ARG  76  -1.396 -13.159   2.674
  573    HB2  ARG  76           2HB      ARG  76  -0.820 -15.173   1.311
  574    HB3  ARG  76           1HB      ARG  76  -0.389 -14.119  -0.023
  575    HG2  ARG  76           2HG      ARG  76   1.262 -13.039   1.620
  576    HG3  ARG  76           1HG      ARG  76   0.991 -14.477   2.607
  577    HD2  ARG  76           2HD      ARG  76   2.372 -15.664   1.334
  578    HD3  ARG  76           1HD      ARG  76   1.446 -15.260  -0.108
  579    HE   ARG  76           HE       ARG  76   3.190 -13.147   0.716
  580   HH11  ARG  76          1HH1      ARG  76   3.024 -16.154  -1.045
  581   HH12  ARG  76          2HH1      ARG  76   4.382 -15.787  -2.053
  582   HH21  ARG  76          1HH2      ARG  76   4.978 -12.661  -0.610
  583   HH22  ARG  76          2HH2      ARG  76   5.493 -13.801  -1.805
  584    H    VAL  77           H        VAL  77  -1.823 -12.009  -0.673
  585    HA   VAL  77           HA       VAL  77  -0.575  -9.467   0.138
  586    HB   VAL  77           HB       VAL  77   0.760  -9.435  -1.687
  587   HG11  VAL  77          1HG1      VAL  77   0.861 -11.867  -1.016
  588   HG12  VAL  77          2HG1      VAL  77   1.434 -11.453  -2.632
  589   HG13  VAL  77          3HG1      VAL  77  -0.159 -12.185  -2.420
  590   HG21  VAL  77          3HG2      VAL  77  -0.011  -9.786  -3.970
  591   HG22  VAL  77          1HG2      VAL  77  -1.097  -8.719  -3.080
  592   HG23  VAL  77          2HG2      VAL  77  -1.549 -10.401  -3.360
  593    HA   PRO  78           HA       PRO  78  -4.764  -7.996  -0.604
  594    HB2  PRO  78           2HB      PRO  78  -3.334  -5.397  -0.761
  595    HB3  PRO  78           1HB      PRO  78  -4.745  -5.848   0.189
  596    HG2  PRO  78           2HG      PRO  78  -2.455  -5.619   1.415
  597    HG3  PRO  78           1HG      PRO  78  -3.432  -7.072   1.722
  598    HD2  PRO  78           2HD      PRO  78  -1.115  -6.750  -0.158
  599    HD3  PRO  78           1HD      PRO  78  -1.373  -7.977   1.118
  600    H    THR  79           H        THR  79  -4.429  -8.982  -3.077
  601    HA   THR  79           HA       THR  79  -4.211  -6.482  -4.631
  602    HB   THR  79           HB       THR  79  -4.602  -8.753  -6.338
  603    HG1  THR  79           1HG      THR  79  -3.759 -10.182  -4.990
  604   HG21  THR  79          3HG2      THR  79  -2.492  -6.732  -5.877
  605   HG22  THR  79          1HG2      THR  79  -3.344  -7.174  -7.358
  606   HG23  THR  79          2HG2      THR  79  -2.045  -8.201  -6.746
  607    H    ILE  80           H        ILE  80  -5.952  -5.556  -4.512
  608    HA   ILE  80           HA       ILE  80  -8.447  -6.717  -5.499
  609    HB   ILE  80           HB       ILE  80  -7.985  -5.087  -3.012
  610   HG12  ILE  80          2HG1      ILE  80  -8.510  -7.579  -3.070
  611   HG13  ILE  80          1HG1      ILE  80  -9.506  -6.609  -2.004
  612   HG21  ILE  80          1HG2      ILE  80  -9.993  -3.980  -2.952
  613   HG22  ILE  80          2HG2      ILE  80 -10.740  -5.022  -4.156
  614   HG23  ILE  80          3HG2      ILE  80  -9.569  -3.808  -4.643
  615   HD11  ILE  80          3HD1      ILE  80 -11.333  -7.302  -3.003
  616   HD12  ILE  80          1HD1      ILE  80 -10.344  -8.370  -4.001
  617   HD13  ILE  80          2HD1      ILE  80 -10.738  -6.747  -4.572
  618    H    PHE  81           H        PHE  81  -9.424  -5.165  -7.120
  619    HA   PHE  81           HA       PHE  81  -9.318  -3.417  -8.604
  620    HB2  PHE  81           2HB      PHE  81  -8.072  -1.285  -7.874
  621    HB3  PHE  81           1HB      PHE  81  -9.451  -1.762  -6.898
  622    HD1  PHE  81           1HD      PHE  81  -5.721  -1.717  -6.992
  623    HD2  PHE  81           2HD      PHE  81  -9.216  -2.198  -4.600
  624    HE1  PHE  81           1HE      PHE  81  -4.320  -1.733  -4.949
  625    HE2  PHE  81           2HE      PHE  81  -7.833  -2.229  -2.573
  626    HZ   PHE  81           HZ       PHE  81  -5.384  -2.041  -2.722
  Start of MODEL   12
    1    H1   GLY   1           1HT      GLY   1   3.232  21.625   1.731
    2    H2   GLY   1           2HT      GLY   1   4.139  22.271   0.458
    3    H3   GLY   1           3HT      GLY   1   4.920  21.510   1.752
    4    HA2  GLY   1           1HA      GLY   1   3.041  20.117  -0.069
    5    HA3  GLY   1           2HA      GLY   1   4.779  20.154  -0.324
    6    H    SER   2           H        SER   2   3.564  17.747  -0.085
    7    HA   SER   2           HA       SER   2   4.564  16.825   2.517
    8    HB2  SER   2           2HB      SER   2   2.701  15.414   2.895
    9    HB3  SER   2           1HB      SER   2   2.008  16.958   2.402
   10    HG   SER   2           HG       SER   2   1.253  14.874   1.369
   11    HA   PRO   3           HA       PRO   3   6.728  13.895  -0.007
   12    HB2  PRO   3           2HB      PRO   3   7.514  12.149   1.879
   13    HB3  PRO   3           1HB      PRO   3   8.178  13.786   1.790
   14    HG2  PRO   3           2HG      PRO   3   6.046  12.703   3.590
   15    HG3  PRO   3           1HG      PRO   3   7.398  13.782   3.981
   16    HD2  PRO   3           2HD      PRO   3   4.843  14.654   3.550
   17    HD3  PRO   3           1HD      PRO   3   6.282  15.644   3.242
   18    H    GLY   4           H        GLY   4   4.126  13.495  -0.530
   19    HA2  GLY   4           2HA      GLY   4   2.843  11.222   0.364
   20    HA3  GLY   4           1HA      GLY   4   2.666  11.895  -1.253
   21    H    PHE   5           H        PHE   5   2.372   9.267  -1.384
   22    HA   PHE   5           HA       PHE   5   4.814   8.369  -2.641
   23    HB2  PHE   5           2HB      PHE   5   3.831   6.323  -0.762
   24    HB3  PHE   5           1HB      PHE   5   5.464   6.735  -1.243
   25    HD1  PHE   5           2HD      PHE   5   2.681   7.781   0.961
   26    HD2  PHE   5           1HD      PHE   5   6.844   8.025   0.117
   27    HE1  PHE   5           2HE      PHE   5   3.049   8.898   3.122
   28    HE2  PHE   5           1HE      PHE   5   7.222   9.134   2.280
   29    HZ   PHE   5           HZ       PHE   5   5.322   9.573   3.786
   30    H    THR   6           H        THR   6   1.483   8.401  -2.711
   31    HA   THR   6           HA       THR   6  -0.091   7.382  -4.012
   32    HB   THR   6           HB       THR   6   1.876   5.935  -5.674
   33    HG1  THR   6           1HG      THR   6   1.961   8.726  -5.269
   34   HG21  THR   6          3HG2      THR   6  -0.519   6.317  -6.304
   35   HG22  THR   6          1HG2      THR   6   0.674   6.829  -7.497
   36   HG23  THR   6          2HG2      THR   6  -0.121   8.027  -6.474
   37    H    CYS   7           H        CYS   7  -1.343   5.732  -3.276
   38    HA   CYS   7           HA       CYS   7  -0.072   3.239  -2.379
   39    HB2  CYS   7           2HB      CYS   7  -1.656   3.977  -0.752
   40    HB3  CYS   7           1HB      CYS   7  -2.918   4.292  -1.935
   41    H    CYS   8           H        CYS   8  -0.470   4.115  -5.285
   42    HA   CYS   8           HA       CYS   8  -1.230   3.220  -7.260
   43    HB2  CYS   8           2HB      CYS   8   0.332   1.493  -6.814
   44    HB3  CYS   8           1HB      CYS   8  -0.646   0.805  -5.533
   45    HG   CYS   8           HG       CYS   8  -0.972   0.277  -8.553
   46    H    VAL   9           H        VAL   9  -3.040   4.124  -5.319
   47    HA   VAL   9           HA       VAL   9  -5.297   2.384  -5.087
   48    HB   VAL   9           HB       VAL   9  -4.919   3.842  -3.269
   49   HG11  VAL   9          1HG1      VAL   9  -5.022   6.433  -3.976
   50   HG12  VAL   9          2HG1      VAL   9  -4.203   5.723  -5.367
   51   HG13  VAL   9          3HG1      VAL   9  -3.544   5.499  -3.746
   52   HG21  VAL   9          3HG2      VAL   9  -7.285   3.849  -3.644
   53   HG22  VAL   9          1HG2      VAL   9  -7.144   5.080  -4.892
   54   HG23  VAL   9          2HG2      VAL   9  -6.806   5.479  -3.199
   55    HA   PRO  10           HA       PRO  10  -6.737   3.839  -9.167
   56    HB2  PRO  10           2HB      PRO  10  -8.410   1.767  -9.597
   57    HB3  PRO  10           1HB      PRO  10  -6.666   1.612  -9.853
   58    HG2  PRO  10           2HG      PRO  10  -8.315   0.760  -7.497
   59    HG3  PRO  10           1HG      PRO  10  -7.032  -0.126  -8.340
   60    HD2  PRO  10           2HD      PRO  10  -6.599   1.202  -6.014
   61    HD3  PRO  10           1HD      PRO  10  -5.357   1.018  -7.266
   62    H    GLY  11           H        GLY  11  -8.138   3.103  -6.175
   63    HA2  GLY  11           2HA      GLY  11 -10.026   5.139  -6.200
   64    HA3  GLY  11           1HA      GLY  11 -10.852   3.646  -6.624
   65    H    CYS  12           H        CYS  12  -8.341   2.679  -4.657
   66    HA   CYS  12           HA       CYS  12 -10.114   2.117  -2.582
   67    HB2  CYS  12           2HB      CYS  12  -8.085   1.475  -1.207
   68    HB3  CYS  12           1HB      CYS  12  -8.366   0.573  -2.678
   69    H    TYR  13           H        TYR  13 -10.796   3.109  -0.949
   70    HA   TYR  13           HA       TYR  13 -11.347   5.285  -0.154
   71    HB2  TYR  13           2HB      TYR  13 -10.164   3.268   1.428
   72    HB3  TYR  13           1HB      TYR  13  -9.800   4.844   2.117
   73    HD1  TYR  13           1HD      TYR  13 -12.895   4.114   0.239
   74    HD2  TYR  13           2HD      TYR  13 -11.128   4.619   4.078
   75    HE1  TYR  13           1HE      TYR  13 -15.134   4.213   1.252
   76    HE2  TYR  13           2HE      TYR  13 -13.362   4.717   5.099
   77    HH   TYR  13           HH       TYR  13 -15.620   4.079   4.654
   78    H    ASN  14           H        ASN  14  -7.894   4.832   0.337
   79    HA   ASN  14           HA       ASN  14  -7.606   7.728   0.154
   80    HB2  ASN  14           2HB      ASN  14  -5.539   7.125   1.640
   81    HB3  ASN  14           1HB      ASN  14  -7.021   7.653   2.294
   82   HD21  ASN  14          1HD2      ASN  14  -8.226   4.965   1.731
   83   HD22  ASN  14          2HD2      ASN  14  -7.567   3.918   2.903
   84    H    ASN  15           H        ASN  15  -5.382   8.627  -0.513
   85    HA   ASN  15           HA       ASN  15  -4.126   6.666  -2.269
   86    HB2  ASN  15           2HB      ASN  15  -5.167   9.011  -3.042
   87    HB3  ASN  15           1HB      ASN  15  -3.578   9.589  -2.566
   88   HD21  ASN  15          1HD2      ASN  15  -1.753   8.169  -3.480
   89   HD22  ASN  15          2HD2      ASN  15  -1.893   7.770  -5.152
   90    H    SER  16           H        SER  16  -1.548   6.695  -2.210
   91    HA   SER  16           HA       SER  16  -0.656   7.149   0.439
   92    HB2  SER  16           2HB      SER  16   0.324   5.236  -0.602
   93    HB3  SER  16           1HB      SER  16   0.579   6.095  -2.080
   94    HG   SER  16           HG       SER  16   2.120   6.029   0.195
   95    H    HIS  17           H        HIS  17  -0.873   9.257  -2.271
   96    HA   HIS  17           HA       HIS  17   0.985  11.099  -0.959
   97    HB2  HIS  17           2HB      HIS  17   1.910  11.833  -3.067
   98    HB3  HIS  17           1HB      HIS  17   2.103  10.093  -2.962
   99    HD1  HIS  17           1HD      HIS  17   2.279  11.220  -5.696
  100    HD2  HIS  17           2HD      HIS  17  -1.358  10.150  -3.996
  101    HE1  HIS  17           1HE      HIS  17   0.718  10.841  -7.630
  102    HE2  HIS  17           2HE      HIS  17  -1.466  10.152  -6.579
  103    H    ARG  18           H        ARG  18  -2.092  10.583  -2.205
  104    HA   ARG  18           HA       ARG  18  -2.526  13.439  -2.692
  105    HB2  ARG  18           2HB      ARG  18  -3.190  11.758  -4.441
  106    HB3  ARG  18           1HB      ARG  18  -4.403  11.162  -3.319
  107    HG2  ARG  18           2HG      ARG  18  -4.535  14.043  -3.693
  108    HG3  ARG  18           1HG      ARG  18  -4.756  13.138  -5.192
  109    HD2  ARG  18           2HD      ARG  18  -6.235  11.875  -3.094
  110    HD3  ARG  18           1HD      ARG  18  -6.634  13.592  -3.135
  111    HE   ARG  18           HE       ARG  18  -7.621  13.300  -5.198
  112   HH11  ARG  18          1HH1      ARG  18  -5.911  10.390  -4.292
  113   HH12  ARG  18          2HH1      ARG  18  -6.628   9.432  -5.542
  114   HH21  ARG  18          1HH2      ARG  18  -8.557  12.038  -6.843
  115   HH22  ARG  18          2HH2      ARG  18  -8.128  10.367  -6.991
  116    H    ASP  19           H        ASP  19  -2.320  12.194   0.007
  117    HA   ASP  19           HA       ASP  19  -4.401  13.616   1.200
  118    HB2  ASP  19           2HB      ASP  19  -6.031  12.103   0.711
  119    HB3  ASP  19           1HB      ASP  19  -4.947  10.727   0.759
  120    H    LYS  20           H        LYS  20  -2.669  10.623   2.093
  121    HA   LYS  20           HA       LYS  20  -1.313  10.130   3.846
  122    HB2  LYS  20           2HB      LYS  20   0.367  11.600   4.288
  123    HB3  LYS  20           1HB      LYS  20  -0.281  12.352   2.843
  124    HG2  LYS  20           2HG      LYS  20  -0.480  14.237   3.982
  125    HG3  LYS  20           1HG      LYS  20  -1.717  13.471   4.976
  126    HD2  LYS  20           2HD      LYS  20   0.059  12.637   6.481
  127    HD3  LYS  20           1HD      LYS  20   1.253  13.497   5.506
  128    HE2  LYS  20           2HE      LYS  20   0.912  15.109   7.057
  129    HE3  LYS  20           1HE      LYS  20  -0.439  15.512   5.999
  130    HZ1  LYS  20           3HZ      LYS  20  -1.494  15.397   7.998
  131    HZ2  LYS  20           1HZ      LYS  20  -0.456  14.216   8.625
  132    HZ3  LYS  20           2HZ      LYS  20  -1.660  13.783   7.519
  133    H    ALA  21           H        ALA  21  -4.184  11.231   4.218
  134    HA   ALA  21           HA       ALA  21  -4.077  11.722   7.107
  135    HB1  ALA  21           1HB      ALA  21  -5.508  13.359   6.800
  136    HB2  ALA  21           2HB      ALA  21  -6.672  12.268   6.050
  137    HB3  ALA  21           3HB      ALA  21  -5.440  13.058   5.065
  138    H    LEU  22           H        LEU  22  -6.092   9.743   4.799
  139    HA   LEU  22           HA       LEU  22  -7.777   8.626   6.667
  140    HB2  LEU  22           2HB      LEU  22  -6.859   7.147   4.194
  141    HB3  LEU  22           1HB      LEU  22  -8.477   7.201   4.896
  142    HG   LEU  22           HG       LEU  22  -7.216   8.969   2.933
  143   HD11  LEU  22          1HD1      LEU  22  -9.829   7.746   3.531
  144   HD12  LEU  22          2HD1      LEU  22  -9.013   7.993   1.985
  145   HD13  LEU  22          3HD1      LEU  22  -9.876   9.326   2.749
  146   HD21  LEU  22          3HD2      LEU  22  -8.965  10.729   3.806
  147   HD22  LEU  22          1HD2      LEU  22  -7.280  10.724   4.300
  148   HD23  LEU  22          2HD2      LEU  22  -8.500  10.022   5.352
  149    H    HIS  23           H        HIS  23  -7.110   5.557   6.286
  150    HA   HIS  23           HA       HIS  23  -5.221   5.536   8.456
  151    HB2  HIS  23           2HB      HIS  23  -7.574   4.202   7.955
  152    HB3  HIS  23           1HB      HIS  23  -6.377   2.990   7.523
  153    HD1  HIS  23           1HD      HIS  23  -7.890   4.721  10.425
  154    HD2  HIS  23           2HD      HIS  23  -4.735   2.121   9.689
  155    HE1  HIS  23           1HE      HIS  23  -7.210   3.833  12.677
  156    HE2  HIS  23           2HE      HIS  23  -5.251   2.320  12.214
  157    H    PHE  24           H        PHE  24  -3.134   4.358   8.285
  158    HA   PHE  24           HA       PHE  24  -2.628   3.265   5.635
  159    HB2  PHE  24           2HB      PHE  24  -0.759   4.968   7.259
  160    HB3  PHE  24           1HB      PHE  24  -0.300   4.089   5.819
  161    HD1  PHE  24           2HD      PHE  24  -2.229   6.935   7.106
  162    HD2  PHE  24           1HD      PHE  24  -0.944   4.868   3.612
  163    HE1  PHE  24           2HE      PHE  24  -2.859   8.869   5.714
  164    HE2  PHE  24           1HE      PHE  24  -1.530   6.787   2.236
  165    HZ   PHE  24           HZ       PHE  24  -2.512   8.797   3.265
  166    H    TYR  25           H        TYR  25  -1.882   1.044   5.734
  167    HA   TYR  25           HA       TYR  25  -1.079   0.016   8.308
  168    HB2  TYR  25           2HB      TYR  25  -1.343  -1.376   5.616
  169    HB3  TYR  25           1HB      TYR  25  -0.930  -2.180   7.120
  170    HD1  TYR  25           2HD      TYR  25  -3.577   0.240   6.020
  171    HD2  TYR  25           1HD      TYR  25  -2.638  -3.386   8.034
  172    HE1  TYR  25           2HE      TYR  25  -5.960  -0.094   6.514
  173    HE2  TYR  25           1HE      TYR  25  -5.019  -3.733   8.534
  174    HH   TYR  25           HH       TYR  25  -7.476  -2.057   7.019
  175    H    THR  26           H        THR  26   1.121  -1.165   8.538
  176    HA   THR  26           HA       THR  26   3.080   0.286   6.903
  177    HB   THR  26           HB       THR  26   4.350   0.526   8.758
  178    HG1  THR  26           1HG      THR  26   3.745  -2.151   9.459
  179   HG21  THR  26          3HG2      THR  26   3.301   0.429  10.902
  180   HG22  THR  26          1HG2      THR  26   2.063  -0.670  10.295
  181   HG23  THR  26          2HG2      THR  26   2.123   0.994   9.717
  182    H    PHE  27           H        PHE  27   5.286  -0.994   6.737
  183    HA   PHE  27           HA       PHE  27   4.621  -3.271   5.199
  184    HB2  PHE  27           2HB      PHE  27   6.507  -1.251   5.170
  185    HB3  PHE  27           1HB      PHE  27   7.391  -2.757   5.139
  186    HD1  PHE  27           2HD      PHE  27   4.058  -2.242   3.626
  187    HD2  PHE  27           1HD      PHE  27   8.243  -2.550   2.978
  188    HE1  PHE  27           2HE      PHE  27   3.681  -2.434   1.204
  189    HE2  PHE  27           1HE      PHE  27   7.868  -2.763   0.580
  190    HZ   PHE  27           HZ       PHE  27   5.567  -2.700  -0.320
  191    HA   PRO  28           HA       PRO  28   5.817  -6.735   7.903
  192    HB2  PRO  28           2HB      PRO  28   7.027  -7.560   5.249
  193    HB3  PRO  28           1HB      PRO  28   6.214  -8.594   6.413
  194    HG2  PRO  28           2HG      PRO  28   4.881  -7.735   4.347
  195    HG3  PRO  28           1HG      PRO  28   4.113  -7.656   5.936
  196    HD2  PRO  28           2HD      PRO  28   5.183  -5.479   4.238
  197    HD3  PRO  28           1HD      PRO  28   3.872  -5.477   5.409
  198    H    LYS  29           H        LYS  29   7.960  -7.989   8.396
  199    HA   LYS  29           HA       LYS  29  10.127  -6.066   8.547
  200    HB2  LYS  29           2HB      LYS  29  11.184  -8.150   9.773
  201    HB3  LYS  29           1HB      LYS  29  10.025  -7.105  10.582
  202    HG2  LYS  29           2HG      LYS  29   8.419  -8.712  10.623
  203    HG3  LYS  29           1HG      LYS  29   8.959  -9.447   9.112
  204    HD2  LYS  29           2HD      LYS  29  10.488 -10.779  10.146
  205    HD3  LYS  29           1HD      LYS  29  10.803  -9.608  11.427
  206    HE2  LYS  29           2HE      LYS  29   8.651 -10.165  12.456
  207    HE3  LYS  29           1HE      LYS  29   8.343 -11.337  11.176
  208    HZ1  LYS  29           3HZ      LYS  29   9.357 -12.084  13.442
  209    HZ2  LYS  29           1HZ      LYS  29  10.812 -11.573  12.745
  210    HZ3  LYS  29           2HZ      LYS  29   9.894 -12.781  11.998
  211    H    ASP  30           H        ASP  30   9.309  -8.866   6.759
  212    HA   ASP  30           HA       ASP  30  11.995  -9.507   5.913
  213    HB2  ASP  30           2HB      ASP  30   9.930 -10.599   4.210
  214    HB3  ASP  30           1HB      ASP  30  11.030 -11.472   5.264
  215    H    ALA  31           H        ALA  31  13.073  -8.238   4.468
  216    HA   ALA  31           HA       ALA  31  12.142  -6.154   3.070
  217    HB1  ALA  31           1HB      ALA  31  14.388  -6.232   3.079
  218    HB2  ALA  31           2HB      ALA  31  14.123  -6.771   1.428
  219    HB3  ALA  31           3HB      ALA  31  14.476  -7.947   2.701
  220    H    GLU  32           H        GLU  32  12.621  -9.308   1.231
  221    HA   GLU  32           HA       GLU  32  11.310  -8.402  -1.065
  222    HB2  GLU  32           2HB      GLU  32  12.544 -10.431  -1.129
  223    HB3  GLU  32           1HB      GLU  32  11.562 -11.236   0.022
  224    HG2  GLU  32           2HG      GLU  32  10.292 -10.251  -2.476
  225    HG3  GLU  32           1HG      GLU  32  11.330 -11.675  -2.557
  226    H    LEU  33           H        LEU  33   9.525 -10.452   1.421
  227    HA   LEU  33           HA       LEU  33   7.124 -10.253   0.229
  228    HB2  LEU  33           2HB      LEU  33   7.745 -11.061   2.639
  229    HB3  LEU  33           1HB      LEU  33   7.350  -9.437   3.116
  230    HG   LEU  33           HG       LEU  33   5.209  -9.917   3.205
  231   HD11  LEU  33          1HD1      LEU  33   3.935 -10.806   1.287
  232   HD12  LEU  33          2HD1      LEU  33   5.450 -11.108   0.444
  233   HD13  LEU  33          3HD1      LEU  33   4.975  -9.459   0.835
  234   HD21  LEU  33          3HD2      LEU  33   6.318 -12.602   2.618
  235   HD22  LEU  33          1HD2      LEU  33   4.576 -12.385   2.756
  236   HD23  LEU  33          2HD2      LEU  33   5.623 -11.973   4.111
  237    H    ARG  34           H        ARG  34   8.885  -7.763   1.796
  238    HA   ARG  34           HA       ARG  34   6.988  -5.700   1.821
  239    HB2  ARG  34           2HB      ARG  34   8.624  -4.363   2.657
  240    HB3  ARG  34           1HB      ARG  34   9.448  -5.886   2.870
  241    HG2  ARG  34           2HG      ARG  34  11.156  -5.009   1.773
  242    HG3  ARG  34           1HG      ARG  34  10.182  -5.035   0.317
  243    HD2  ARG  34           2HD      ARG  34  10.421  -2.842   0.243
  244    HD3  ARG  34           1HD      ARG  34   9.361  -2.758   1.639
  245    HE   ARG  34           HE       ARG  34  11.148  -2.186   2.928
  246   HH11  ARG  34          1HH1      ARG  34  12.325  -3.603  -0.033
  247   HH12  ARG  34          2HH1      ARG  34  13.984  -3.243   0.308
  248   HH21  ARG  34          1HH2      ARG  34  13.325  -1.711   3.380
  249   HH22  ARG  34          2HH2      ARG  34  14.553  -2.168   2.247
  250    H    ARG  35           H        ARG  35   9.587  -6.218  -0.508
  251    HA   ARG  35           HA       ARG  35   8.709  -4.233  -2.232
  252    HB2  ARG  35           2HB      ARG  35  10.148  -5.080  -3.873
  253    HB3  ARG  35           1HB      ARG  35  10.928  -5.460  -2.352
  254    HG2  ARG  35           2HG      ARG  35  11.213  -7.306  -3.795
  255    HG3  ARG  35           1HG      ARG  35  10.047  -7.794  -2.578
  256    HD2  ARG  35           2HD      ARG  35   8.453  -8.133  -4.121
  257    HD3  ARG  35           1HD      ARG  35   8.795  -6.599  -4.918
  258    HE   ARG  35           HE       ARG  35   9.608  -9.156  -5.779
  259   HH11  ARG  35          1HH1      ARG  35  10.799  -5.889  -5.508
  260   HH12  ARG  35          2HH1      ARG  35  11.897  -6.044  -6.838
  261   HH21  ARG  35          1HH2      ARG  35  11.052  -9.365  -7.528
  262   HH22  ARG  35          2HH2      ARG  35  12.041  -8.017  -7.985
  263    H    LEU  36           H        LEU  36   7.578  -7.532  -1.688
  264    HA   LEU  36           HA       LEU  36   6.022  -7.643  -4.104
  265    HB2  LEU  36           2HB      LEU  36   5.533  -8.943  -1.424
  266    HB3  LEU  36           1HB      LEU  36   4.515  -9.203  -2.820
  267    HG   LEU  36           HG       LEU  36   7.469  -9.782  -2.837
  268   HD11  LEU  36          1HD1      LEU  36   5.236 -11.314  -1.694
  269   HD12  LEU  36          2HD1      LEU  36   6.965 -11.401  -1.360
  270   HD13  LEU  36          3HD1      LEU  36   6.299 -12.216  -2.774
  271   HD21  LEU  36          3HD2      LEU  36   6.652  -9.585  -5.037
  272   HD22  LEU  36          1HD2      LEU  36   5.160 -10.440  -4.645
  273   HD23  LEU  36          2HD2      LEU  36   6.689 -11.316  -4.703
  274    H    TRP  37           H        TRP  37   5.147  -6.354  -0.887
  275    HA   TRP  37           HA       TRP  37   2.559  -5.617  -1.728
  276    HB2  TRP  37           2HB      TRP  37   4.399  -4.596   0.418
  277    HB3  TRP  37           1HB      TRP  37   2.846  -3.833   0.108
  278    HD1  TRP  37           HD       TRP  37   3.240  -7.597  -0.210
  279    HE1  TRP  37           1HE      TRP  37   1.962  -8.753   1.738
  280    HE3  TRP  37           3HE      TRP  37   1.825  -3.466   2.435
  281    HZ2  TRP  37           2HZ      TRP  37   0.555  -7.973   4.083
  282    HZ3  TRP  37           3HZ      TRP  37   0.571  -3.733   4.487
  283    HH2  TRP  37           HH       TRP  37  -0.071  -5.923   5.295
  284    H    LEU  38           H        LEU  38   5.785  -3.999  -1.970
  285    HA   LEU  38           HA       LEU  38   5.193  -1.438  -2.650
  286    HB2  LEU  38           2HB      LEU  38   7.081  -3.342  -4.070
  287    HB3  LEU  38           1HB      LEU  38   6.953  -1.669  -4.480
  288    HG   LEU  38           HG       LEU  38   8.055  -2.904  -2.019
  289   HD11  LEU  38          1HD1      LEU  38   9.560  -2.406  -3.849
  290   HD12  LEU  38          2HD1      LEU  38   9.887  -1.356  -2.471
  291   HD13  LEU  38          3HD1      LEU  38   9.007  -0.732  -3.864
  292   HD21  LEU  38          3HD2      LEU  38   8.077  -0.738  -0.911
  293   HD22  LEU  38          1HD2      LEU  38   6.423  -1.264  -1.218
  294   HD23  LEU  38          2HD2      LEU  38   7.160  -0.037  -2.245
  295    H    LYS  39           H        LYS  39   4.951  -4.361  -4.824
  296    HA   LYS  39           HA       LYS  39   3.969  -3.239  -7.072
  297    HB2  LYS  39           2HB      LYS  39   3.846  -5.840  -5.705
  298    HB3  LYS  39           1HB      LYS  39   2.612  -5.609  -6.920
  299    HG2  LYS  39           2HG      LYS  39   4.771  -6.742  -7.583
  300    HG3  LYS  39           1HG      LYS  39   4.200  -5.435  -8.632
  301    HD2  LYS  39           2HD      LYS  39   5.761  -3.998  -7.030
  302    HD3  LYS  39           1HD      LYS  39   6.553  -5.557  -6.811
  303    HE2  LYS  39           2HE      LYS  39   5.971  -4.347  -9.505
  304    HE3  LYS  39           1HE      LYS  39   7.492  -4.120  -8.645
  305    HZ1  LYS  39           3HZ      LYS  39   6.491  -6.443 -10.054
  306    HZ2  LYS  39           1HZ      LYS  39   7.242  -6.777  -8.574
  307    HZ3  LYS  39           2HZ      LYS  39   8.085  -5.945  -9.781
  308    H    ASN  40           H        ASN  40   1.812  -4.590  -4.580
  309    HA   ASN  40           HA       ASN  40  -0.562  -3.721  -5.697
  310    HB2  ASN  40           2HB      ASN  40  -0.721  -3.714  -2.797
  311    HB3  ASN  40           1HB      ASN  40  -1.493  -4.776  -3.960
  312   HD21  ASN  40          1HD2      ASN  40  -0.622  -5.617  -1.481
  313   HD22  ASN  40          2HD2      ASN  40   0.688  -6.720  -1.679
  314    H    VAL  41           H        VAL  41   1.488  -2.124  -3.385
  315    HA   VAL  41           HA       VAL  41  -0.354   0.025  -3.070
  316    HB   VAL  41           HB       VAL  41   1.572  -0.950  -1.413
  317   HG11  VAL  41          1HG1      VAL  41   2.449   1.843  -2.001
  318   HG12  VAL  41          2HG1      VAL  41   3.178   0.491  -2.856
  319   HG13  VAL  41          3HG1      VAL  41   3.283   0.579  -1.099
  320   HG21  VAL  41          3HG2      VAL  41   0.654   0.535   0.105
  321   HG22  VAL  41          1HG2      VAL  41  -0.606   0.431  -1.125
  322   HG23  VAL  41          2HG2      VAL  41   0.484   1.818  -1.093
  323    H    SER  42           H        SER  42   2.303  -0.451  -5.291
  324    HA   SER  42           HA       SER  42   1.923   1.496  -6.994
  325    HB2  SER  42           2HB      SER  42   1.571   3.456  -5.865
  326    HB3  SER  42           1HB      SER  42   2.437   2.930  -4.401
  327    HG   SER  42           HG       SER  42   3.757   3.638  -6.826
  328    H    ARG  43           H        ARG  43   4.968   2.291  -5.125
  329    HA   ARG  43           HA       ARG  43   7.099   1.585  -5.480
  330    HB2  ARG  43           2HB      ARG  43   7.421  -0.529  -6.130
  331    HB3  ARG  43           1HB      ARG  43   5.689  -0.629  -6.398
  332    HG2  ARG  43           2HG      ARG  43   6.550   0.463  -8.751
  333    HG3  ARG  43           1HG      ARG  43   7.899  -0.587  -8.318
  334    HD2  ARG  43           2HD      ARG  43   6.290  -2.445  -8.037
  335    HD3  ARG  43           1HD      ARG  43   5.004  -1.375  -8.589
  336    HE   ARG  43           HE       ARG  43   7.306  -1.787 -10.341
  337   HH11  ARG  43          1HH1      ARG  43   3.939  -2.428  -9.647
  338   HH12  ARG  43          2HH1      ARG  43   3.584  -2.950 -11.259
  339   HH21  ARG  43          1HH2      ARG  43   6.832  -2.478 -12.453
  340   HH22  ARG  43          2HH2      ARG  43   5.224  -2.983 -12.849
  341    H    ALA  44           H        ALA  44   5.031   2.399  -8.181
  342    HA   ALA  44           HA       ALA  44   6.919   2.956 -10.149
  343    HB1  ALA  44           1HB      ALA  44   4.426   2.865 -10.406
  344    HB2  ALA  44           2HB      ALA  44   5.203   4.214 -11.235
  345    HB3  ALA  44           3HB      ALA  44   4.352   4.485  -9.713
  346    H    GLY  45           H        GLY  45   8.666   3.946  -8.446
  347    HA2  GLY  45           2HA      GLY  45   8.142   6.845  -8.232
  348    HA3  GLY  45           1HA      GLY  45   9.191   5.934  -7.165
  349    H    VAL  46           H        VAL  46   8.921   6.105 -10.689
  350    HA   VAL  46           HA       VAL  46  11.628   5.852 -11.251
  351    HB   VAL  46           HB       VAL  46   9.499   5.816 -12.789
  352   HG11  VAL  46          1HG1      VAL  46   9.253   8.365 -12.464
  353   HG12  VAL  46          2HG1      VAL  46   9.044   7.683 -14.077
  354   HG13  VAL  46          3HG1      VAL  46  10.562   8.474 -13.646
  355   HG21  VAL  46          3HG2      VAL  46  12.113   6.797 -13.909
  356   HG22  VAL  46          1HG2      VAL  46  10.924   5.749 -14.682
  357   HG23  VAL  46          2HG2      VAL  46  11.863   5.156 -13.312
  358    H    SER  47           H        SER  47  12.518   7.451  -9.432
  359    HA   SER  47           HA       SER  47  12.629   9.750  -8.661
  360    HB2  SER  47           2HB      SER  47  14.786   8.763  -8.982
  361    HB3  SER  47           1HB      SER  47  14.681   8.929 -10.742
  362    HG   SER  47           HG       SER  47  14.897  11.031  -8.841
  363    H    GLY  48           H        GLY  48  13.608  10.043 -12.275
  364    HA2  GLY  48           2HA      GLY  48  13.256  11.905 -13.602
  365    HA3  GLY  48           1HA      GLY  48  11.588  11.435 -13.328
  366    H    CYS  49           H        CYS  49  10.309  12.624 -11.935
  367    HA   CYS  49           HA       CYS  49  11.481  15.154 -10.981
  368    HB2  CYS  49           2HB      CYS  49   8.595  14.811 -11.787
  369    HB3  CYS  49           1HB      CYS  49   9.492  16.309 -11.559
  370    HG   CYS  49           HG       CYS  49   9.089  15.500 -14.149
  371    H    PHE  50           H        PHE  50   8.800  15.782  -9.763
  372    HA   PHE  50           HA       PHE  50   9.203  15.241  -7.133
  373    HB2  PHE  50           2HB      PHE  50   7.385  16.657  -8.100
  374    HB3  PHE  50           1HB      PHE  50   6.472  15.196  -8.465
  375    HD1  PHE  50           2HD      PHE  50   8.459  16.121  -5.454
  376    HD2  PHE  50           1HD      PHE  50   4.630  15.215  -7.076
  377    HE1  PHE  50           2HE      PHE  50   7.493  16.167  -3.190
  378    HE2  PHE  50           1HE      PHE  50   3.658  15.261  -4.816
  379    HZ   PHE  50           HZ       PHE  50   5.090  15.737  -2.870
  380    H    SER  51           H        SER  51   7.783  12.910  -9.547
  381    HA   SER  51           HA       SER  51   6.747  11.062  -7.708
  382    HB2  SER  51           2HB      SER  51   6.498  11.233 -10.285
  383    HB3  SER  51           1HB      SER  51   7.949  10.230 -10.329
  384    HG   SER  51           HG       SER  51   6.870   8.601  -9.363
  385    H    THR  52           H        THR  52   8.892  11.470  -6.229
  386    HA   THR  52           HA       THR  52  10.686   9.193  -6.761
  387    HB   THR  52           HB       THR  52  12.517  10.402  -5.813
  388    HG1  THR  52           1HG      THR  52  11.547  11.531  -4.176
  389   HG21  THR  52          3HG2      THR  52  11.791  12.777  -7.179
  390   HG22  THR  52          1HG2      THR  52  11.184  11.394  -8.089
  391   HG23  THR  52          2HG2      THR  52  12.898  11.500  -7.685
  392    H    PHE  53           H        PHE  53   8.577   8.401  -5.421
  393    HA   PHE  53           HA       PHE  53   8.921   8.877  -2.576
  394    HB2  PHE  53           2HB      PHE  53   6.871   7.466  -2.360
  395    HB3  PHE  53           1HB      PHE  53   6.654   8.902  -3.347
  396    HD1  PHE  53           1HD      PHE  53   7.633   5.311  -3.818
  397    HD2  PHE  53           2HD      PHE  53   5.444   8.664  -5.262
  398    HE1  PHE  53           1HE      PHE  53   6.732   3.928  -5.637
  399    HE2  PHE  53           2HE      PHE  53   4.537   7.284  -7.087
  400    HZ   PHE  53           HZ       PHE  53   5.177   4.911  -7.269
  401    H    GLN  54           H        GLN  54  11.045   7.452  -3.886
  402    HA   GLN  54           HA       GLN  54  11.488   4.931  -4.033
  403    HB2  GLN  54           2HB      GLN  54  12.848   6.931  -2.345
  404    HB3  GLN  54           1HB      GLN  54  13.278   5.260  -2.024
  405    HG2  GLN  54           2HG      GLN  54  14.231   4.965  -4.096
  406    HG3  GLN  54           1HG      GLN  54  13.286   6.260  -4.831
  407   HE21  GLN  54          1HE2      GLN  54  15.869   5.633  -2.507
  408   HE22  GLN  54          2HE2      GLN  54  16.719   7.112  -2.780
  409    HA   PRO  55           HA       PRO  55   9.235   2.765  -0.852
  410    HB2  PRO  55           2HB      PRO  55  10.686   0.341  -1.454
  411    HB3  PRO  55           1HB      PRO  55   9.009   0.747  -1.794
  412    HG2  PRO  55           2HG      PRO  55  10.971   0.495  -3.711
  413    HG3  PRO  55           1HG      PRO  55   9.453   1.378  -3.919
  414    HD2  PRO  55           2HD      PRO  55  12.193   2.405  -3.446
  415    HD3  PRO  55           1HD      PRO  55  10.834   3.153  -4.312
  416    H    THR  56           H        THR  56  12.733   2.637  -1.109
  417    HA   THR  56           HA       THR  56  13.452   1.279   1.190
  418    HB   THR  56           HB       THR  56  15.216   2.026  -0.171
  419    HG1  THR  56           1HG      THR  56  15.308   3.855   1.985
  420   HG21  THR  56          3HG2      THR  56  14.485   3.803  -1.444
  421   HG22  THR  56          1HG2      THR  56  15.693   4.545  -0.395
  422   HG23  THR  56          2HG2      THR  56  13.977   4.737  -0.037
  423    H    THR  57           H        THR  57  12.237   4.707   0.875
  424    HA   THR  57           HA       THR  57  12.696   5.504   3.506
  425    HB   THR  57           HB       THR  57  11.972   6.991   1.645
  426    HG1  THR  57           1HG      THR  57  11.373   8.287   3.161
  427   HG21  THR  57          3HG2      THR  57   9.872   5.238   1.312
  428   HG22  THR  57          1HG2      THR  57  10.034   6.832   0.575
  429   HG23  THR  57          2HG2      THR  57   9.130   6.643   2.078
  430    H    GLY  58           H        GLY  58  10.210   3.436   2.148
  431    HA2  GLY  58           2HA      GLY  58   9.326   1.815   3.851
  432    HA3  GLY  58           1HA      GLY  58   9.060   3.217   4.854
  433    H    HIS  59           H        HIS  59   7.740   1.550   1.891
  434    HA   HIS  59           HA       HIS  59   5.645   3.517   1.716
  435    HB2  HIS  59           2HB      HIS  59   6.519   1.215   0.129
  436    HB3  HIS  59           1HB      HIS  59   4.769   1.342   0.249
  437    HD1  HIS  59           1HD      HIS  59   7.182   4.228  -0.019
  438    HD2  HIS  59           2HD      HIS  59   4.205   2.363  -2.263
  439    HE1  HIS  59           1HE      HIS  59   6.810   5.701  -2.013
  440    HE2  HIS  59           2HE      HIS  59   5.100   4.496  -3.411
  441    H    ARG  60           H        ARG  60   3.571   3.305   2.305
  442    HA   ARG  60           HA       ARG  60   2.927   1.162   4.228
  443    HB2  ARG  60           2HB      ARG  60   1.776   2.735   5.533
  444    HB3  ARG  60           1HB      ARG  60   3.176   3.618   4.977
  445    HG2  ARG  60           2HG      ARG  60   0.684   3.837   3.373
  446    HG3  ARG  60           1HG      ARG  60   0.811   4.712   4.895
  447    HD2  ARG  60           2HD      ARG  60   2.777   4.897   2.624
  448    HD3  ARG  60           1HD      ARG  60   1.515   6.072   2.976
  449    HE   ARG  60           HE       ARG  60   4.026   5.762   4.342
  450   HH11  ARG  60          1HH1      ARG  60   0.754   6.945   4.597
  451   HH12  ARG  60          2HH1      ARG  60   1.130   8.084   5.844
  452   HH21  ARG  60          1HH2      ARG  60   4.522   7.262   5.984
  453   HH22  ARG  60          2HH2      ARG  60   3.267   8.264   6.632
  454    H    LEU  61           H        LEU  61   0.374   0.854   4.350
  455    HA   LEU  61           HA       LEU  61  -0.672   0.674   1.591
  456    HB2  LEU  61           2HB      LEU  61  -0.328  -1.197   3.739
  457    HB3  LEU  61           1HB      LEU  61  -2.045  -1.007   3.517
  458    HG   LEU  61           HG       LEU  61  -0.213  -2.639   2.081
  459   HD11  LEU  61          1HD1      LEU  61  -3.148  -2.259   2.159
  460   HD12  LEU  61          2HD1      LEU  61  -2.172  -3.566   2.791
  461   HD13  LEU  61          3HD1      LEU  61  -2.391  -3.412   1.057
  462   HD21  LEU  61          3HD2      LEU  61  -1.440  -0.489   0.459
  463   HD22  LEU  61          1HD2      LEU  61  -1.276  -2.119  -0.194
  464   HD23  LEU  61          2HD2      LEU  61   0.151  -1.243   0.341
  465    H    CYS  62           H        CYS  62  -3.242   0.989   1.413
  466    HA   CYS  62           HA       CYS  62  -4.219   2.475   3.719
  467    HB2  CYS  62           2HB      CYS  62  -4.814   4.313   2.520
  468    HB3  CYS  62           1HB      CYS  62  -3.527   3.780   1.553
  469    H    SER  63           H        SER  63  -6.799   2.812   3.465
  470    HA   SER  63           HA       SER  63  -7.961   0.835   4.618
  471    HB2  SER  63           2HB      SER  63  -8.826   3.287   3.477
  472    HB3  SER  63           1HB      SER  63 -10.066   2.087   3.157
  473    HG   SER  63           HG       SER  63  -9.767   1.539   5.488
  474    H    VAL  64           H        VAL  64  -9.638   1.375   1.735
  475    HA   VAL  64           HA       VAL  64 -10.964  -1.043   1.856
  476    HB   VAL  64           HB       VAL  64 -12.122  -0.476  -0.129
  477   HG11  VAL  64          1HG1      VAL  64 -11.990   1.070   2.120
  478   HG12  VAL  64          2HG1      VAL  64 -13.182   1.249   0.832
  479   HG13  VAL  64          3HG1      VAL  64 -11.732   2.251   0.837
  480   HG21  VAL  64          3HG2      VAL  64 -10.259   0.099  -1.550
  481   HG22  VAL  64          1HG2      VAL  64  -9.929   1.531  -0.575
  482   HG23  VAL  64          2HG2      VAL  64 -11.424   1.423  -1.513
  483    H    HIS  65           H        HIS  65  -8.264  -1.897   1.545
  484    HA   HIS  65           HA       HIS  65  -8.779  -3.650  -0.768
  485    HB2  HIS  65           2HB      HIS  65  -6.067  -3.439  -0.939
  486    HB3  HIS  65           1HB      HIS  65  -7.243  -2.611  -1.957
  487    HD1  HIS  65           1HD      HIS  65  -8.138  -0.328  -0.432
  488    HD2  HIS  65           2HD      HIS  65  -4.201  -1.600  -0.399
  489    HE1  HIS  65           1HE      HIS  65  -6.831   1.601   0.404
  490    H    PHE  66           H        PHE  66  -9.286  -4.347   1.815
  491    HA   PHE  66           HA       PHE  66  -7.240  -6.409   2.219
  492    HB2  PHE  66           2HB      PHE  66  -8.216  -4.389   4.127
  493    HB3  PHE  66           1HB      PHE  66  -8.240  -6.028   4.760
  494    HD1  PHE  66           2HD      PHE  66  -5.948  -7.333   3.860
  495    HD2  PHE  66           1HD      PHE  66  -6.400  -3.217   4.836
  496    HE1  PHE  66           2HE      PHE  66  -3.542  -7.188   4.345
  497    HE2  PHE  66           1HE      PHE  66  -3.996  -3.065   5.324
  498    HZ   PHE  66           HZ       PHE  66  -2.572  -5.052   5.080
  499    H    GLN  67           H        GLN  67  -8.270  -8.356   3.622
  500    HA   GLN  67           HA       GLN  67 -11.012  -8.657   2.685
  501    HB2  GLN  67           2HB      GLN  67 -10.673 -11.071   2.928
  502    HB3  GLN  67           1HB      GLN  67  -9.401 -10.369   1.939
  503    HG2  GLN  67           2HG      GLN  67  -8.232 -11.806   3.304
  504    HG3  GLN  67           1HG      GLN  67  -8.064 -10.268   4.147
  505   HE21  GLN  67          1HE2      GLN  67 -10.548 -12.800   3.984
  506   HE22  GLN  67          2HE2      GLN  67 -10.704 -12.993   5.694
  507    H    GLY  68           H        GLY  68 -12.706  -9.466   4.453
  508    HA2  GLY  68           2HA      GLY  68 -13.514  -8.946   6.570
  509    HA3  GLY  68           1HA      GLY  68 -12.508 -10.339   6.895
  510    H    GLY  69           H        GLY  69 -10.102  -9.734   7.475
  511    HA2  GLY  69           2HA      GLY  69  -9.295  -7.218   8.258
  512    HA3  GLY  69           1HA      GLY  69 -10.181  -7.869   9.628
  513    H    ARG  70           H        ARG  70  -7.398  -7.201   9.626
  514    HA   ARG  70           HA       ARG  70  -5.324  -8.033  10.092
  515    HB2  ARG  70           2HB      ARG  70  -5.772 -10.390  11.469
  516    HB3  ARG  70           1HB      ARG  70  -5.710  -8.780  12.166
  517    HG2  ARG  70           2HG      ARG  70  -8.172  -8.615  11.836
  518    HG3  ARG  70           1HG      ARG  70  -8.161 -10.302  11.320
  519    HD2  ARG  70           2HD      ARG  70  -8.707 -10.430  13.579
  520    HD3  ARG  70           1HD      ARG  70  -6.975 -10.763  13.553
  521    HE   ARG  70           HE       ARG  70  -6.611  -8.815  14.705
  522   HH11  ARG  70          1HH1      ARG  70  -9.884  -8.822  13.491
  523   HH12  ARG  70          2HH1      ARG  70 -10.353  -7.418  14.391
  524   HH21  ARG  70          1HH2      ARG  70  -7.228  -6.971  15.891
  525   HH22  ARG  70          2HH2      ARG  70  -8.845  -6.368  15.754
  526    H    LYS  71           H        LYS  71  -5.915  -8.609   7.538
  527    HA   LYS  71           HA       LYS  71  -6.147 -10.756   6.209
  528    HB2  LYS  71           2HB      LYS  71  -4.871  -9.770   4.678
  529    HB3  LYS  71           1HB      LYS  71  -4.437  -8.598   5.902
  530    HG2  LYS  71           2HG      LYS  71  -2.743 -10.938   6.076
  531    HG3  LYS  71           1HG      LYS  71  -2.732 -10.247   4.460
  532    HD2  LYS  71           2HD      LYS  71  -0.985  -9.302   5.929
  533    HD3  LYS  71           1HD      LYS  71  -2.112  -8.091   5.323
  534    HE2  LYS  71           2HE      LYS  71  -3.354  -8.662   7.609
  535    HE3  LYS  71           1HE      LYS  71  -1.713  -9.117   8.077
  536    HZ1  LYS  71           3HZ      LYS  71  -2.281  -6.506   6.819
  537    HZ2  LYS  71           1HZ      LYS  71  -0.939  -6.963   7.745
  538    HZ3  LYS  71           2HZ      LYS  71  -2.440  -6.730   8.488
  539    H    THR  72           H        THR  72  -5.883 -12.865   6.409
  540    HA   THR  72           HA       THR  72  -3.394 -13.967   7.434
  541    HB   THR  72           HB       THR  72  -4.833 -13.638   9.435
  542    HG1  THR  72           1HG      THR  72  -4.336 -15.585  10.242
  543   HG21  THR  72          3HG2      THR  72  -6.884 -14.675   7.799
  544   HG22  THR  72          1HG2      THR  72  -6.976 -14.163   9.485
  545   HG23  THR  72          2HG2      THR  72  -6.597 -15.839   9.092
  546    H    TYR  73           H        TYR  73  -2.827 -15.705   6.278
  547    HA   TYR  73           HA       TYR  73  -2.894 -17.357   4.723
  548    HB2  TYR  73           2HB      TYR  73  -4.429 -18.239   6.657
  549    HB3  TYR  73           1HB      TYR  73  -5.736 -17.957   5.513
  550    HD1  TYR  73           2HD      TYR  73  -2.297 -19.234   4.851
  551    HD2  TYR  73           1HD      TYR  73  -6.461 -20.098   4.954
  552    HE1  TYR  73           2HE      TYR  73  -1.863 -21.428   3.825
  553    HE2  TYR  73           1HE      TYR  73  -6.039 -22.294   3.930
  554    HH   TYR  73           HH       TYR  73  -4.369 -23.411   2.596
  555    H    THR  74           H        THR  74  -4.422 -18.231   2.744
  556    HA   THR  74           HA       THR  74  -5.166 -17.582   0.684
  557    HB   THR  74           HB       THR  74  -7.403 -16.097   1.107
  558    HG1  THR  74           1HG      THR  74  -7.059 -17.619   3.470
  559   HG21  THR  74          3HG2      THR  74  -6.867 -18.738   0.506
  560   HG22  THR  74          1HG2      THR  74  -8.449 -17.956   0.500
  561   HG23  THR  74          2HG2      THR  74  -7.900 -18.825   1.934
  562    H    VAL  75           H        VAL  75  -5.760 -14.649   2.673
  563    HA   VAL  75           HA       VAL  75  -5.094 -12.902   0.483
  564    HB   VAL  75           HB       VAL  75  -6.859 -12.369   2.113
  565   HG11  VAL  75          1HG1      VAL  75  -5.407 -11.565   4.396
  566   HG12  VAL  75          2HG1      VAL  75  -4.923 -13.210   3.999
  567   HG13  VAL  75          3HG1      VAL  75  -6.625 -12.829   4.246
  568   HG21  VAL  75          3HG2      VAL  75  -4.601 -10.374   2.424
  569   HG22  VAL  75          1HG2      VAL  75  -6.310 -10.076   2.721
  570   HG23  VAL  75          2HG2      VAL  75  -5.755 -10.419   1.086
  571    H    ARG  76           H        ARG  76  -2.814 -13.284  -0.006
  572    HA   ARG  76           HA       ARG  76  -0.950 -12.974   2.220
  573    HB2  ARG  76           2HB      ARG  76  -0.618 -14.798   0.562
  574    HB3  ARG  76           1HB      ARG  76  -0.340 -13.591  -0.682
  575    HG2  ARG  76           2HG      ARG  76   1.446 -12.814   1.202
  576    HG3  ARG  76           1HG      ARG  76   1.430 -14.563   1.438
  577    HD2  ARG  76           2HD      ARG  76   2.025 -14.954  -0.834
  578    HD3  ARG  76           1HD      ARG  76   1.777 -13.260  -1.255
  579    HE   ARG  76           HE       ARG  76   3.901 -12.834  -0.547
  580   HH11  ARG  76          1HH1      ARG  76   2.854 -15.846   0.872
  581   HH12  ARG  76          2HH1      ARG  76   4.390 -16.183   1.598
  582   HH21  ARG  76          1HH2      ARG  76   5.922 -13.276   0.406
  583   HH22  ARG  76          2HH2      ARG  76   6.131 -14.724   1.334
  584    H    VAL  77           H        VAL  77  -1.723 -11.360  -0.871
  585    HA   VAL  77           HA       VAL  77  -0.386  -8.982   0.207
  586    HB   VAL  77           HB       VAL  77   0.734  -8.490  -1.809
  587   HG11  VAL  77          1HG1      VAL  77   1.837 -10.312  -0.704
  588   HG12  VAL  77          2HG1      VAL  77   1.944 -10.546  -2.449
  589   HG13  VAL  77          3HG1      VAL  77   0.788 -11.484  -1.501
  590   HG21  VAL  77          3HG2      VAL  77   0.310  -9.642  -3.935
  591   HG22  VAL  77          1HG2      VAL  77  -1.106  -8.778  -3.338
  592   HG23  VAL  77          2HG2      VAL  77  -1.011 -10.531  -3.173
  593    HA   PRO  78           HA       PRO  78  -4.502  -7.250  -0.421
  594    HB2  PRO  78           2HB      PRO  78  -2.812  -4.791  -0.417
  595    HB3  PRO  78           1HB      PRO  78  -4.340  -5.088   0.414
  596    HG2  PRO  78           2HG      PRO  78  -2.157  -5.231   1.827
  597    HG3  PRO  78           1HG      PRO  78  -3.282  -6.602   1.946
  598    HD2  PRO  78           2HD      PRO  78  -0.793  -6.342   0.286
  599    HD3  PRO  78           1HD      PRO  78  -1.268  -7.670   1.378
  600    H    THR  79           H        THR  79  -3.595  -8.100  -3.054
  601    HA   THR  79           HA       THR  79  -4.064  -5.474  -4.315
  602    HB   THR  79           HB       THR  79  -2.972  -6.228  -6.290
  603    HG1  THR  79           1HG      THR  79  -3.264  -8.871  -5.309
  604   HG21  THR  79          3HG2      THR  79  -1.137  -7.954  -5.136
  605   HG22  THR  79          1HG2      THR  79  -1.619  -6.867  -3.833
  606   HG23  THR  79          2HG2      THR  79  -0.985  -6.209  -5.340
  607    H    ILE  80           H        ILE  80  -6.112  -5.199  -4.415
  608    HA   ILE  80           HA       ILE  80  -7.783  -7.106  -5.887
  609    HB   ILE  80           HB       ILE  80  -8.592  -5.433  -3.496
  610   HG12  ILE  80          2HG1      ILE  80  -9.520  -7.996  -3.112
  611   HG13  ILE  80          1HG1      ILE  80  -7.988  -8.271  -3.936
  612   HG21  ILE  80          1HG2      ILE  80 -10.851  -6.659  -3.967
  613   HG22  ILE  80          2HG2      ILE  80 -10.240  -6.719  -5.622
  614   HG23  ILE  80          3HG2      ILE  80 -10.453  -5.164  -4.814
  615   HD11  ILE  80          3HD1      ILE  80  -6.933  -7.978  -2.017
  616   HD12  ILE  80          1HD1      ILE  80  -8.467  -7.644  -1.211
  617   HD13  ILE  80          2HD1      ILE  80  -7.542  -6.326  -1.934
  618    H    PHE  81           H        PHE  81  -7.650  -5.942  -7.924
  619    HA   PHE  81           HA       PHE  81  -9.253  -3.606  -8.079
  620    HB2  PHE  81           2HB      PHE  81  -6.521  -2.865  -9.019
  621    HB3  PHE  81           1HB      PHE  81  -7.812  -1.845  -8.416
  622    HD1  PHE  81           2HD      PHE  81  -8.194  -1.817  -5.841
  623    HD2  PHE  81           1HD      PHE  81  -4.693  -3.370  -7.707
  624    HE1  PHE  81           2HE      PHE  81  -6.993  -1.661  -3.703
  625    HE2  PHE  81           1HE      PHE  81  -3.474  -3.179  -5.573
  626    HZ   PHE  81           HZ       PHE  81  -4.639  -2.362  -3.540
  Start of MODEL   13
    1    H1   GLY   1           1HT      GLY   1   7.871  16.358   6.433
    2    H2   GLY   1           2HT      GLY   1   8.813  17.759   6.350
    3    H3   GLY   1           3HT      GLY   1   8.956  16.573   5.154
    4    HA2  GLY   1           1HA      GLY   1   6.388  17.940   5.645
    5    HA3  GLY   1           2HA      GLY   1   7.609  18.657   4.606
    6    H    SER   2           H        SER   2   7.296  15.203   4.785
    7    HA   SER   2           HA       SER   2   7.040  14.849   2.037
    8    HB2  SER   2           2HB      SER   2   6.001  12.541   2.890
    9    HB3  SER   2           1HB      SER   2   7.721  12.902   3.042
   10    HG   SER   2           HG       SER   2   5.737  13.260   5.042
   11    HA   PRO   3           HA       PRO   3   2.702  15.942   1.686
   12    HB2  PRO   3           2HB      PRO   3   2.562  16.013  -0.988
   13    HB3  PRO   3           1HB      PRO   3   3.417  17.263  -0.073
   14    HG2  PRO   3           2HG      PRO   3   4.523  14.904  -1.544
   15    HG3  PRO   3           1HG      PRO   3   5.123  16.573  -1.492
   16    HD2  PRO   3           2HD      PRO   3   6.146  14.515   0.020
   17    HD3  PRO   3           1HD      PRO   3   6.250  16.229   0.470
   18    H    GLY   4           H        GLY   4   4.160  12.985   1.054
   19    HA2  GLY   4           2HA      GLY   4   2.413  11.165   1.461
   20    HA3  GLY   4           1HA      GLY   4   1.651  11.847   0.032
   21    H    PHE   5           H        PHE   5   2.060   9.301  -0.447
   22    HA   PHE   5           HA       PHE   5   4.474   9.255  -2.093
   23    HB2  PHE   5           2HB      PHE   5   3.792   7.012  -0.200
   24    HB3  PHE   5           1HB      PHE   5   5.175   7.108  -1.267
   25    HD1  PHE   5           2HD      PHE   5   6.603   9.348  -0.941
   26    HD2  PHE   5           1HD      PHE   5   4.150   7.504   2.007
   27    HE1  PHE   5           2HE      PHE   5   7.908  10.451   0.828
   28    HE2  PHE   5           1HE      PHE   5   5.452   8.604   3.782
   29    HZ   PHE   5           HZ       PHE   5   7.334  10.079   3.194
   30    H    THR   6           H        THR   6   1.250   8.827  -2.165
   31    HA   THR   6           HA       THR   6  -0.233   7.965  -3.661
   32    HB   THR   6           HB       THR   6   1.643   6.794  -5.552
   33    HG1  THR   6           1HG      THR   6   2.075   9.445  -4.667
   34   HG21  THR   6          3HG2      THR   6  -0.132   7.428  -6.742
   35   HG22  THR   6          1HG2      THR   6   0.633   9.018  -6.738
   36   HG23  THR   6          2HG2      THR   6  -0.619   8.640  -5.554
   37    H    CYS   7           H        CYS   7  -1.390   6.231  -3.066
   38    HA   CYS   7           HA       CYS   7  -0.080   3.674  -2.538
   39    HB2  CYS   7           2HB      CYS   7  -1.731   4.097  -0.862
   40    HB3  CYS   7           1HB      CYS   7  -2.938   4.630  -2.024
   41    H    CYS   8           H        CYS   8  -0.723   5.093  -5.289
   42    HA   CYS   8           HA       CYS   8  -1.426   4.427  -7.366
   43    HB2  CYS   8           2HB      CYS   8   0.335   2.806  -7.144
   44    HB3  CYS   8           1HB      CYS   8  -0.634   1.790  -6.088
   45    HG   CYS   8           HG       CYS   8  -0.578   0.774  -8.506
   46    H    VAL   9           H        VAL   9  -3.166   4.766  -5.149
   47    HA   VAL   9           HA       VAL   9  -5.253   2.850  -5.061
   48    HB   VAL   9           HB       VAL   9  -4.933   4.112  -3.107
   49   HG11  VAL   9          1HG1      VAL   9  -4.391   6.284  -4.978
   50   HG12  VAL   9          2HG1      VAL   9  -3.694   5.933  -3.397
   51   HG13  VAL   9          3HG1      VAL   9  -5.239   6.775  -3.514
   52   HG21  VAL   9          3HG2      VAL   9  -6.968   5.001  -2.570
   53   HG22  VAL   9          1HG2      VAL   9  -7.398   4.102  -4.034
   54   HG23  VAL   9          2HG2      VAL   9  -7.132   5.841  -4.119
   55    HA   PRO  10           HA       PRO  10  -7.108   4.676  -8.775
   56    HB2  PRO  10           2HB      PRO  10  -8.171   2.445  -9.758
   57    HB3  PRO  10           1HB      PRO  10  -6.423   2.702  -9.824
   58    HG2  PRO  10           2HG      PRO  10  -8.020   1.018  -7.941
   59    HG3  PRO  10           1HG      PRO  10  -6.461   0.668  -8.710
   60    HD2  PRO  10           2HD      PRO  10  -6.794   1.624  -6.118
   61    HD3  PRO  10           1HD      PRO  10  -5.303   1.723  -7.064
   62    H    GLY  11           H        GLY  11  -8.411   2.844  -6.141
   63    HA2  GLY  11           2HA      GLY  11 -10.774   4.422  -6.095
   64    HA3  GLY  11           1HA      GLY  11 -11.100   2.797  -6.664
   65    H    CYS  12           H        CYS  12  -8.521   2.781  -4.356
   66    HA   CYS  12           HA       CYS  12 -10.228   1.406  -2.581
   67    HB2  CYS  12           2HB      CYS  12  -8.121   1.985  -0.921
   68    HB3  CYS  12           1HB      CYS  12  -8.285   0.559  -1.905
   69    H    TYR  13           H        TYR  13  -9.019   2.870  -0.088
   70    HA   TYR  13           HA       TYR  13 -11.283   4.662   0.108
   71    HB2  TYR  13           2HB      TYR  13 -10.814   2.895   1.807
   72    HB3  TYR  13           1HB      TYR  13  -9.406   3.827   2.281
   73    HD1  TYR  13           1HD      TYR  13 -11.879   6.119   1.339
   74    HD2  TYR  13           2HD      TYR  13 -10.849   3.465   4.501
   75    HE1  TYR  13           1HE      TYR  13 -13.276   7.425   2.880
   76    HE2  TYR  13           2HE      TYR  13 -12.246   4.764   6.051
   77    HH   TYR  13           HH       TYR  13 -14.074   6.308   6.031
   78    H    ASN  14           H        ASN  14  -7.878   4.724   0.850
   79    HA   ASN  14           HA       ASN  14  -7.876   7.647   0.712
   80    HB2  ASN  14           2HB      ASN  14  -5.717   6.705   2.255
   81    HB3  ASN  14           1HB      ASN  14  -7.047   7.713   2.759
   82   HD21  ASN  14          1HD2      ASN  14  -9.165   6.303   2.901
   83   HD22  ASN  14          2HD2      ASN  14  -9.004   4.872   3.856
   84    H    ASN  15           H        ASN  15  -5.704   8.667  -0.006
   85    HA   ASN  15           HA       ASN  15  -4.393   6.755  -1.787
   86    HB2  ASN  15           2HB      ASN  15  -5.458   8.668  -2.926
   87    HB3  ASN  15           1HB      ASN  15  -4.474   9.779  -1.980
   88   HD21  ASN  15          1HD2      ASN  15  -4.772   8.563  -4.928
   89   HD22  ASN  15          2HD2      ASN  15  -3.123   8.545  -5.446
   90    H    SER  16           H        SER  16  -1.830   6.865  -1.832
   91    HA   SER  16           HA       SER  16  -0.801   7.349   0.725
   92    HB2  SER  16           2HB      SER  16   0.232   5.528  -0.430
   93    HB3  SER  16           1HB      SER  16   0.309   6.427  -1.913
   94    HG   SER  16           HG       SER  16   1.914   6.727   0.387
   95    H    HIS  17           H        HIS  17  -0.973   9.342  -2.207
   96    HA   HIS  17           HA       HIS  17   0.450  11.450  -0.761
   97    HB2  HIS  17           2HB      HIS  17   2.090  10.557  -2.280
   98    HB3  HIS  17           1HB      HIS  17   0.988  10.633  -3.629
   99    HD1  HIS  17           1HD      HIS  17   3.216  12.018  -4.521
  100    HD2  HIS  17           2HD      HIS  17   0.724  13.900  -1.781
  101    HE1  HIS  17           1HE      HIS  17   3.744  14.469  -4.706
  102    HE2  HIS  17           2HE      HIS  17   2.151  15.597  -3.111
  103    H    ARG  18           H        ARG  18  -2.198  11.609  -0.645
  104    HA   ARG  18           HA       ARG  18  -2.793  13.970  -2.131
  105    HB2  ARG  18           2HB      ARG  18  -3.209  12.195  -3.834
  106    HB3  ARG  18           1HB      ARG  18  -4.460  11.541  -2.788
  107    HG2  ARG  18           2HG      ARG  18  -5.796  13.488  -3.029
  108    HG3  ARG  18           1HG      ARG  18  -4.490  14.358  -3.836
  109    HD2  ARG  18           2HD      ARG  18  -4.649  12.339  -5.522
  110    HD3  ARG  18           1HD      ARG  18  -6.286  12.222  -4.877
  111    HE   ARG  18           HE       ARG  18  -5.255  14.247  -6.632
  112   HH11  ARG  18          1HH1      ARG  18  -7.676  13.523  -4.226
  113   HH12  ARG  18          2HH1      ARG  18  -8.773  14.741  -4.783
  114   HH21  ARG  18          1HH2      ARG  18  -6.696  15.849  -7.365
  115   HH22  ARG  18          2HH2      ARG  18  -8.218  16.061  -6.565
  116    H    ASP  19           H        ASP  19  -2.990  12.370   0.597
  117    HA   ASP  19           HA       ASP  19  -5.153  13.928   1.639
  118    HB2  ASP  19           2HB      ASP  19  -5.526  10.979   1.980
  119    HB3  ASP  19           1HB      ASP  19  -6.663  12.281   2.280
  120    H    LYS  20           H        LYS  20  -3.751  10.854   2.644
  121    HA   LYS  20           HA       LYS  20  -2.504  10.261   4.439
  122    HB2  LYS  20           2HB      LYS  20  -1.801  13.192   4.562
  123    HB3  LYS  20           1HB      LYS  20  -0.979  11.905   5.432
  124    HG2  LYS  20           2HG      LYS  20   0.132  11.177   3.601
  125    HG3  LYS  20           1HG      LYS  20  -1.174  11.614   2.499
  126    HD2  LYS  20           2HD      LYS  20   0.829  13.003   2.171
  127    HD3  LYS  20           1HD      LYS  20  -0.571  13.957   2.665
  128    HE2  LYS  20           2HE      LYS  20   1.144  12.957   4.847
  129    HE3  LYS  20           1HE      LYS  20   1.872  14.167   3.793
  130    HZ1  LYS  20           3HZ      LYS  20  -0.076  14.506   5.827
  131    HZ2  LYS  20           1HZ      LYS  20  -0.661  15.095   4.352
  132    HZ3  LYS  20           2HZ      LYS  20   0.796  15.680   4.978
  133    H    ALA  21           H        ALA  21  -5.328  11.674   4.659
  134    HA   ALA  21           HA       ALA  21  -5.198  12.083   7.576
  135    HB1  ALA  21           1HB      ALA  21  -6.787  13.669   7.415
  136    HB2  ALA  21           2HB      ALA  21  -7.667  12.815   6.147
  137    HB3  ALA  21           3HB      ALA  21  -6.230  13.753   5.744
  138    H    LEU  22           H        LEU  22  -5.589   9.441   5.890
  139    HA   LEU  22           HA       LEU  22  -7.963   8.580   7.388
  140    HB2  LEU  22           2HB      LEU  22  -7.120   7.629   4.629
  141    HB3  LEU  22           1HB      LEU  22  -8.521   7.027   5.531
  142    HG   LEU  22           HG       LEU  22  -9.159   8.583   3.798
  143   HD11  LEU  22          1HD1      LEU  22 -10.128  10.353   5.601
  144   HD12  LEU  22          2HD1      LEU  22  -9.716   8.993   6.646
  145   HD13  LEU  22          3HD1      LEU  22 -10.818   8.759   5.290
  146   HD21  LEU  22          3HD2      LEU  22  -8.170  10.953   5.176
  147   HD22  LEU  22          1HD2      LEU  22  -8.305  10.583   3.463
  148   HD23  LEU  22          2HD2      LEU  22  -6.928   9.978   4.387
  149    H    HIS  23           H        HIS  23  -6.533   5.599   6.182
  150    HA   HIS  23           HA       HIS  23  -4.916   5.492   8.598
  151    HB2  HIS  23           2HB      HIS  23  -7.289   4.138   8.140
  152    HB3  HIS  23           1HB      HIS  23  -6.066   2.939   7.737
  153    HD1  HIS  23           1HD      HIS  23  -4.408   2.257   9.681
  154    HD2  HIS  23           2HD      HIS  23  -7.604   4.648  10.835
  155    HE1  HIS  23           1HE      HIS  23  -4.502   2.088  12.188
  156    HE2  HIS  23           2HE      HIS  23  -6.391   3.608  12.869
  157    H    PHE  24           H        PHE  24  -2.867   4.197   8.363
  158    HA   PHE  24           HA       PHE  24  -2.455   3.210   5.648
  159    HB2  PHE  24           2HB      PHE  24  -0.509   4.830   7.270
  160    HB3  PHE  24           1HB      PHE  24  -0.121   4.032   5.756
  161    HD1  PHE  24           2HD      PHE  24  -2.208   6.667   7.286
  162    HD2  PHE  24           1HD      PHE  24  -0.705   5.013   3.661
  163    HE1  PHE  24           2HE      PHE  24  -3.004   8.638   6.043
  164    HE2  PHE  24           1HE      PHE  24  -1.491   6.971   2.430
  165    HZ   PHE  24           HZ       PHE  24  -2.642   8.782   3.608
  166    H    TYR  25           H        TYR  25  -1.605   1.007   5.575
  167    HA   TYR  25           HA       TYR  25  -0.881  -0.168   8.115
  168    HB2  TYR  25           2HB      TYR  25  -1.129  -1.380   5.342
  169    HB3  TYR  25           1HB      TYR  25  -0.644  -2.290   6.765
  170    HD1  TYR  25           1HD      TYR  25  -3.358   0.188   6.049
  171    HD2  TYR  25           2HD      TYR  25  -2.320  -3.663   7.529
  172    HE1  TYR  25           1HE      TYR  25  -5.713  -0.232   6.603
  173    HE2  TYR  25           2HE      TYR  25  -4.678  -4.093   8.078
  174    HH   TYR  25           HH       TYR  25  -7.182  -2.409   6.873
  175    H    THR  26           H        THR  26   1.307  -1.313   8.382
  176    HA   THR  26           HA       THR  26   3.311   0.156   6.823
  177    HB   THR  26           HB       THR  26   4.465   0.480   8.730
  178    HG1  THR  26           1HG      THR  26   5.507  -1.233   9.294
  179   HG21  THR  26          3HG2      THR  26   2.237   0.844   9.658
  180   HG22  THR  26          1HG2      THR  26   3.363   0.222  10.864
  181   HG23  THR  26          2HG2      THR  26   2.167  -0.852  10.140
  182    H    PHE  27           H        PHE  27   5.549  -1.065   6.811
  183    HA   PHE  27           HA       PHE  27   5.069  -3.327   5.185
  184    HB2  PHE  27           2HB      PHE  27   6.865  -1.260   5.375
  185    HB3  PHE  27           1HB      PHE  27   7.829  -2.705   5.466
  186    HD1  PHE  27           2HD      PHE  27   4.842  -3.166   3.627
  187    HD2  PHE  27           1HD      PHE  27   8.800  -1.653   3.321
  188    HE1  PHE  27           2HE      PHE  27   4.708  -3.338   1.206
  189    HE2  PHE  27           1HE      PHE  27   8.689  -1.843   0.884
  190    HZ   PHE  27           HZ       PHE  27   6.619  -2.670  -0.195
  191    HA   PRO  28           HA       PRO  28   6.006  -6.765   8.084
  192    HB2  PRO  28           2HB      PRO  28   7.086  -7.629   5.372
  193    HB3  PRO  28           1HB      PRO  28   6.363  -8.673   6.598
  194    HG2  PRO  28           2HG      PRO  28   4.813  -7.877   4.737
  195    HG3  PRO  28           1HG      PRO  28   4.260  -7.556   6.386
  196    HD2  PRO  28           2HD      PRO  28   5.441  -5.664   4.400
  197    HD3  PRO  28           1HD      PRO  28   4.128  -5.429   5.546
  198    H    LYS  29           H        LYS  29   8.047  -8.136   8.604
  199    HA   LYS  29           HA       LYS  29  10.315  -6.394   8.873
  200    HB2  LYS  29           2HB      LYS  29  11.308  -8.557   9.893
  201    HB3  LYS  29           1HB      LYS  29  10.022  -7.725  10.754
  202    HG2  LYS  29           2HG      LYS  29   8.995  -9.706   8.905
  203    HG3  LYS  29           1HG      LYS  29  10.117 -10.406  10.068
  204    HD2  LYS  29           2HD      LYS  29   8.256  -8.540  11.301
  205    HD3  LYS  29           1HD      LYS  29   7.436  -9.878  10.494
  206    HE2  LYS  29           2HE      LYS  29   8.658 -11.488  11.770
  207    HE3  LYS  29           1HE      LYS  29   9.708 -10.240  12.438
  208    HZ1  LYS  29           3HZ      LYS  29   7.390  -9.310  13.248
  209    HZ2  LYS  29           1HZ      LYS  29   8.254 -10.455  14.145
  210    HZ3  LYS  29           2HZ      LYS  29   6.968 -10.947  13.161
  211    H    ASP  30           H        ASP  30   9.419  -9.078   6.887
  212    HA   ASP  30           HA       ASP  30  12.075  -9.561   5.859
  213    HB2  ASP  30           2HB      ASP  30   9.977 -10.635   4.191
  214    HB3  ASP  30           1HB      ASP  30  11.147 -11.523   5.157
  215    H    ALA  31           H        ALA  31  13.013  -8.154   4.442
  216    HA   ALA  31           HA       ALA  31  11.866  -6.045   3.233
  217    HB1  ALA  31           1HB      ALA  31  14.312  -7.617   2.622
  218    HB2  ALA  31           2HB      ALA  31  14.127  -5.966   3.202
  219    HB3  ALA  31           3HB      ALA  31  13.822  -6.334   1.512
  220    H    GLU  32           H        GLU  32  12.409  -9.127   1.360
  221    HA   GLU  32           HA       GLU  32  11.090  -8.207  -0.936
  222    HB2  GLU  32           2HB      GLU  32  12.370 -10.159  -1.136
  223    HB3  GLU  32           1HB      GLU  32  11.574 -11.005   0.128
  224    HG2  GLU  32           2HG      GLU  32  10.133 -10.213  -2.378
  225    HG3  GLU  32           1HG      GLU  32  11.102 -11.683  -2.292
  226    H    LEU  33           H        LEU  33   9.466 -10.374   1.538
  227    HA   LEU  33           HA       LEU  33   7.050 -10.405   0.383
  228    HB2  LEU  33           2HB      LEU  33   7.672 -11.146   2.772
  229    HB3  LEU  33           1HB      LEU  33   7.323  -9.519   3.257
  230    HG   LEU  33           HG       LEU  33   5.163  -9.920   3.381
  231   HD11  LEU  33          1HD1      LEU  33   5.408 -11.185   0.663
  232   HD12  LEU  33          2HD1      LEU  33   4.699  -9.628   1.078
  233   HD13  LEU  33          3HD1      LEU  33   3.887 -11.121   1.548
  234   HD21  LEU  33          3HD2      LEU  33   5.661 -11.890   4.440
  235   HD22  LEU  33          1HD2      LEU  33   6.206 -12.666   2.954
  236   HD23  LEU  33          2HD2      LEU  33   4.489 -12.380   3.219
  237    H    ARG  34           H        ARG  34   8.570  -7.664   1.913
  238    HA   ARG  34           HA       ARG  34   6.220  -6.023   1.636
  239    HB2  ARG  34           2HB      ARG  34   8.163  -4.174   1.955
  240    HB3  ARG  34           1HB      ARG  34   7.289  -4.949   3.257
  241    HG2  ARG  34           2HG      ARG  34   9.090  -6.096   3.947
  242    HG3  ARG  34           1HG      ARG  34   9.682  -6.308   2.313
  243    HD2  ARG  34           2HD      ARG  34  11.050  -4.575   2.475
  244    HD3  ARG  34           1HD      ARG  34   9.738  -3.534   3.005
  245    HE   ARG  34           HE       ARG  34  10.753  -5.250   5.075
  246   HH11  ARG  34          1HH1      ARG  34  11.150  -2.196   3.433
  247   HH12  ARG  34          2HH1      ARG  34  11.938  -1.433   4.774
  248   HH21  ARG  34          1HH2      ARG  34  11.787  -4.246   6.844
  249   HH22  ARG  34          2HH2      ARG  34  12.299  -2.597   6.709
  250    H    ARG  35           H        ARG  35   9.275  -6.232  -0.094
  251    HA   ARG  35           HA       ARG  35   8.672  -4.213  -1.887
  252    HB2  ARG  35           2HB      ARG  35  10.377  -4.953  -3.263
  253    HB3  ARG  35           1HB      ARG  35  10.879  -5.584  -1.708
  254    HG2  ARG  35           2HG      ARG  35  11.290  -7.237  -3.357
  255    HG3  ARG  35           1HG      ARG  35   9.932  -7.799  -2.400
  256    HD2  ARG  35           2HD      ARG  35   8.600  -7.854  -4.193
  257    HD3  ARG  35           1HD      ARG  35   9.057  -6.218  -4.658
  258    HE   ARG  35           HE       ARG  35  10.870  -7.121  -5.911
  259   HH11  ARG  35          1HH1      ARG  35   8.682  -9.546  -4.657
  260   HH12  ARG  35          2HH1      ARG  35   9.183 -10.751  -5.790
  261   HH21  ARG  35          1HH2      ARG  35  11.521  -8.712  -7.394
  262   HH22  ARG  35          2HH2      ARG  35  10.790 -10.282  -7.342
  263    H    LEU  36           H        LEU  36   7.435  -7.533  -1.599
  264    HA   LEU  36           HA       LEU  36   6.142  -7.504  -4.175
  265    HB2  LEU  36           2HB      LEU  36   5.757  -9.029  -1.636
  266    HB3  LEU  36           1HB      LEU  36   4.496  -9.064  -2.846
  267    HG   LEU  36           HG       LEU  36   7.346  -9.949  -3.237
  268   HD11  LEU  36          1HD1      LEU  36   6.575 -12.142  -3.187
  269   HD12  LEU  36          2HD1      LEU  36   4.892 -11.658  -3.404
  270   HD13  LEU  36          3HD1      LEU  36   5.701 -11.369  -1.863
  271   HD21  LEU  36          3HD2      LEU  36   5.016  -9.777  -5.132
  272   HD22  LEU  36          1HD2      LEU  36   6.416 -10.811  -5.421
  273   HD23  LEU  36          2HD2      LEU  36   6.621  -9.062  -5.306
  274    H    TRP  37           H        TRP  37   5.082  -6.514  -0.982
  275    HA   TRP  37           HA       TRP  37   2.528  -5.644  -1.725
  276    HB2  TRP  37           2HB      TRP  37   4.506  -4.839   0.394
  277    HB3  TRP  37           1HB      TRP  37   2.985  -3.970   0.207
  278    HD1  TRP  37           HD       TRP  37   3.218  -7.742  -0.315
  279    HE1  TRP  37           1HE      TRP  37   1.827  -8.879   1.594
  280    HE3  TRP  37           3HE      TRP  37   2.177  -3.632   2.460
  281    HZ2  TRP  37           2HZ      TRP  37   0.450  -8.042   3.981
  282    HZ3  TRP  37           3HZ      TRP  37   0.846  -3.817   4.487
  283    HH2  TRP  37           HH       TRP  37  -0.004  -5.967   5.246
  284    H    LEU  38           H        LEU  38   5.779  -4.029  -1.839
  285    HA   LEU  38           HA       LEU  38   5.193  -1.436  -2.363
  286    HB2  LEU  38           2HB      LEU  38   7.168  -3.256  -3.762
  287    HB3  LEU  38           1HB      LEU  38   7.035  -1.579  -4.157
  288    HG   LEU  38           HG       LEU  38   7.833  -2.750  -1.519
  289   HD11  LEU  38          1HD1      LEU  38   9.271  -1.051  -3.544
  290   HD12  LEU  38          2HD1      LEU  38   9.615  -2.730  -3.125
  291   HD13  LEU  38          3HD1      LEU  38   9.895  -1.451  -1.944
  292   HD21  LEU  38          3HD2      LEU  38   8.137  -0.363  -0.826
  293   HD22  LEU  38          1HD2      LEU  38   6.459  -0.880  -0.991
  294   HD23  LEU  38          2HD2      LEU  38   7.207   0.100  -2.252
  295    H    LYS  39           H        LYS  39   5.095  -4.182  -4.755
  296    HA   LYS  39           HA       LYS  39   4.196  -2.926  -6.957
  297    HB2  LYS  39           2HB      LYS  39   4.046  -5.620  -5.773
  298    HB3  LYS  39           1HB      LYS  39   2.907  -5.323  -7.063
  299    HG2  LYS  39           2HG      LYS  39   5.110  -6.368  -7.660
  300    HG3  LYS  39           1HG      LYS  39   4.651  -4.946  -8.610
  301    HD2  LYS  39           2HD      LYS  39   6.052  -3.629  -6.888
  302    HD3  LYS  39           1HD      LYS  39   6.710  -5.200  -6.435
  303    HE2  LYS  39           2HE      LYS  39   6.679  -4.298  -9.294
  304    HE3  LYS  39           1HE      LYS  39   7.965  -3.799  -8.194
  305    HZ1  LYS  39           3HZ      LYS  39   7.852  -6.452  -7.770
  306    HZ2  LYS  39           1HZ      LYS  39   8.925  -5.696  -8.838
  307    HZ3  LYS  39           2HZ      LYS  39   7.486  -6.367  -9.418
  308    H    ASN  40           H        ASN  40   1.958  -4.476  -4.654
  309    HA   ASN  40           HA       ASN  40  -0.373  -3.643  -5.866
  310    HB2  ASN  40           2HB      ASN  40  -0.758  -3.776  -3.003
  311    HB3  ASN  40           1HB      ASN  40  -1.367  -4.830  -4.264
  312   HD21  ASN  40          1HD2      ASN  40  -0.841  -5.938  -1.922
  313   HD22  ASN  40          2HD2      ASN  40   0.600  -6.885  -1.973
  314    H    VAL  41           H        VAL  41   1.532  -1.949  -3.461
  315    HA   VAL  41           HA       VAL  41  -0.521   0.014  -3.144
  316    HB   VAL  41           HB       VAL  41   1.283  -0.726  -1.383
  317   HG11  VAL  41          1HG1      VAL  41   2.422   1.862  -2.419
  318   HG12  VAL  41          2HG1      VAL  41   3.150   0.290  -2.723
  319   HG13  VAL  41          3HG1      VAL  41   3.021   0.889  -1.074
  320   HG21  VAL  41          3HG2      VAL  41  -0.502   0.509  -0.620
  321   HG22  VAL  41          1HG2      VAL  41  -0.243   1.795  -1.796
  322   HG23  VAL  41          2HG2      VAL  41   0.811   1.663  -0.394
  323    H    SER  42           H        SER  42   2.211  -0.160  -5.316
  324    HA   SER  42           HA       SER  42   1.594   1.807  -6.959
  325    HB2  SER  42           2HB      SER  42   1.151   3.692  -5.695
  326    HB3  SER  42           1HB      SER  42   2.138   3.165  -4.310
  327    HG   SER  42           HG       SER  42   2.848   5.040  -5.707
  328    H    ARG  43           H        ARG  43   4.673   2.818  -5.282
  329    HA   ARG  43           HA       ARG  43   6.812   2.482  -5.877
  330    HB2  ARG  43           2HB      ARG  43   6.665   0.191  -5.446
  331    HB3  ARG  43           1HB      ARG  43   5.637  -0.119  -6.831
  332    HG2  ARG  43           2HG      ARG  43   7.750  -1.021  -7.347
  333    HG3  ARG  43           1HG      ARG  43   7.619   0.470  -8.282
  334    HD2  ARG  43           2HD      ARG  43   8.960   1.648  -6.638
  335    HD3  ARG  43           1HD      ARG  43   9.033   0.203  -5.631
  336    HE   ARG  43           HE       ARG  43  10.652  -0.654  -7.018
  337   HH11  ARG  43          1HH1      ARG  43   9.197   2.134  -8.533
  338   HH12  ARG  43          2HH1      ARG  43  10.388   2.230  -9.785
  339   HH21  ARG  43          1HH2      ARG  43  12.217  -0.529  -8.667
  340   HH22  ARG  43          2HH2      ARG  43  12.101   0.718  -9.863
  341    H    ALA  44           H        ALA  44   4.746   1.530  -8.663
  342    HA   ALA  44           HA       ALA  44   6.598   2.503 -10.603
  343    HB1  ALA  44           1HB      ALA  44   4.794   0.683 -10.846
  344    HB2  ALA  44           2HB      ALA  44   5.048   1.785 -12.202
  345    HB3  ALA  44           3HB      ALA  44   3.674   2.021 -11.119
  346    H    GLY  45           H        GLY  45   6.778   4.851  -9.484
  347    HA2  GLY  45           2HA      GLY  45   4.673   6.609  -9.369
  348    HA3  GLY  45           1HA      GLY  45   6.321   7.081  -9.715
  349    H    VAL  46           H        VAL  46   6.745   6.044 -12.174
  350    HA   VAL  46           HA       VAL  46   6.518   6.588 -14.388
  351    HB   VAL  46           HB       VAL  46   3.564   6.717 -14.279
  352   HG11  VAL  46          1HG1      VAL  46   5.452   5.072 -15.948
  353   HG12  VAL  46          2HG1      VAL  46   4.871   6.685 -16.364
  354   HG13  VAL  46          3HG1      VAL  46   3.734   5.342 -16.243
  355   HG21  VAL  46          3HG2      VAL  46   3.368   4.997 -12.870
  356   HG22  VAL  46          1HG2      VAL  46   5.056   4.518 -13.045
  357   HG23  VAL  46          2HG2      VAL  46   3.870   4.022 -14.252
  358    H    SER  47           H        SER  47   6.560   8.774 -12.420
  359    HA   SER  47           HA       SER  47   5.798  10.894 -14.230
  360    HB2  SER  47           2HB      SER  47   3.960  11.766 -13.110
  361    HB3  SER  47           1HB      SER  47   3.696  10.033 -12.876
  362    HG   SER  47           HG       SER  47   4.733  11.916 -11.027
  363    H    GLY  48           H        GLY  48   6.352  10.402 -10.548
  364    HA2  GLY  48           2HA      GLY  48   7.567  12.800 -10.041
  365    HA3  GLY  48           1HA      GLY  48   8.029  11.295  -9.258
  366    H    CYS  49           H        CYS  49   9.457  13.793 -10.437
  367    HA   CYS  49           HA       CYS  49  11.423  12.326 -12.062
  368    HB2  CYS  49           2HB      CYS  49  11.145  15.325 -11.899
  369    HB3  CYS  49           1HB      CYS  49  12.029  14.384 -13.096
  370    HG   CYS  49           HG       CYS  49   8.994  14.889 -13.092
  371    H    PHE  50           H        PHE  50  10.930  13.837  -9.045
  372    HA   PHE  50           HA       PHE  50  13.828  14.182  -8.625
  373    HB2  PHE  50           2HB      PHE  50  11.375  15.227  -7.206
  374    HB3  PHE  50           1HB      PHE  50  12.943  15.223  -6.405
  375    HD1  PHE  50           1HD      PHE  50  14.779  15.925  -8.537
  376    HD2  PHE  50           2HD      PHE  50  10.884  17.422  -7.705
  377    HE1  PHE  50           1HE      PHE  50  15.358  18.039  -9.657
  378    HE2  PHE  50           2HE      PHE  50  11.455  19.538  -8.825
  379    HZ   PHE  50           HZ       PHE  50  13.693  19.848  -9.803
  380    H    SER  51           H        SER  51  10.975  12.870  -6.685
  381    HA   SER  51           HA       SER  51  12.875  10.856  -5.660
  382    HB2  SER  51           2HB      SER  51  11.024  10.903  -3.711
  383    HB3  SER  51           1HB      SER  51  12.440  11.952  -3.708
  384    HG   SER  51           HG       SER  51   9.768  12.560  -4.268
  385    H    THR  52           H        THR  52   9.637  11.487  -6.858
  386    HA   THR  52           HA       THR  52   7.974  10.109  -7.584
  387    HB   THR  52           HB       THR  52   8.593   8.223  -8.815
  388    HG1  THR  52           1HG      THR  52  10.469   7.003  -8.318
  389   HG21  THR  52          3HG2      THR  52  11.363   9.097  -8.926
  390   HG22  THR  52          1HG2      THR  52  10.207  10.417  -9.089
  391   HG23  THR  52          2HG2      THR  52  10.134   9.042 -10.190
  392    H    PHE  53           H        PHE  53   8.311  10.351  -4.811
  393    HA   PHE  53           HA       PHE  53   7.815   9.419  -2.802
  394    HB2  PHE  53           2HB      PHE  53   5.821   8.005  -2.766
  395    HB3  PHE  53           1HB      PHE  53   5.585   9.364  -3.860
  396    HD1  PHE  53           2HD      PHE  53   6.716   5.801  -3.905
  397    HD2  PHE  53           1HD      PHE  53   4.679   8.938  -5.928
  398    HE1  PHE  53           2HE      PHE  53   6.059   4.227  -5.655
  399    HE2  PHE  53           1HE      PHE  53   4.009   7.357  -7.692
  400    HZ   PHE  53           HZ       PHE  53   4.696   4.991  -7.548
  401    H    GLN  54           H        GLN  54   9.988   8.089  -4.405
  402    HA   GLN  54           HA       GLN  54  10.372   5.524  -4.537
  403    HB2  GLN  54           2HB      GLN  54  12.022   7.673  -3.604
  404    HB3  GLN  54           1HB      GLN  54  12.426   6.209  -2.719
  405    HG2  GLN  54           2HG      GLN  54  12.215   5.389  -5.363
  406    HG3  GLN  54           1HG      GLN  54  13.027   6.952  -5.442
  407   HE21  GLN  54          1HE2      GLN  54  13.286   3.649  -4.596
  408   HE22  GLN  54          2HE2      GLN  54  14.936   3.673  -4.086
  409    HA   PRO  55           HA       PRO  55   8.869   3.456  -0.904
  410    HB2  PRO  55           2HB      PRO  55  10.454   1.121  -1.522
  411    HB3  PRO  55           1HB      PRO  55   8.713   1.350  -1.651
  412    HG2  PRO  55           2HG      PRO  55  10.411   1.095  -3.802
  413    HG3  PRO  55           1HG      PRO  55   8.809   1.848  -3.859
  414    HD2  PRO  55           2HD      PRO  55  11.497   3.110  -3.828
  415    HD3  PRO  55           1HD      PRO  55   9.987   3.670  -4.574
  416    H    THR  56           H        THR  56  12.187   4.064  -1.527
  417    HA   THR  56           HA       THR  56  13.528   2.817   0.555
  418    HB   THR  56           HB       THR  56  15.101   4.696   0.471
  419    HG1  THR  56           1HG      THR  56  12.970   6.010  -0.818
  420   HG21  THR  56          3HG2      THR  56  15.660   3.502  -1.358
  421   HG22  THR  56          1HG2      THR  56  15.128   4.977  -2.168
  422   HG23  THR  56          2HG2      THR  56  14.041   3.594  -2.053
  423    H    THR  57           H        THR  57  11.592   5.919   0.635
  424    HA   THR  57           HA       THR  57  12.113   6.553   3.309
  425    HB   THR  57           HB       THR  57  11.125   8.184   1.859
  426    HG1  THR  57           1HG      THR  57  10.415   8.576   3.874
  427   HG21  THR  57          3HG2      THR  57   9.283   6.051   1.166
  428   HG22  THR  57          1HG2      THR  57   9.718   7.510   0.278
  429   HG23  THR  57          2HG2      THR  57   8.469   7.573   1.521
  430    H    GLY  58           H        GLY  58  10.133   4.071   1.935
  431    HA2  GLY  58           2HA      GLY  58   9.517   2.267   3.516
  432    HA3  GLY  58           1HA      GLY  58   9.068   3.533   4.630
  433    H    HIS  59           H        HIS  59   7.895   1.843   1.624
  434    HA   HIS  59           HA       HIS  59   5.577   3.532   1.579
  435    HB2  HIS  59           2HB      HIS  59   6.733   1.524  -0.159
  436    HB3  HIS  59           1HB      HIS  59   5.001   1.275   0.026
  437    HD1  HIS  59           1HD      HIS  59   6.865   4.566  -0.171
  438    HD2  HIS  59           2HD      HIS  59   4.041   2.392  -2.319
  439    HE1  HIS  59           1HE      HIS  59   6.104   6.075  -2.029
  440    HE2  HIS  59           2HE      HIS  59   4.353   4.765  -3.263
  441    H    ARG  60           H        ARG  60   3.668   3.205   2.324
  442    HA   ARG  60           HA       ARG  60   3.097   0.852   4.040
  443    HB2  ARG  60           2HB      ARG  60   1.738   2.376   5.362
  444    HB3  ARG  60           1HB      ARG  60   3.325   3.080   5.153
  445    HG2  ARG  60           2HG      ARG  60   1.575   3.938   3.039
  446    HG3  ARG  60           1HG      ARG  60   0.879   4.291   4.616
  447    HD2  ARG  60           2HD      ARG  60   3.734   4.948   4.010
  448    HD3  ARG  60           1HD      ARG  60   2.432   6.035   3.529
  449    HE   ARG  60           HE       ARG  60   2.362   5.257   6.303
  450   HH11  ARG  60          1HH1      ARG  60   3.613   7.549   3.988
  451   HH12  ARG  60          2HH1      ARG  60   3.865   8.792   5.167
  452   HH21  ARG  60          1HH2      ARG  60   2.695   6.891   7.855
  453   HH22  ARG  60          2HH2      ARG  60   3.345   8.418   7.362
  454    H    LEU  61           H        LEU  61   0.511   0.449   4.041
  455    HA   LEU  61           HA       LEU  61  -0.432   0.922   1.285
  456    HB2  LEU  61           2HB      LEU  61  -0.890  -1.426   3.130
  457    HB3  LEU  61           1HB      LEU  61  -1.911  -1.152   1.741
  458    HG   LEU  61           HG       LEU  61   0.365  -2.663   1.790
  459   HD11  LEU  61          1HD1      LEU  61  -1.378  -2.910   0.161
  460   HD12  LEU  61          2HD1      LEU  61   0.188  -2.769  -0.629
  461   HD13  LEU  61          3HD1      LEU  61  -0.904  -1.390  -0.602
  462   HD21  LEU  61          3HD2      LEU  61   1.938  -1.488   0.278
  463   HD22  LEU  61          1HD2      LEU  61   1.838  -0.782   1.892
  464   HD23  LEU  61          2HD2      LEU  61   1.014  -0.021   0.546
  465    H    CYS  62           H        CYS  62  -2.981   1.242   1.082
  466    HA   CYS  62           HA       CYS  62  -3.859   2.461   3.556
  467    HB2  CYS  62           2HB      CYS  62  -4.535   4.324   2.475
  468    HB3  CYS  62           1HB      CYS  62  -3.321   3.763   1.363
  469    H    SER  63           H        SER  63  -6.452   2.764   3.518
  470    HA   SER  63           HA       SER  63  -7.396   0.736   4.782
  471    HB2  SER  63           2HB      SER  63  -8.460   3.129   3.671
  472    HB3  SER  63           1HB      SER  63  -9.697   1.879   3.617
  473    HG   SER  63           HG       SER  63  -8.146   2.366   5.932
  474    H    VAL  64           H        VAL  64  -9.424   1.203   2.122
  475    HA   VAL  64           HA       VAL  64 -10.574  -1.315   2.342
  476    HB   VAL  64           HB       VAL  64 -11.768  -0.774   0.204
  477   HG11  VAL  64          1HG1      VAL  64 -12.742   1.391   1.331
  478   HG12  VAL  64          2HG1      VAL  64 -11.705   0.900   2.672
  479   HG13  VAL  64          3HG1      VAL  64 -12.960  -0.190   2.082
  480   HG21  VAL  64          3HG2      VAL  64 -11.012   1.976   0.213
  481   HG22  VAL  64          1HG2      VAL  64 -10.995   0.818  -1.113
  482   HG23  VAL  64          2HG2      VAL  64  -9.585   0.969  -0.058
  483    H    HIS  65           H        HIS  65  -7.856  -1.924   1.694
  484    HA   HIS  65           HA       HIS  65  -8.180  -3.241  -0.933
  485    HB2  HIS  65           2HB      HIS  65  -5.594  -3.415   0.518
  486    HB3  HIS  65           1HB      HIS  65  -5.915  -3.282  -1.214
  487    HD1  HIS  65           1HD      HIS  65  -7.862  -0.680  -0.112
  488    HD2  HIS  65           2HD      HIS  65  -3.779  -1.245  -0.180
  489    HE1  HIS  65           1HE      HIS  65  -6.875   1.557   0.326
  490    H    PHE  66           H        PHE  66  -6.904  -4.264   2.344
  491    HA   PHE  66           HA       PHE  66  -6.862  -6.936   1.859
  492    HB2  PHE  66           2HB      PHE  66  -7.657  -5.534   4.433
  493    HB3  PHE  66           1HB      PHE  66  -7.049  -7.183   4.316
  494    HD1  PHE  66           1HD      PHE  66  -4.749  -7.598   3.556
  495    HD2  PHE  66           2HD      PHE  66  -6.165  -3.662   4.436
  496    HE1  PHE  66           1HE      PHE  66  -2.428  -6.802   3.732
  497    HE2  PHE  66           2HE      PHE  66  -3.836  -2.873   4.599
  498    HZ   PHE  66           HZ       PHE  66  -1.972  -4.444   4.238
  499    H    GLN  67           H        GLN  67  -8.570  -8.667   2.782
  500    HA   GLN  67           HA       GLN  67 -11.209  -7.721   1.976
  501    HB2  GLN  67           2HB      GLN  67  -9.770  -9.934   1.237
  502    HB3  GLN  67           1HB      GLN  67 -10.887 -10.592   2.424
  503    HG2  GLN  67           2HG      GLN  67 -12.219 -10.799   0.627
  504    HG3  GLN  67           1HG      GLN  67 -12.597  -9.117   0.994
  505   HE21  GLN  67          1HE2      GLN  67 -13.000  -8.363  -1.005
  506   HE22  GLN  67          2HE2      GLN  67 -11.847  -8.341  -2.294
  507    H    GLY  68           H        GLY  68 -12.362  -7.038   4.150
  508    HA2  GLY  68           2HA      GLY  68 -13.049  -7.270   6.293
  509    HA3  GLY  68           1HA      GLY  68 -13.291  -8.948   5.826
  510    H    GLY  69           H        GLY  69 -12.846  -8.846   8.371
  511    HA2  GLY  69           2HA      GLY  69 -11.468  -9.192  10.146
  512    HA3  GLY  69           1HA      GLY  69 -10.781 -10.395   9.088
  513    H    ARG  70           H        ARG  70  -8.688  -9.691   7.845
  514    HA   ARG  70           HA       ARG  70  -7.443  -7.282   8.012
  515    HB2  ARG  70           2HB      ARG  70  -5.850  -7.639   9.924
  516    HB3  ARG  70           1HB      ARG  70  -7.502  -7.319  10.421
  517    HG2  ARG  70           2HG      ARG  70  -7.489  -9.167  11.632
  518    HG3  ARG  70           1HG      ARG  70  -7.244 -10.118  10.166
  519    HD2  ARG  70           2HD      ARG  70  -4.768  -9.550  10.416
  520    HD3  ARG  70           1HD      ARG  70  -5.176  -9.007  12.044
  521    HE   ARG  70           HE       ARG  70  -6.196 -11.591  11.678
  522   HH11  ARG  70          1HH1      ARG  70  -3.124  -9.959  11.961
  523   HH12  ARG  70          2HH1      ARG  70  -2.315 -11.334  12.634
  524   HH21  ARG  70          1HH2      ARG  70  -5.133 -13.400  12.564
  525   HH22  ARG  70          2HH2      ARG  70  -3.455 -13.288  12.977
  526    H    LYS  71           H        LYS  71  -7.592  -9.303   6.233
  527    HA   LYS  71           HA       LYS  71  -6.478 -10.820   4.985
  528    HB2  LYS  71           2HB      LYS  71  -5.198  -9.311   3.960
  529    HB3  LYS  71           1HB      LYS  71  -4.752  -8.520   5.458
  530    HG2  LYS  71           2HG      LYS  71  -3.385 -11.053   5.208
  531    HG3  LYS  71           1HG      LYS  71  -3.144 -10.062   3.776
  532    HD2  LYS  71           2HD      LYS  71  -1.476  -9.782   5.686
  533    HD3  LYS  71           1HD      LYS  71  -2.170  -8.318   4.993
  534    HE2  LYS  71           2HE      LYS  71  -3.900  -9.114   7.077
  535    HE3  LYS  71           1HE      LYS  71  -2.248  -9.260   7.694
  536    HZ1  LYS  71           3HZ      LYS  71  -3.681  -6.870   6.773
  537    HZ2  LYS  71           1HZ      LYS  71  -1.996  -6.920   6.625
  538    HZ3  LYS  71           2HZ      LYS  71  -2.714  -7.081   8.146
  539    H    THR  72           H        THR  72  -6.587 -12.755   5.989
  540    HA   THR  72           HA       THR  72  -4.910 -13.408   8.227
  541    HB   THR  72           HB       THR  72  -6.010 -15.574   8.178
  542    HG1  THR  72           1HG      THR  72  -7.235 -16.226   6.502
  543   HG21  THR  72          3HG2      THR  72  -7.989 -14.870   8.927
  544   HG22  THR  72          1HG2      THR  72  -8.356 -13.995   7.440
  545   HG23  THR  72          2HG2      THR  72  -7.326 -13.256   8.668
  546    H    TYR  73           H        TYR  73  -5.144 -16.101   6.157
  547    HA   TYR  73           HA       TYR  73  -2.296 -15.825   5.485
  548    HB2  TYR  73           2HB      TYR  73  -2.757 -18.494   5.235
  549    HB3  TYR  73           1HB      TYR  73  -2.147 -17.725   6.692
  550    HD1  TYR  73           2HD      TYR  73  -4.003 -16.880   8.365
  551    HD2  TYR  73           1HD      TYR  73  -4.622 -19.854   5.385
  552    HE1  TYR  73           2HE      TYR  73  -5.932 -17.736   9.628
  553    HE2  TYR  73           1HE      TYR  73  -6.552 -20.719   6.641
  554    HH   TYR  73           HH       TYR  73  -8.141 -19.997   8.305
  555    H    THR  74           H        THR  74  -5.320 -17.251   4.288
  556    HA   THR  74           HA       THR  74  -4.544 -18.064   1.788
  557    HB   THR  74           HB       THR  74  -7.011 -16.982   1.251
  558    HG1  THR  74           1HG      THR  74  -7.167 -17.775   3.948
  559   HG21  THR  74          3HG2      THR  74  -6.941 -19.207   0.820
  560   HG22  THR  74          1HG2      THR  74  -7.839 -19.240   2.337
  561   HG23  THR  74          2HG2      THR  74  -6.111 -19.589   2.329
  562    H    VAL  75           H        VAL  75  -4.992 -14.822   2.942
  563    HA   VAL  75           HA       VAL  75  -4.579 -13.703   0.257
  564    HB   VAL  75           HB       VAL  75  -6.477 -12.838   1.558
  565   HG11  VAL  75          1HG1      VAL  75  -6.403 -12.562   3.743
  566   HG12  VAL  75          2HG1      VAL  75  -5.106 -11.380   3.593
  567   HG13  VAL  75          3HG1      VAL  75  -4.722 -13.093   3.720
  568   HG21  VAL  75          3HG2      VAL  75  -4.341 -10.699   1.459
  569   HG22  VAL  75          1HG2      VAL  75  -6.083 -10.460   1.496
  570   HG23  VAL  75          2HG2      VAL  75  -5.338 -11.203   0.087
  571    H    ARG  76           H        ARG  76  -2.244 -14.026   0.018
  572    HA   ARG  76           HA       ARG  76  -0.517 -13.233   2.168
  573    HB2  ARG  76           2HB      ARG  76  -0.150 -14.976   0.201
  574    HB3  ARG  76           1HB      ARG  76   0.545 -13.575  -0.600
  575    HG2  ARG  76           2HG      ARG  76   2.287 -14.813   0.482
  576    HG3  ARG  76           1HG      ARG  76   2.070 -13.274   1.317
  577    HD2  ARG  76           2HD      ARG  76   0.759 -14.382   3.043
  578    HD3  ARG  76           1HD      ARG  76   0.917 -15.918   2.196
  579    HE   ARG  76           HE       ARG  76   3.111 -16.080   2.927
  580   HH11  ARG  76          1HH1      ARG  76   1.757 -12.987   3.832
  581   HH12  ARG  76          2HH1      ARG  76   3.037 -12.614   4.934
  582   HH21  ARG  76          1HH2      ARG  76   4.790 -15.584   4.377
  583   HH22  ARG  76          2HH2      ARG  76   4.758 -14.084   5.243
  584    H    VAL  77           H        VAL  77  -1.364 -11.807  -0.998
  585    HA   VAL  77           HA       VAL  77  -0.336  -9.260   0.041
  586    HB   VAL  77           HB       VAL  77   0.706  -8.691  -2.002
  587   HG11  VAL  77          1HG1      VAL  77   1.169 -11.595  -1.393
  588   HG12  VAL  77          2HG1      VAL  77   2.121 -10.204  -0.875
  589   HG13  VAL  77          3HG1      VAL  77   2.131 -10.701  -2.568
  590   HG21  VAL  77          3HG2      VAL  77  -1.040 -10.784  -3.173
  591   HG22  VAL  77          1HG2      VAL  77   0.498 -10.417  -3.958
  592   HG23  VAL  77          2HG2      VAL  77  -0.697  -9.143  -3.722
  593    HA   PRO  78           HA       PRO  78  -4.589  -7.992  -0.749
  594    HB2  PRO  78           2HB      PRO  78  -3.276  -5.327  -0.714
  595    HB3  PRO  78           1HB      PRO  78  -4.709  -5.884   0.150
  596    HG2  PRO  78           2HG      PRO  78  -2.468  -5.617   1.473
  597    HG3  PRO  78           1HG      PRO  78  -3.413  -7.107   1.699
  598    HD2  PRO  78           2HD      PRO  78  -0.993  -6.654  -0.025
  599    HD3  PRO  78           1HD      PRO  78  -1.321  -7.968   1.142
  600    H    THR  79           H        THR  79  -4.262  -8.819  -3.259
  601    HA   THR  79           HA       THR  79  -3.967  -6.253  -4.694
  602    HB   THR  79           HB       THR  79  -3.320  -7.424  -6.601
  603    HG1  THR  79           1HG      THR  79  -4.878  -9.613  -5.692
  604   HG21  THR  79          3HG2      THR  79  -2.110  -9.522  -6.089
  605   HG22  THR  79          1HG2      THR  79  -2.713  -9.413  -4.435
  606   HG23  THR  79          2HG2      THR  79  -1.661  -8.151  -5.076
  607    H    ILE  80           H        ILE  80  -5.724  -5.292  -4.524
  608    HA   ILE  80           HA       ILE  80  -8.239  -6.389  -5.541
  609    HB   ILE  80           HB       ILE  80  -7.754  -4.500  -3.213
  610   HG12  ILE  80          2HG1      ILE  80  -9.358  -6.286  -2.154
  611   HG13  ILE  80          1HG1      ILE  80  -8.801  -7.284  -3.490
  612   HG21  ILE  80          1HG2      ILE  80  -9.664  -3.669  -4.538
  613   HG22  ILE  80          2HG2      ILE  80 -10.132  -4.230  -2.943
  614   HG23  ILE  80          3HG2      ILE  80 -10.446  -5.237  -4.352
  615   HD11  ILE  80          3HD1      ILE  80  -6.723  -7.512  -2.628
  616   HD12  ILE  80          1HD1      ILE  80  -7.614  -7.257  -1.125
  617   HD13  ILE  80          2HD1      ILE  80  -6.739  -5.918  -1.872
  618    H    PHE  81           H        PHE  81  -9.179  -4.793  -7.155
  619    HA   PHE  81           HA       PHE  81  -9.046  -3.029  -8.614
  620    HB2  PHE  81           2HB      PHE  81  -7.711  -0.941  -7.793
  621    HB3  PHE  81           1HB      PHE  81  -9.190  -1.369  -6.948
  622    HD1  PHE  81           2HD      PHE  81  -5.477  -1.395  -6.721
  623    HD2  PHE  81           1HD      PHE  81  -9.157  -1.994  -4.655
  624    HE1  PHE  81           2HE      PHE  81  -4.260  -1.539  -4.593
  625    HE2  PHE  81           1HE      PHE  81  -7.939  -2.143  -2.528
  626    HZ   PHE  81           HZ       PHE  81  -5.483  -1.946  -2.486
  Start of MODEL   14
    1    H1   GLY   1           1HT      GLY   1   8.187  21.280  -1.493
    2    H2   GLY   1           2HT      GLY   1   6.571  20.990  -1.900
    3    H3   GLY   1           3HT      GLY   1   7.613  21.693  -3.030
    4    HA2  GLY   1           1HA      GLY   1   8.460  19.752  -3.690
    5    HA3  GLY   1           2HA      GLY   1   8.556  19.166  -2.037
    6    H    SER   2           H        SER   2   7.491  17.316  -1.871
    7    HA   SER   2           HA       SER   2   4.696  17.172  -2.429
    8    HB2  SER   2           2HB      SER   2   5.476  16.804  -4.705
    9    HB3  SER   2           1HB      SER   2   6.576  15.541  -4.154
   10    HG   SER   2           HG       SER   2   4.727  14.348  -3.496
   11    HA   PRO   3           HA       PRO   3   6.126  14.330   0.873
   12    HB2  PRO   3           2HB      PRO   3   4.293  15.010   2.708
   13    HB3  PRO   3           1HB      PRO   3   5.720  16.011   2.408
   14    HG2  PRO   3           2HG      PRO   3   2.913  16.376   1.438
   15    HG3  PRO   3           1HG      PRO   3   4.045  17.586   2.068
   16    HD2  PRO   3           2HD      PRO   3   3.578  17.170  -0.603
   17    HD3  PRO   3           1HD      PRO   3   5.091  17.833   0.046
   18    H    GLY   4           H        GLY   4   4.797  13.255  -1.271
   19    HA2  GLY   4           2HA      GLY   4   2.899  11.520   0.106
   20    HA3  GLY   4           1HA      GLY   4   2.325  12.346  -1.341
   21    H    PHE   5           H        PHE   5   2.144   9.681  -1.622
   22    HA   PHE   5           HA       PHE   5   4.343   9.056  -3.440
   23    HB2  PHE   5           2HB      PHE   5   3.418   6.871  -1.623
   24    HB3  PHE   5           1HB      PHE   5   4.920   7.026  -2.508
   25    HD1  PHE   5           2HD      PHE   5   6.211   9.366  -1.699
   26    HD2  PHE   5           1HD      PHE   5   3.694   6.866   0.653
   27    HE1  PHE   5           2HE      PHE   5   7.319  10.169   0.341
   28    HE2  PHE   5           1HE      PHE   5   4.797   7.668   2.692
   29    HZ   PHE   5           HZ       PHE   5   6.613   9.322   2.540
   30    H    THR   6           H        THR   6   1.152   8.108  -2.280
   31    HA   THR   6           HA       THR   6  -0.749   7.637  -3.528
   32    HB   THR   6           HB       THR   6   0.831   8.326  -5.592
   33    HG1  THR   6           1HG      THR   6  -0.984   8.032  -6.843
   34   HG21  THR   6          3HG2      THR   6   1.151   6.678  -7.187
   35   HG22  THR   6          1HG2      THR   6   0.103   5.531  -6.356
   36   HG23  THR   6          2HG2      THR   6   1.692   5.914  -5.694
   37    H    CYS   7           H        CYS   7  -1.759   5.836  -2.812
   38    HA   CYS   7           HA       CYS   7  -0.284   3.432  -2.247
   39    HB2  CYS   7           2HB      CYS   7  -1.940   3.767  -0.601
   40    HB3  CYS   7           1HB      CYS   7  -3.158   4.291  -1.751
   41    H    CYS   8           H        CYS   8  -0.923   4.438  -5.141
   42    HA   CYS   8           HA       CYS   8  -1.507   3.459  -7.137
   43    HB2  CYS   8           2HB      CYS   8   0.107   1.767  -6.675
   44    HB3  CYS   8           1HB      CYS   8  -0.864   1.056  -5.406
   45    HG   CYS   8           HG       CYS   8  -1.349  -0.560  -7.227
   46    H    VAL   9           H        VAL   9  -3.225   4.171  -4.925
   47    HA   VAL   9           HA       VAL   9  -5.438   2.423  -4.684
   48    HB   VAL   9           HB       VAL   9  -5.038   3.834  -2.834
   49   HG11  VAL   9          1HG1      VAL   9  -4.313   5.768  -4.904
   50   HG12  VAL   9          2HG1      VAL   9  -3.628   5.484  -3.303
   51   HG13  VAL   9          3HG1      VAL   9  -5.086   6.448  -3.481
   52   HG21  VAL   9          3HG2      VAL   9  -7.488   3.950  -3.775
   53   HG22  VAL   9          1HG2      VAL   9  -7.068   5.637  -4.060
   54   HG23  VAL   9          2HG2      VAL   9  -6.980   4.976  -2.423
   55    HA   PRO  10           HA       PRO  10  -7.039   3.916  -8.691
   56    HB2  PRO  10           2HB      PRO  10  -8.721   1.828  -9.054
   57    HB3  PRO  10           1HB      PRO  10  -6.992   1.707  -9.408
   58    HG2  PRO  10           2HG      PRO  10  -8.488   0.807  -6.967
   59    HG3  PRO  10           1HG      PRO  10  -7.252  -0.052  -7.903
   60    HD2  PRO  10           2HD      PRO  10  -6.656   1.223  -5.595
   61    HD3  PRO  10           1HD      PRO  10  -5.521   1.129  -6.953
   62    H    GLY  11           H        GLY  11  -8.494   2.904  -5.742
   63    HA2  GLY  11           2HA      GLY  11 -10.231   5.010  -5.440
   64    HA3  GLY  11           1HA      GLY  11 -11.148   3.755  -6.261
   65    H    CYS  12           H        CYS  12  -8.638   2.695  -4.082
   66    HA   CYS  12           HA       CYS  12 -10.469   1.244  -2.571
   67    HB2  CYS  12           2HB      CYS  12  -8.412   1.394  -0.790
   68    HB3  CYS  12           1HB      CYS  12  -8.542   0.218  -2.075
   69    H    TYR  13           H        TYR  13  -8.547   3.129  -0.376
   70    HA   TYR  13           HA       TYR  13 -11.024   4.462   0.482
   71    HB2  TYR  13           2HB      TYR  13  -9.846   2.631   1.928
   72    HB3  TYR  13           1HB      TYR  13  -8.823   3.970   2.397
   73    HD1  TYR  13           2HD      TYR  13 -12.474   3.802   1.680
   74    HD2  TYR  13           1HD      TYR  13  -9.458   4.604   4.571
   75    HE1  TYR  13           2HE      TYR  13 -14.199   4.529   3.273
   76    HE2  TYR  13           1HE      TYR  13 -11.172   5.334   6.169
   77    HH   TYR  13           HH       TYR  13 -13.556   5.029   6.580
   78    H    ASN  14           H        ASN  14  -7.615   4.764   1.044
   79    HA   ASN  14           HA       ASN  14  -7.675   7.654   0.598
   80    HB2  ASN  14           2HB      ASN  14  -5.546   7.295   2.101
   81    HB3  ASN  14           1HB      ASN  14  -7.040   7.810   2.744
   82   HD21  ASN  14          1HD2      ASN  14  -8.463   5.530   2.933
   83   HD22  ASN  14          2HD2      ASN  14  -7.658   4.357   3.917
   84    H    ASN  15           H        ASN  15  -5.430   8.621  -0.201
   85    HA   ASN  15           HA       ASN  15  -4.173   6.455  -1.722
   86    HB2  ASN  15           2HB      ASN  15  -3.609   9.296  -2.456
   87    HB3  ASN  15           1HB      ASN  15  -3.766   7.890  -3.494
   88   HD21  ASN  15          1HD2      ASN  15  -6.334   7.075  -2.374
   89   HD22  ASN  15          2HD2      ASN  15  -7.499   8.194  -2.970
   90    H    SER  16           H        SER  16  -1.607   6.753  -2.021
   91    HA   SER  16           HA       SER  16  -0.547   7.269   0.562
   92    HB2  SER  16           2HB      SER  16   0.173   5.238  -0.726
   93    HB3  SER  16           1HB      SER  16   0.818   6.247  -1.969
   94    HG   SER  16           HG       SER  16   2.110   7.206  -0.155
   95    H    HIS  17           H        HIS  17  -1.207   9.363  -1.966
   96    HA   HIS  17           HA       HIS  17   0.876  11.193  -1.039
   97    HB2  HIS  17           2HB      HIS  17   1.470  11.923  -3.231
   98    HB3  HIS  17           1HB      HIS  17   1.555  10.167  -3.285
   99    HD1  HIS  17           1HD      HIS  17  -1.359   9.456  -3.847
  100    HD2  HIS  17           2HD      HIS  17   0.628  12.596  -5.705
  101    HE1  HIS  17           1HE      HIS  17  -2.604   9.864  -5.990
  102    HE2  HIS  17           2HE      HIS  17  -1.375  11.756  -7.108
  103    H    ARG  18           H        ARG  18  -2.273  10.687  -2.457
  104    HA   ARG  18           HA       ARG  18  -2.889  13.536  -2.323
  105    HB2  ARG  18           2HB      ARG  18  -3.413  11.843  -4.259
  106    HB3  ARG  18           1HB      ARG  18  -4.799  11.455  -3.260
  107    HG2  ARG  18           2HG      ARG  18  -5.470  13.813  -3.307
  108    HG3  ARG  18           1HG      ARG  18  -4.112  14.153  -4.384
  109    HD2  ARG  18           2HD      ARG  18  -5.498  11.928  -5.439
  110    HD3  ARG  18           1HD      ARG  18  -6.705  13.153  -5.038
  111    HE   ARG  18           HE       ARG  18  -4.830  14.571  -6.364
  112   HH11  ARG  18          1HH1      ARG  18  -6.529  11.615  -7.115
  113   HH12  ARG  18          2HH1      ARG  18  -6.467  11.867  -8.826
  114   HH21  ARG  18          1HH2      ARG  18  -4.748  14.902  -8.617
  115   HH22  ARG  18          2HH2      ARG  18  -5.456  13.731  -9.679
  116    H    ASP  19           H        ASP  19  -2.584  12.401   0.180
  117    HA   ASP  19           HA       ASP  19  -4.961  13.122   1.427
  118    HB2  ASP  19           2HB      ASP  19  -6.186  11.260   1.400
  119    HB3  ASP  19           1HB      ASP  19  -4.922  10.423   0.529
  120    H    LYS  20           H        LYS  20  -2.544  10.639   2.193
  121    HA   LYS  20           HA       LYS  20  -1.152  10.362   3.978
  122    HB2  LYS  20           2HB      LYS  20   0.385  12.085   4.341
  123    HB3  LYS  20           1HB      LYS  20  -0.170  12.350   2.699
  124    HG2  LYS  20           2HG      LYS  20  -0.966  14.370   3.181
  125    HG3  LYS  20           1HG      LYS  20  -1.752  13.810   4.654
  126    HD2  LYS  20           2HD      LYS  20   1.067  13.785   5.070
  127    HD3  LYS  20           1HD      LYS  20   0.614  15.350   4.392
  128    HE2  LYS  20           2HE      LYS  20  -0.350  14.049   6.920
  129    HE3  LYS  20           1HE      LYS  20   0.428  15.617   6.718
  130    HZ1  LYS  20           3HZ      LYS  20  -1.734  16.247   6.958
  131    HZ2  LYS  20           1HZ      LYS  20  -2.359  14.847   6.239
  132    HZ3  LYS  20           2HZ      LYS  20  -1.694  16.069   5.277
  133    H    ALA  21           H        ALA  21  -4.036  11.321   4.402
  134    HA   ALA  21           HA       ALA  21  -3.817  12.067   7.237
  135    HB1  ALA  21           1HB      ALA  21  -6.389  12.697   6.618
  136    HB2  ALA  21           2HB      ALA  21  -5.552  13.024   5.099
  137    HB3  ALA  21           3HB      ALA  21  -5.021  13.812   6.585
  138    H    LEU  22           H        LEU  22  -5.995  10.022   5.141
  139    HA   LEU  22           HA       LEU  22  -7.556   8.982   7.148
  140    HB2  LEU  22           2HB      LEU  22  -6.830   7.404   4.678
  141    HB3  LEU  22           1HB      LEU  22  -8.403   7.543   5.462
  142    HG   LEU  22           HG       LEU  22  -7.236   9.115   3.304
  143   HD11  LEU  22          1HD1      LEU  22  -9.840   8.127   4.206
  144   HD12  LEU  22          2HD1      LEU  22  -9.195   8.321   2.573
  145   HD13  LEU  22          3HD1      LEU  22  -9.885   9.702   3.418
  146   HD21  LEU  22          3HD2      LEU  22  -8.067  10.478   5.740
  147   HD22  LEU  22          1HD2      LEU  22  -8.805  11.056   4.251
  148   HD23  LEU  22          2HD2      LEU  22  -7.052  11.012   4.404
  149    H    HIS  23           H        HIS  23  -6.989   5.909   6.856
  150    HA   HIS  23           HA       HIS  23  -4.856   5.943   8.802
  151    HB2  HIS  23           2HB      HIS  23  -7.279   4.555   8.556
  152    HB3  HIS  23           1HB      HIS  23  -6.043   3.338   8.267
  153    HD1  HIS  23           1HD      HIS  23  -5.599   6.178  10.706
  154    HD2  HIS  23           2HD      HIS  23  -6.288   2.081  10.712
  155    HE1  HIS  23           1HE      HIS  23  -5.334   5.456  13.100
  156    HE2  HIS  23           2HE      HIS  23  -5.685   2.961  13.067
  157    H    PHE  24           H        PHE  24  -2.881   4.592   8.517
  158    HA   PHE  24           HA       PHE  24  -2.629   3.475   5.833
  159    HB2  PHE  24           2HB      PHE  24  -0.610   5.105   7.358
  160    HB3  PHE  24           1HB      PHE  24  -0.241   4.226   5.886
  161    HD1  PHE  24           2HD      PHE  24  -2.227   7.010   7.286
  162    HD2  PHE  24           1HD      PHE  24  -0.784   5.141   3.740
  163    HE1  PHE  24           2HE      PHE  24  -2.894   8.979   5.967
  164    HE2  PHE  24           1HE      PHE  24  -1.422   7.101   2.431
  165    HZ   PHE  24           HZ       PHE  24  -2.494   9.029   3.525
  166    H    TYR  25           H        TYR  25  -1.756   1.291   5.788
  167    HA   TYR  25           HA       TYR  25  -1.021   0.107   8.317
  168    HB2  TYR  25           2HB      TYR  25  -1.526  -0.976   5.548
  169    HB3  TYR  25           1HB      TYR  25  -0.714  -1.966   6.753
  170    HD1  TYR  25           2HD      TYR  25  -3.523   0.429   7.198
  171    HD2  TYR  25           1HD      TYR  25  -2.264  -3.632   7.281
  172    HE1  TYR  25           2HE      TYR  25  -5.708  -0.220   8.121
  173    HE2  TYR  25           1HE      TYR  25  -4.446  -4.298   8.205
  174    HH   TYR  25           HH       TYR  25  -6.299  -3.233   9.499
  175    H    THR  26           H        THR  26   1.171  -1.094   8.509
  176    HA   THR  26           HA       THR  26   3.159   0.435   6.981
  177    HB   THR  26           HB       THR  26   4.341  -1.061   9.149
  178    HG1  THR  26           1HG      THR  26   2.501  -1.146  10.269
  179   HG21  THR  26          3HG2      THR  26   4.066   1.626   9.910
  180   HG22  THR  26          1HG2      THR  26   4.317   1.620   8.165
  181   HG23  THR  26          2HG2      THR  26   5.483   0.832   9.230
  182    H    PHE  27           H        PHE  27   5.347  -0.836   6.681
  183    HA   PHE  27           HA       PHE  27   4.709  -3.043   5.053
  184    HB2  PHE  27           2HB      PHE  27   6.645  -1.092   5.197
  185    HB3  PHE  27           1HB      PHE  27   7.512  -2.605   5.246
  186    HD1  PHE  27           1HD      PHE  27   4.395  -2.621   3.407
  187    HD2  PHE  27           2HD      PHE  27   8.563  -1.802   3.145
  188    HE1  PHE  27           1HE      PHE  27   4.286  -2.751   0.965
  189    HE2  PHE  27           2HE      PHE  27   8.444  -1.953   0.709
  190    HZ   PHE  27           HZ       PHE  27   6.283  -2.426  -0.393
  191    HA   PRO  28           HA       PRO  28   5.524  -6.541   7.864
  192    HB2  PRO  28           2HB      PRO  28   6.746  -7.467   5.244
  193    HB3  PRO  28           1HB      PRO  28   5.860  -8.444   6.410
  194    HG2  PRO  28           2HG      PRO  28   4.606  -7.543   4.314
  195    HG3  PRO  28           1HG      PRO  28   3.817  -7.389   5.891
  196    HD2  PRO  28           2HD      PRO  28   5.039  -5.314   4.175
  197    HD3  PRO  28           1HD      PRO  28   3.723  -5.184   5.334
  198    H    LYS  29           H        LYS  29   7.575  -7.905   8.477
  199    HA   LYS  29           HA       LYS  29   9.846  -6.096   8.588
  200    HB2  LYS  29           2HB      LYS  29  10.545  -8.480   9.893
  201    HB3  LYS  29           1HB      LYS  29  10.046  -6.966  10.630
  202    HG2  LYS  29           2HG      LYS  29   7.737  -7.707  10.652
  203    HG3  LYS  29           1HG      LYS  29   8.190  -9.202   9.830
  204    HD2  LYS  29           2HD      LYS  29   9.303  -8.361  12.502
  205    HD3  LYS  29           1HD      LYS  29   7.889  -9.400  12.316
  206    HE2  LYS  29           2HE      LYS  29  10.716  -9.951  11.440
  207    HE3  LYS  29           1HE      LYS  29   9.777 -10.813  12.658
  208    HZ1  LYS  29           3HZ      LYS  29   8.226 -11.434  10.813
  209    HZ2  LYS  29           1HZ      LYS  29   9.766 -12.127  10.712
  210    HZ3  LYS  29           2HZ      LYS  29   9.363 -10.816   9.722
  211    H    ASP  30           H        ASP  30   8.875  -8.846   6.823
  212    HA   ASP  30           HA       ASP  30  11.551  -9.712   6.128
  213    HB2  ASP  30           2HB      ASP  30   9.520 -10.679   4.331
  214    HB3  ASP  30           1HB      ASP  30  10.476 -11.608   5.474
  215    H    ALA  31           H        ALA  31  12.770  -8.518   4.717
  216    HA   ALA  31           HA       ALA  31  11.985  -6.377   3.297
  217    HB1  ALA  31           1HB      ALA  31  13.993  -7.081   1.720
  218    HB2  ALA  31           2HB      ALA  31  14.254  -8.262   3.009
  219    HB3  ALA  31           3HB      ALA  31  14.224  -6.545   3.377
  220    H    GLU  32           H        GLU  32  12.385  -9.546   1.482
  221    HA   GLU  32           HA       GLU  32  11.209  -8.616  -0.867
  222    HB2  GLU  32           2HB      GLU  32  12.297 -10.692  -0.931
  223    HB3  GLU  32           1HB      GLU  32  11.355 -11.412   0.310
  224    HG2  GLU  32           2HG      GLU  32  10.157 -10.569  -2.308
  225    HG3  GLU  32           1HG      GLU  32  10.942 -12.132  -2.098
  226    H    LEU  33           H        LEU  33   9.227 -10.551   1.550
  227    HA   LEU  33           HA       LEU  33   6.889 -10.266   0.277
  228    HB2  LEU  33           2HB      LEU  33   7.378 -11.026   2.726
  229    HB3  LEU  33           1HB      LEU  33   7.042  -9.375   3.148
  230    HG   LEU  33           HG       LEU  33   4.886  -9.788   3.214
  231   HD11  LEU  33          1HD1      LEU  33   5.131 -10.929   0.434
  232   HD12  LEU  33          2HD1      LEU  33   4.719  -9.272   0.857
  233   HD13  LEU  33          3HD1      LEU  33   3.614 -10.585   1.258
  234   HD21  LEU  33          3HD2      LEU  33   4.152 -12.215   2.697
  235   HD22  LEU  33          1HD2      LEU  33   5.188 -11.883   4.083
  236   HD23  LEU  33          2HD2      LEU  33   5.884 -12.511   2.587
  237    H    ARG  34           H        ARG  34   8.673  -7.788   1.865
  238    HA   ARG  34           HA       ARG  34   6.818  -5.679   1.725
  239    HB2  ARG  34           2HB      ARG  34   8.431  -4.295   2.573
  240    HB3  ARG  34           1HB      ARG  34   9.122  -5.836   3.021
  241    HG2  ARG  34           2HG      ARG  34  10.996  -5.219   2.023
  242    HG3  ARG  34           1HG      ARG  34  10.161  -5.194   0.483
  243    HD2  ARG  34           2HD      ARG  34   9.963  -2.950   0.466
  244    HD3  ARG  34           1HD      ARG  34   9.805  -2.845   2.218
  245    HE   ARG  34           HE       ARG  34  12.429  -3.609   1.323
  246   HH11  ARG  34          1HH1      ARG  34  10.317  -0.926   2.056
  247   HH12  ARG  34          2HH1      ARG  34  11.618   0.176   2.358
  248   HH21  ARG  34          1HH2      ARG  34  14.139  -2.161   1.723
  249   HH22  ARG  34          2HH2      ARG  34  13.789  -0.525   2.169
  250    H    ARG  35           H        ARG  35   9.564  -6.346  -0.382
  251    HA   ARG  35           HA       ARG  35   8.920  -4.350  -2.188
  252    HB2  ARG  35           2HB      ARG  35  10.433  -5.296  -3.710
  253    HB3  ARG  35           1HB      ARG  35  11.080  -5.673  -2.128
  254    HG2  ARG  35           2HG      ARG  35  11.395  -7.559  -3.508
  255    HG3  ARG  35           1HG      ARG  35  10.123  -7.972  -2.373
  256    HD2  ARG  35           2HD      ARG  35   8.676  -8.346  -4.039
  257    HD3  ARG  35           1HD      ARG  35   9.040  -6.788  -4.780
  258    HE   ARG  35           HE       ARG  35  11.136  -8.592  -5.302
  259   HH11  ARG  35          1HH1      ARG  35   7.813  -7.988  -6.182
  260   HH12  ARG  35          2HH1      ARG  35   7.964  -8.711  -7.746
  261   HH21  ARG  35          1HH2      ARG  35  11.336  -9.544  -7.361
  262   HH22  ARG  35          2HH2      ARG  35   9.965  -9.597  -8.417
  263    H    LEU  36           H        LEU  36   7.597  -7.595  -1.714
  264    HA   LEU  36           HA       LEU  36   6.227  -7.642  -4.250
  265    HB2  LEU  36           2HB      LEU  36   5.656  -8.948  -1.616
  266    HB3  LEU  36           1HB      LEU  36   4.473  -9.012  -2.897
  267    HG   LEU  36           HG       LEU  36   7.279 -10.109  -2.987
  268   HD11  LEU  36          1HD1      LEU  36   6.175 -12.262  -3.173
  269   HD12  LEU  36          2HD1      LEU  36   4.596 -11.479  -3.082
  270   HD13  LEU  36          3HD1      LEU  36   5.682 -11.441  -1.692
  271   HD21  LEU  36          3HD2      LEU  36   6.115 -11.079  -5.197
  272   HD22  LEU  36          1HD2      LEU  36   7.076  -9.598  -5.183
  273   HD23  LEU  36          2HD2      LEU  36   5.315  -9.509  -5.111
  274    H    TRP  37           H        TRP  37   5.247  -6.349  -1.111
  275    HA   TRP  37           HA       TRP  37   2.734  -5.468  -1.997
  276    HB2  TRP  37           2HB      TRP  37   4.604  -4.661   0.216
  277    HB3  TRP  37           1HB      TRP  37   3.152  -3.712  -0.114
  278    HD1  TRP  37           HD       TRP  37   3.213  -7.486  -0.534
  279    HE1  TRP  37           1HE      TRP  37   1.589  -8.529   1.223
  280    HE3  TRP  37           3HE      TRP  37   2.100  -3.289   2.105
  281    HZ2  TRP  37           2HZ      TRP  37  -0.034  -7.590   3.384
  282    HZ3  TRP  37           3HZ      TRP  37   0.514  -3.405   3.940
  283    HH2  TRP  37           HH       TRP  37  -0.552  -5.478   4.563
  284    H    LEU  38           H        LEU  38   6.023  -3.967  -2.084
  285    HA   LEU  38           HA       LEU  38   5.522  -1.389  -2.780
  286    HB2  LEU  38           2HB      LEU  38   7.464  -3.319  -4.086
  287    HB3  LEU  38           1HB      LEU  38   7.431  -1.618  -4.415
  288    HG   LEU  38           HG       LEU  38   7.990  -2.903  -1.762
  289   HD11  LEU  38          1HD1      LEU  38  10.191  -2.432  -2.088
  290   HD12  LEU  38          2HD1      LEU  38   9.855  -1.043  -3.122
  291   HD13  LEU  38          3HD1      LEU  38   9.713  -2.678  -3.768
  292   HD21  LEU  38          3HD2      LEU  38   7.788   0.013  -2.489
  293   HD22  LEU  38          1HD2      LEU  38   8.385  -0.617  -0.954
  294   HD23  LEU  38          2HD2      LEU  38   6.706  -0.878  -1.420
  295    H    LYS  39           H        LYS  39   5.345  -4.298  -4.995
  296    HA   LYS  39           HA       LYS  39   4.560  -3.045  -7.283
  297    HB2  LYS  39           2HB      LYS  39   4.395  -5.714  -6.082
  298    HB3  LYS  39           1HB      LYS  39   3.218  -5.437  -7.342
  299    HG2  LYS  39           2HG      LYS  39   5.607  -6.439  -7.798
  300    HG3  LYS  39           1HG      LYS  39   4.794  -5.402  -8.975
  301    HD2  LYS  39           2HD      LYS  39   6.400  -3.936  -7.008
  302    HD3  LYS  39           1HD      LYS  39   7.337  -5.047  -8.006
  303    HE2  LYS  39           2HE      LYS  39   5.555  -2.805  -8.937
  304    HE3  LYS  39           1HE      LYS  39   7.306  -2.925  -9.101
  305    HZ1  LYS  39           3HZ      LYS  39   6.592  -5.126 -10.362
  306    HZ2  LYS  39           1HZ      LYS  39   6.714  -3.632 -11.148
  307    HZ3  LYS  39           2HZ      LYS  39   5.201  -4.209 -10.656
  308    H    ASN  40           H        ASN  40   2.256  -4.546  -5.017
  309    HA   ASN  40           HA       ASN  40  -0.013  -3.598  -6.352
  310    HB2  ASN  40           2HB      ASN  40  -0.844  -3.894  -3.731
  311    HB3  ASN  40           1HB      ASN  40  -0.890  -5.118  -4.983
  312   HD21  ASN  40          1HD2      ASN  40  -0.668  -5.256  -2.111
  313   HD22  ASN  40          2HD2      ASN  40   0.749  -6.170  -1.796
  314    H    VAL  41           H        VAL  41   1.971  -2.077  -4.011
  315    HA   VAL  41           HA       VAL  41  -0.052  -0.207  -3.306
  316    HB   VAL  41           HB       VAL  41   2.199  -1.048  -2.000
  317   HG11  VAL  41          1HG1      VAL  41   3.544   0.922  -1.644
  318   HG12  VAL  41          2HG1      VAL  41   2.523   1.844  -2.750
  319   HG13  VAL  41          3HG1      VAL  41   3.519   0.529  -3.363
  320   HG21  VAL  41          3HG2      VAL  41   1.236   1.367  -0.834
  321   HG22  VAL  41          1HG2      VAL  41   0.878  -0.300  -0.383
  322   HG23  VAL  41          2HG2      VAL  41  -0.129   0.526  -1.579
  323    H    SER  42           H        SER  42   2.402  -0.157  -5.821
  324    HA   SER  42           HA       SER  42   1.530   1.855  -7.278
  325    HB2  SER  42           2HB      SER  42   1.178   3.700  -5.956
  326    HB3  SER  42           1HB      SER  42   2.250   3.139  -4.653
  327    HG   SER  42           HG       SER  42   3.204   4.176  -7.134
  328    H    ARG  43           H        ARG  43   4.742   2.941  -5.932
  329    HA   ARG  43           HA       ARG  43   6.811   2.724  -6.798
  330    HB2  ARG  43           2HB      ARG  43   5.814   0.149  -6.763
  331    HB3  ARG  43           1HB      ARG  43   6.413   0.315  -8.404
  332    HG2  ARG  43           2HG      ARG  43   7.989   0.789  -5.898
  333    HG3  ARG  43           1HG      ARG  43   8.092  -0.597  -6.983
  334    HD2  ARG  43           2HD      ARG  43   9.312   0.512  -8.510
  335    HD3  ARG  43           1HD      ARG  43   8.408   2.008  -8.289
  336    HE   ARG  43           HE       ARG  43   9.992   2.707  -6.795
  337   HH11  ARG  43          1HH1      ARG  43  10.364  -0.727  -7.298
  338   HH12  ARG  43          2HH1      ARG  43  11.868  -0.814  -6.443
  339   HH21  ARG  43          1HH2      ARG  43  11.976   2.595  -5.683
  340   HH22  ARG  43          2HH2      ARG  43  12.780   1.069  -5.523
  341    H    ALA  44           H        ALA  44   4.506   1.650  -9.332
  342    HA   ALA  44           HA       ALA  44   6.056   2.763 -11.458
  343    HB1  ALA  44           1HB      ALA  44   3.578   1.240 -11.152
  344    HB2  ALA  44           2HB      ALA  44   4.801   1.176 -12.421
  345    HB3  ALA  44           3HB      ALA  44   3.528   2.397 -12.485
  346    H    GLY  45           H        GLY  45   6.182   5.112 -10.324
  347    HA2  GLY  45           2HA      GLY  45   3.770   6.627 -10.258
  348    HA3  GLY  45           1HA      GLY  45   5.402   7.251 -10.138
  349    H    VAL  46           H        VAL  46   4.199   5.395 -12.875
  350    HA   VAL  46           HA       VAL  46   4.273   5.885 -15.111
  351    HB   VAL  46           HB       VAL  46   2.045   6.619 -14.497
  352   HG11  VAL  46          1HG1      VAL  46   1.609   9.045 -14.087
  353   HG12  VAL  46          2HG1      VAL  46   3.347   9.273 -13.909
  354   HG13  VAL  46          3HG1      VAL  46   2.475   8.227 -12.787
  355   HG21  VAL  46          3HG2      VAL  46   3.200   7.112 -16.810
  356   HG22  VAL  46          1HG2      VAL  46   2.945   8.789 -16.324
  357   HG23  VAL  46          2HG2      VAL  46   1.572   7.692 -16.461
  358    H    SER  47           H        SER  47   6.738   6.545 -14.290
  359    HA   SER  47           HA       SER  47   7.338   8.859 -15.964
  360    HB2  SER  47           2HB      SER  47   8.329  10.216 -14.330
  361    HB3  SER  47           1HB      SER  47   6.897   9.613 -13.495
  362    HG   SER  47           HG       SER  47   8.391   9.155 -12.046
  363    H    GLY  48           H        GLY  48   8.976   6.643 -13.410
  364    HA2  GLY  48           2HA      GLY  48  10.687   5.146 -13.835
  365    HA3  GLY  48           1HA      GLY  48  10.648   5.599 -15.532
  366    H    CYS  49           H        CYS  49  11.411   7.958 -15.904
  367    HA   CYS  49           HA       CYS  49  14.112   8.116 -15.166
  368    HB2  CYS  49           2HB      CYS  49  12.218   9.726 -16.704
  369    HB3  CYS  49           1HB      CYS  49  13.424  10.704 -15.876
  370    HG   CYS  49           HG       CYS  49  14.343  10.054 -18.219
  371    H    PHE  50           H        PHE  50  11.220   9.365 -13.688
  372    HA   PHE  50           HA       PHE  50  12.704  11.104 -11.870
  373    HB2  PHE  50           2HB      PHE  50   9.877  10.705 -12.638
  374    HB3  PHE  50           1HB      PHE  50  10.117  11.041 -10.928
  375    HD1  PHE  50           1HD      PHE  50  11.974  12.296 -13.897
  376    HD2  PHE  50           2HD      PHE  50   9.430  13.225 -10.616
  377    HE1  PHE  50           1HE      PHE  50  12.202  14.693 -14.405
  378    HE2  PHE  50           2HE      PHE  50   9.651  15.625 -11.118
  379    HZ   PHE  50           HZ       PHE  50  11.039  16.360 -13.016
  380    H    SER  51           H        SER  51  10.353   8.294 -11.424
  381    HA   SER  51           HA       SER  51  10.239   6.737  -9.775
  382    HB2  SER  51           2HB      SER  51  13.195   7.296  -9.425
  383    HB3  SER  51           1HB      SER  51  12.331   5.853  -8.896
  384    HG   SER  51           HG       SER  51  12.779   6.718 -11.559
  385    H    THR  52           H        THR  52   9.312   9.132  -8.985
  386    HA   THR  52           HA       THR  52  10.564  10.123  -6.624
  387    HB   THR  52           HB       THR  52   8.856  11.695  -6.549
  388    HG1  THR  52           1HG      THR  52   7.107   9.919  -7.890
  389   HG21  THR  52          3HG2      THR  52   8.571  12.558  -8.648
  390   HG22  THR  52          1HG2      THR  52   8.259  10.981  -9.375
  391   HG23  THR  52          2HG2      THR  52   9.906  11.443  -8.949
  392    H    PHE  53           H        PHE  53   8.953  10.322  -4.559
  393    HA   PHE  53           HA       PHE  53   8.295   9.208  -2.707
  394    HB2  PHE  53           2HB      PHE  53   6.294   7.906  -2.923
  395    HB3  PHE  53           1HB      PHE  53   6.176   9.270  -4.025
  396    HD1  PHE  53           2HD      PHE  53   6.686   5.635  -3.763
  397    HD2  PHE  53           1HD      PHE  53   6.024   8.917  -6.380
  398    HE1  PHE  53           2HE      PHE  53   6.191   4.069  -5.577
  399    HE2  PHE  53           1HE      PHE  53   5.517   7.354  -8.209
  400    HZ   PHE  53           HZ       PHE  53   5.598   4.924  -7.809
  401    H    GLN  54           H        GLN  54  10.630   8.058  -4.096
  402    HA   GLN  54           HA       GLN  54  10.898   5.427  -4.414
  403    HB2  GLN  54           2HB      GLN  54  12.598   7.505  -3.384
  404    HB3  GLN  54           1HB      GLN  54  12.936   5.997  -2.545
  405    HG2  GLN  54           2HG      GLN  54  12.940   5.029  -4.990
  406    HG3  GLN  54           1HG      GLN  54  13.297   6.703  -5.407
  407   HE21  GLN  54          1HE2      GLN  54  14.895   7.532  -3.418
  408   HE22  GLN  54          2HE2      GLN  54  16.354   6.609  -3.376
  409    HA   PRO  55           HA       PRO  55   9.190   3.411  -0.843
  410    HB2  PRO  55           2HB      PRO  55  10.681   1.008  -1.494
  411    HB3  PRO  55           1HB      PRO  55   8.948   1.308  -1.596
  412    HG2  PRO  55           2HG      PRO  55  10.569   1.008  -3.779
  413    HG3  PRO  55           1HG      PRO  55   9.041   1.904  -3.789
  414    HD2  PRO  55           2HD      PRO  55  11.839   2.921  -3.715
  415    HD3  PRO  55           1HD      PRO  55  10.399   3.614  -4.486
  416    H    THR  56           H        THR  56  12.538   3.860  -1.384
  417    HA   THR  56           HA       THR  56  13.823   2.491   0.631
  418    HB   THR  56           HB       THR  56  14.955   3.982  -0.979
  419    HG1  THR  56           1HG      THR  56  16.042   3.452   0.946
  420   HG21  THR  56          3HG2      THR  56  14.898   6.266  -0.992
  421   HG22  THR  56          1HG2      THR  56  14.350   6.374   0.680
  422   HG23  THR  56          2HG2      THR  56  13.223   5.891  -0.587
  423    H    THR  57           H        THR  57  11.952   5.623   0.923
  424    HA   THR  57           HA       THR  57  12.484   6.037   3.645
  425    HB   THR  57           HB       THR  57  11.569   7.812   2.321
  426    HG1  THR  57           1HG      THR  57  10.446   8.499   3.937
  427   HG21  THR  57          3HG2      THR  57  10.098   7.412   0.718
  428   HG22  THR  57          1HG2      THR  57   8.869   7.226   1.968
  429   HG23  THR  57          2HG2      THR  57   9.738   5.814   1.371
  430    H    GLY  58           H        GLY  58  10.292   3.856   2.035
  431    HA2  GLY  58           2HA      GLY  58   9.594   1.911   3.390
  432    HA3  GLY  58           1HA      GLY  58   9.303   3.039   4.688
  433    H    HIS  59           H        HIS  59   7.757   1.707   1.697
  434    HA   HIS  59           HA       HIS  59   5.670   3.671   1.847
  435    HB2  HIS  59           2HB      HIS  59   6.435   1.561   0.005
  436    HB3  HIS  59           1HB      HIS  59   4.697   1.578   0.286
  437    HD1  HIS  59           1HD      HIS  59   7.050   4.519   0.063
  438    HD2  HIS  59           2HD      HIS  59   3.785   2.904  -1.981
  439    HE1  HIS  59           1HE      HIS  59   6.466   6.196  -1.702
  440    HE2  HIS  59           2HE      HIS  59   4.579   5.143  -3.003
  441    H    ARG  60           H        ARG  60   3.627   3.431   2.476
  442    HA   ARG  60           HA       ARG  60   3.013   1.191   4.300
  443    HB2  ARG  60           2HB      ARG  60   1.797   2.743   5.621
  444    HB3  ARG  60           1HB      ARG  60   3.270   3.584   5.177
  445    HG2  ARG  60           2HG      ARG  60   1.776   4.416   3.165
  446    HG3  ARG  60           1HG      ARG  60   0.487   4.093   4.319
  447    HD2  ARG  60           2HD      ARG  60   1.118   5.785   5.699
  448    HD3  ARG  60           1HD      ARG  60   2.829   5.592   5.324
  449    HE   ARG  60           HE       ARG  60   1.258   6.645   3.152
  450   HH11  ARG  60          1HH1      ARG  60   3.099   7.430   6.011
  451   HH12  ARG  60          2HH1      ARG  60   3.428   9.054   5.506
  452   HH21  ARG  60          1HH2      ARG  60   1.686   8.779   2.486
  453   HH22  ARG  60          2HH2      ARG  60   2.623   9.822   3.504
  454    H    LEU  61           H        LEU  61   0.448   0.810   4.347
  455    HA   LEU  61           HA       LEU  61  -0.524   1.132   1.604
  456    HB2  LEU  61           2HB      LEU  61   0.123  -1.193   2.536
  457    HB3  LEU  61           1HB      LEU  61  -1.409  -1.129   3.381
  458    HG   LEU  61           HG       LEU  61  -2.569  -1.655   1.555
  459   HD11  LEU  61          1HD1      LEU  61  -2.534   0.263   0.348
  460   HD12  LEU  61          2HD1      LEU  61  -1.691  -0.821  -0.755
  461   HD13  LEU  61          3HD1      LEU  61  -0.788   0.287   0.259
  462   HD21  LEU  61          3HD2      LEU  61   0.086  -2.273   0.290
  463   HD22  LEU  61          1HD2      LEU  61  -1.469  -3.021  -0.056
  464   HD23  LEU  61          2HD2      LEU  61  -0.697  -3.294   1.497
  465    H    CYS  62           H        CYS  62  -3.095   1.339   1.375
  466    HA   CYS  62           HA       CYS  62  -4.058   2.590   3.809
  467    HB2  CYS  62           2HB      CYS  62  -4.960   4.319   2.666
  468    HB3  CYS  62           1HB      CYS  62  -3.654   3.941   1.637
  469    H    SER  63           H        SER  63  -6.735   2.676   3.772
  470    HA   SER  63           HA       SER  63  -7.424   0.359   4.886
  471    HB2  SER  63           2HB      SER  63  -8.577   2.927   4.312
  472    HB3  SER  63           1HB      SER  63  -9.816   1.697   4.195
  473    HG   SER  63           HG       SER  63  -9.481   1.130   6.276
  474    H    VAL  64           H        VAL  64  -9.979   1.108   3.183
  475    HA   VAL  64           HA       VAL  64 -11.233  -1.119   2.779
  476    HB   VAL  64           HB       VAL  64 -12.502  -0.188   0.919
  477   HG11  VAL  64          1HG1      VAL  64 -11.802   1.732   3.137
  478   HG12  VAL  64          2HG1      VAL  64 -13.046   0.484   3.175
  479   HG13  VAL  64          3HG1      VAL  64 -13.216   1.867   2.093
  480   HG21  VAL  64          3HG2      VAL  64 -11.454   1.098  -0.533
  481   HG22  VAL  64          1HG2      VAL  64 -10.047   1.247   0.528
  482   HG23  VAL  64          2HG2      VAL  64 -11.409   2.365   0.695
  483    H    HIS  65           H        HIS  65  -8.808  -2.085   2.124
  484    HA   HIS  65           HA       HIS  65  -9.132  -2.925  -0.695
  485    HB2  HIS  65           2HB      HIS  65  -6.655  -3.536   0.827
  486    HB3  HIS  65           1HB      HIS  65  -6.878  -3.318  -0.900
  487    HD1  HIS  65           1HD      HIS  65  -8.453  -0.491   0.523
  488    HD2  HIS  65           2HD      HIS  65  -4.574  -1.669  -0.138
  489    HE1  HIS  65           1HE      HIS  65  -7.099   1.575   0.761
  490    H    PHE  66           H        PHE  66  -8.017  -4.534   2.410
  491    HA   PHE  66           HA       PHE  66  -8.163  -7.087   1.496
  492    HB2  PHE  66           2HB      PHE  66  -8.903  -6.220   4.304
  493    HB3  PHE  66           1HB      PHE  66  -8.145  -7.730   3.820
  494    HD1  PHE  66           1HD      PHE  66  -5.831  -7.750   3.029
  495    HD2  PHE  66           2HD      PHE  66  -7.568  -4.226   4.694
  496    HE1  PHE  66           1HE      PHE  66  -3.591  -6.819   3.386
  497    HE2  PHE  66           2HE      PHE  66  -5.317  -3.305   5.061
  498    HZ   PHE  66           HZ       PHE  66  -3.330  -4.607   4.408
  499    H    GLN  67           H        GLN  67  -9.947  -8.828   2.265
  500    HA   GLN  67           HA       GLN  67 -12.531  -7.680   1.575
  501    HB2  GLN  67           2HB      GLN  67 -13.197 -10.088   1.321
  502    HB3  GLN  67           1HB      GLN  67 -11.946  -9.529   0.222
  503    HG2  GLN  67           2HG      GLN  67 -10.727 -10.592   2.576
  504    HG3  GLN  67           1HG      GLN  67 -11.896 -11.749   1.944
  505   HE21  GLN  67          1HE2      GLN  67  -9.983  -9.417   0.126
  506   HE22  GLN  67          2HE2      GLN  67  -9.085 -10.585  -0.777
  507    H    GLY  68           H        GLY  68 -13.656  -7.033   3.783
  508    HA2  GLY  68           2HA      GLY  68 -14.736  -7.678   5.715
  509    HA3  GLY  68           1HA      GLY  68 -13.996  -9.264   5.605
  510    H    GLY  69           H        GLY  69 -11.522  -9.312   6.217
  511    HA2  GLY  69           2HA      GLY  69 -10.131  -7.328   7.444
  512    HA3  GLY  69           1HA      GLY  69 -11.240  -7.865   8.696
  513    H    ARG  70           H        ARG  70  -8.338  -8.022   8.701
  514    HA   ARG  70           HA       ARG  70  -6.708  -9.468   9.366
  515    HB2  ARG  70           2HB      ARG  70  -8.403 -10.358  10.897
  516    HB3  ARG  70           1HB      ARG  70  -9.005 -11.419   9.633
  517    HG2  ARG  70           2HG      ARG  70  -7.222 -12.846   9.784
  518    HG3  ARG  70           1HG      ARG  70  -6.135 -11.597  10.392
  519    HD2  ARG  70           2HD      ARG  70  -6.486 -12.360  12.447
  520    HD3  ARG  70           1HD      ARG  70  -8.170 -11.864  12.308
  521    HE   ARG  70           HE       ARG  70  -7.137 -14.538  12.183
  522   HH11  ARG  70          1HH1      ARG  70  -9.752 -12.446  11.203
  523   HH12  ARG  70          2HH1      ARG  70 -10.889 -13.740  11.027
  524   HH21  ARG  70          1HH2      ARG  70  -8.631 -16.242  11.950
  525   HH22  ARG  70          2HH2      ARG  70 -10.252 -15.897  11.452
  526    H    LYS  71           H        LYS  71  -6.807  -9.062   6.726
  527    HA   LYS  71           HA       LYS  71  -7.282 -11.025   4.932
  528    HB2  LYS  71           2HB      LYS  71  -6.433  -9.422   3.660
  529    HB3  LYS  71           1HB      LYS  71  -5.689  -8.662   5.048
  530    HG2  LYS  71           2HG      LYS  71  -4.237 -10.972   3.914
  531    HG3  LYS  71           1HG      LYS  71  -4.353  -9.551   2.890
  532    HD2  LYS  71           2HD      LYS  71  -2.396  -9.942   4.703
  533    HD3  LYS  71           1HD      LYS  71  -2.921  -8.356   4.158
  534    HE2  LYS  71           2HE      LYS  71  -4.423  -9.463   6.447
  535    HE3  LYS  71           1HE      LYS  71  -2.721  -9.107   6.748
  536    HZ1  LYS  71           3HZ      LYS  71  -3.219  -6.860   5.721
  537    HZ2  LYS  71           1HZ      LYS  71  -3.842  -7.152   7.267
  538    HZ3  LYS  71           2HZ      LYS  71  -4.855  -7.241   5.917
  539    H    THR  72           H        THR  72  -6.945 -13.104   5.260
  540    HA   THR  72           HA       THR  72  -4.341 -14.193   5.031
  541    HB   THR  72           HB       THR  72  -4.652 -15.524   7.277
  542    HG1  THR  72           1HG      THR  72  -5.906 -13.072   7.929
  543   HG21  THR  72          3HG2      THR  72  -3.034 -13.433   6.562
  544   HG22  THR  72          1HG2      THR  72  -2.903 -14.389   8.039
  545   HG23  THR  72          2HG2      THR  72  -3.789 -12.865   8.051
  546    H    TYR  73           H        TYR  73  -4.373 -16.480   4.720
  547    HA   TYR  73           HA       TYR  73  -5.293 -18.552   4.330
  548    HB2  TYR  73           2HB      TYR  73  -7.165 -17.535   6.032
  549    HB3  TYR  73           1HB      TYR  73  -8.125 -17.776   4.578
  550    HD1  TYR  73           1HD      TYR  73  -6.660 -20.239   3.549
  551    HD2  TYR  73           2HD      TYR  73  -8.111 -19.200   7.413
  552    HE1  TYR  73           1HE      TYR  73  -6.890 -22.624   4.100
  553    HE2  TYR  73           2HE      TYR  73  -8.341 -21.582   7.974
  554    HH   TYR  73           HH       TYR  73  -6.888 -23.980   6.448
  555    H    THR  74           H        THR  74  -5.303 -15.997   2.486
  556    HA   THR  74           HA       THR  74  -5.998 -17.358   0.130
  557    HB   THR  74           HB       THR  74  -7.932 -15.297  -0.059
  558    HG1  THR  74           1HG      THR  74  -8.683 -16.976   2.058
  559   HG21  THR  74          3HG2      THR  74  -8.420 -18.248   0.277
  560   HG22  THR  74          1HG2      THR  74  -7.974 -17.465  -1.240
  561   HG23  THR  74          2HG2      THR  74  -9.502 -17.061  -0.453
  562    H    VAL  75           H        VAL  75  -6.106 -14.071   1.490
  563    HA   VAL  75           HA       VAL  75  -4.870 -13.057  -0.940
  564    HB   VAL  75           HB       VAL  75  -5.557 -11.228   1.317
  565   HG11  VAL  75          1HG1      VAL  75  -6.105  -9.731  -0.484
  566   HG12  VAL  75          2HG1      VAL  75  -5.976 -11.039  -1.659
  567   HG13  VAL  75          3HG1      VAL  75  -4.537 -10.465  -0.816
  568   HG21  VAL  75          3HG2      VAL  75  -7.849 -11.231   0.966
  569   HG22  VAL  75          1HG2      VAL  75  -7.467 -12.950   0.932
  570   HG23  VAL  75          2HG2      VAL  75  -7.720 -12.076  -0.576
  571    H    ARG  76           H        ARG  76  -2.754 -12.617  -1.102
  572    HA   ARG  76           HA       ARG  76  -1.167 -12.557   1.367
  573    HB2  ARG  76           2HB      ARG  76  -0.665 -14.190  -0.561
  574    HB3  ARG  76           1HB      ARG  76  -0.029 -12.788  -1.410
  575    HG2  ARG  76           2HG      ARG  76   1.866 -13.637  -0.447
  576    HG3  ARG  76           1HG      ARG  76   1.366 -12.454   0.765
  577    HD2  ARG  76           2HD      ARG  76   0.478 -14.123   2.172
  578    HD3  ARG  76           1HD      ARG  76   0.532 -15.338   0.895
  579    HE   ARG  76           HE       ARG  76   3.111 -14.280   1.619
  580   HH11  ARG  76          1HH1      ARG  76   0.704 -16.710   2.320
  581   HH12  ARG  76          2HH1      ARG  76   1.833 -17.793   3.058
  582   HH21  ARG  76          1HH2      ARG  76   4.597 -15.707   2.593
  583   HH22  ARG  76          2HH2      ARG  76   4.042 -17.225   3.214
  584    H    VAL  77           H        VAL  77  -1.743 -10.757  -1.640
  585    HA   VAL  77           HA       VAL  77  -0.457  -8.438  -0.380
  586    HB   VAL  77           HB       VAL  77   0.692  -7.851  -2.307
  587   HG11  VAL  77          1HG1      VAL  77   1.609  -9.949  -1.569
  588   HG12  VAL  77          2HG1      VAL  77   1.679  -9.851  -3.328
  589   HG13  VAL  77          3HG1      VAL  77   0.442 -10.838  -2.549
  590   HG21  VAL  77          3HG2      VAL  77  -1.201  -7.679  -3.790
  591   HG22  VAL  77          1HG2      VAL  77  -1.296  -9.436  -3.918
  592   HG23  VAL  77          2HG2      VAL  77   0.097  -8.577  -4.574
  593    HA   PRO  78           HA       PRO  78  -4.544  -6.575  -0.580
  594    HB2  PRO  78           2HB      PRO  78  -2.748  -4.199  -0.824
  595    HB3  PRO  78           1HB      PRO  78  -4.234  -4.367   0.106
  596    HG2  PRO  78           2HG      PRO  78  -2.017  -4.609   1.412
  597    HG3  PRO  78           1HG      PRO  78  -3.193  -5.927   1.602
  598    HD2  PRO  78           2HD      PRO  78  -0.778  -5.802  -0.171
  599    HD3  PRO  78           1HD      PRO  78  -1.278  -7.107   0.946
  600    H    THR  79           H        THR  79  -4.159  -7.553  -3.171
  601    HA   THR  79           HA       THR  79  -4.572  -4.979  -4.532
  602    HB   THR  79           HB       THR  79  -4.425  -6.896  -6.548
  603    HG1  THR  79           1HG      THR  79  -3.655  -8.497  -5.259
  604   HG21  THR  79          3HG2      THR  79  -1.836  -6.075  -6.359
  605   HG22  THR  79          1HG2      THR  79  -2.697  -4.785  -5.520
  606   HG23  THR  79          2HG2      THR  79  -3.129  -5.198  -7.180
  607    H    ILE  80           H        ILE  80  -6.574  -4.527  -4.380
  608    HA   ILE  80           HA       ILE  80  -8.588  -6.411  -5.401
  609    HB   ILE  80           HB       ILE  80  -8.694  -4.731  -2.917
  610   HG12  ILE  80          2HG1      ILE  80  -8.464  -7.263  -2.922
  611   HG13  ILE  80          1HG1      ILE  80  -9.767  -6.620  -1.944
  612   HG21  ILE  80          1HG2      ILE  80 -11.288  -5.058  -3.116
  613   HG22  ILE  80          2HG2      ILE  80 -10.941  -5.021  -4.845
  614   HG23  ILE  80          3HG2      ILE  80 -10.491  -3.653  -3.826
  615   HD11  ILE  80          3HD1      ILE  80 -10.860  -7.106  -4.480
  616   HD12  ILE  80          1HD1      ILE  80 -11.160  -7.972  -2.971
  617   HD13  ILE  80          2HD1      ILE  80  -9.882  -8.512  -4.063
  618    H    PHE  81           H        PHE  81  -8.635  -5.435  -7.527
  619    HA   PHE  81           HA       PHE  81  -9.946  -2.903  -7.641
  620    HB2  PHE  81           2HB      PHE  81  -7.321  -2.729  -9.061
  621    HB3  PHE  81           1HB      PHE  81  -8.334  -1.447  -8.433
  622    HD1  PHE  81           1HD      PHE  81  -8.396  -1.347  -5.717
  623    HD2  PHE  81           2HD      PHE  81  -5.292  -3.105  -8.066
  624    HE1  PHE  81           1HE      PHE  81  -6.834  -1.122  -3.829
  625    HE2  PHE  81           2HE      PHE  81  -3.722  -2.857  -6.157
  626    HZ   PHE  81           HZ       PHE  81  -4.517  -1.910  -4.018
  Start of MODEL   15
    1    H1   GLY   1           1HT      GLY   1   6.790  10.116   9.343
    2    H2   GLY   1           2HT      GLY   1   8.359  10.460   9.873
    3    H3   GLY   1           3HT      GLY   1   7.741   8.893  10.025
    4    HA2  GLY   1           1HA      GLY   1   9.325   9.116   8.168
    5    HA3  GLY   1           2HA      GLY   1   7.728   8.563   7.681
    6    H    SER   2           H        SER   2   7.111   9.443   5.832
    7    HA   SER   2           HA       SER   2   7.989  12.181   5.212
    8    HB2  SER   2           2HB      SER   2   8.090   9.804   3.690
    9    HB3  SER   2           1HB      SER   2   6.859  10.820   2.938
   10    HG   SER   2           HG       SER   2   9.554  11.511   3.495
   11    HA   PRO   3           HA       PRO   3   3.825  13.623   5.088
   12    HB2  PRO   3           2HB      PRO   3   3.750  15.307   2.995
   13    HB3  PRO   3           1HB      PRO   3   4.730  15.642   4.428
   14    HG2  PRO   3           2HG      PRO   3   5.571  14.532   1.777
   15    HG3  PRO   3           1HG      PRO   3   6.368  15.757   2.782
   16    HD2  PRO   3           2HD      PRO   3   7.118  13.125   2.712
   17    HD3  PRO   3           1HD      PRO   3   7.376  14.185   4.111
   18    H    GLY   4           H        GLY   4   4.853  11.491   2.728
   19    HA2  GLY   4           2HA      GLY   4   2.490  10.301   2.189
   20    HA3  GLY   4           1HA      GLY   4   2.530  11.623   1.025
   21    H    PHE   5           H        PHE   5   2.433   9.268  -0.252
   22    HA   PHE   5           HA       PHE   5   5.055   9.065  -1.426
   23    HB2  PHE   5           2HB      PHE   5   3.939   6.479  -0.400
   24    HB3  PHE   5           1HB      PHE   5   5.569   6.862  -0.918
   25    HD1  PHE   5           1HD      PHE   5   3.121   7.423   1.786
   26    HD2  PHE   5           2HD      PHE   5   7.203   7.561   0.596
   27    HE1  PHE   5           1HE      PHE   5   3.788   7.801   4.125
   28    HE2  PHE   5           2HE      PHE   5   7.876   7.941   2.933
   29    HZ   PHE   5           HZ       PHE   5   6.166   8.060   4.701
   30    H    THR   6           H        THR   6   1.779   7.774  -1.330
   31    HA   THR   6           HA       THR   6   0.310   7.847  -3.215
   32    HB   THR   6           HB       THR   6   2.705   7.026  -4.869
   33    HG1  THR   6           1HG      THR   6   1.393   9.535  -4.817
   34   HG21  THR   6          3HG2      THR   6   0.972   8.090  -6.614
   35   HG22  THR   6          1HG2      THR   6  -0.152   7.349  -5.475
   36   HG23  THR   6          2HG2      THR   6   1.080   6.364  -6.265
   37    H    CYS   7           H        CYS   7  -0.990   6.163  -2.714
   38    HA   CYS   7           HA       CYS   7   0.056   3.480  -2.355
   39    HB2  CYS   7           2HB      CYS   7  -1.705   3.996  -0.832
   40    HB3  CYS   7           1HB      CYS   7  -2.779   4.588  -2.088
   41    H    CYS   8           H        CYS   8  -0.500   5.210  -5.073
   42    HA   CYS   8           HA       CYS   8  -1.137   4.698  -7.217
   43    HB2  CYS   8           2HB      CYS   8   0.690   3.126  -7.128
   44    HB3  CYS   8           1HB      CYS   8  -0.255   1.986  -6.178
   45    HG   CYS   8           HG       CYS   8  -0.508   2.422  -9.236
   46    H    VAL   9           H        VAL   9  -2.918   4.865  -5.096
   47    HA   VAL   9           HA       VAL   9  -4.909   2.850  -5.076
   48    HB   VAL   9           HB       VAL   9  -4.724   4.095  -3.105
   49   HG11  VAL   9          1HG1      VAL   9  -5.024   6.726  -3.378
   50   HG12  VAL   9          2HG1      VAL   9  -4.279   6.353  -4.931
   51   HG13  VAL   9          3HG1      VAL   9  -3.461   5.914  -3.431
   52   HG21  VAL   9          3HG2      VAL   9  -7.162   4.110  -4.198
   53   HG22  VAL   9          1HG2      VAL   9  -6.899   5.847  -4.072
   54   HG23  VAL   9          2HG2      VAL   9  -6.803   4.837  -2.623
   55    HA   PRO  10           HA       PRO  10  -6.605   4.447  -8.972
   56    HB2  PRO  10           2HB      PRO  10  -8.044   2.229  -9.547
   57    HB3  PRO  10           1HB      PRO  10  -6.304   2.328  -9.849
   58    HG2  PRO  10           2HG      PRO  10  -7.761   1.042  -7.573
   59    HG3  PRO  10           1HG      PRO  10  -6.368   0.443  -8.492
   60    HD2  PRO  10           2HD      PRO  10  -6.146   1.613  -6.043
   61    HD3  PRO  10           1HD      PRO  10  -4.873   1.694  -7.273
   62    H    GLY  11           H        GLY  11  -7.931   3.514  -6.012
   63    HA2  GLY  11           2HA      GLY  11  -9.906   5.303  -5.782
   64    HA3  GLY  11           1HA      GLY  11 -10.681   4.026  -6.704
   65    H    CYS  12           H        CYS  12  -8.261   2.920  -4.470
   66    HA   CYS  12           HA       CYS  12 -10.061   1.327  -3.115
   67    HB2  CYS  12           2HB      CYS  12  -8.112   1.814  -1.151
   68    HB3  CYS  12           1HB      CYS  12  -8.203   0.457  -2.248
   69    H    TYR  13           H        TYR  13  -8.450   3.644  -1.012
   70    HA   TYR  13           HA       TYR  13 -11.044   4.806  -0.306
   71    HB2  TYR  13           2HB      TYR  13 -10.242   2.779   1.150
   72    HB3  TYR  13           1HB      TYR  13  -9.207   3.989   1.876
   73    HD1  TYR  13           2HD      TYR  13 -11.191   6.319   1.664
   74    HD2  TYR  13           1HD      TYR  13 -11.621   2.308   3.015
   75    HE1  TYR  13           2HE      TYR  13 -13.044   7.013   3.119
   76    HE2  TYR  13           1HE      TYR  13 -13.477   2.992   4.472
   77    HH   TYR  13           HH       TYR  13 -14.138   5.363   5.618
   78    H    ASN  14           H        ASN  14  -7.709   4.718   0.585
   79    HA   ASN  14           HA       ASN  14  -7.565   7.633   0.697
   80    HB2  ASN  14           2HB      ASN  14  -5.582   6.442   2.306
   81    HB3  ASN  14           1HB      ASN  14  -6.906   7.443   2.804
   82   HD21  ASN  14          1HD2      ASN  14  -9.033   6.314   2.968
   83   HD22  ASN  14          2HD2      ASN  14  -9.036   4.733   3.664
   84    H    ASN  15           H        ASN  15  -5.309   8.574   0.151
   85    HA   ASN  15           HA       ASN  15  -3.993   6.726  -1.691
   86    HB2  ASN  15           2HB      ASN  15  -4.658   8.575  -2.965
   87    HB3  ASN  15           1HB      ASN  15  -4.331   9.711  -1.665
   88   HD21  ASN  15          1HD2      ASN  15  -3.026   7.976  -4.344
   89   HD22  ASN  15          2HD2      ASN  15  -1.491   8.763  -4.380
   90    H    SER  16           H        SER  16  -1.414   6.746  -1.620
   91    HA   SER  16           HA       SER  16  -0.529   6.948   1.048
   92    HB2  SER  16           2HB      SER  16   0.287   5.062  -0.284
   93    HB3  SER  16           1HB      SER  16   0.863   6.130  -1.517
   94    HG   SER  16           HG       SER  16   2.423   5.276   0.096
   95    H    HIS  17           H        HIS  17  -0.396   9.176  -1.682
   96    HA   HIS  17           HA       HIS  17   1.320  10.935  -0.079
   97    HB2  HIS  17           2HB      HIS  17   2.858  10.374  -1.679
   98    HB3  HIS  17           1HB      HIS  17   1.672  10.104  -2.931
   99    HD1  HIS  17           1HD      HIS  17   2.442  11.638  -4.736
  100    HD2  HIS  17           2HD      HIS  17   2.361  13.505  -1.025
  101    HE1  HIS  17           1HE      HIS  17   2.970  14.055  -5.187
  102    HE2  HIS  17           2HE      HIS  17   3.018  15.143  -2.916
  103    H    ARG  18           H        ARG  18  -1.131  11.709   0.450
  104    HA   ARG  18           HA       ARG  18  -1.511  14.008  -1.225
  105    HB2  ARG  18           2HB      ARG  18  -2.893  12.891  -2.622
  106    HB3  ARG  18           1HB      ARG  18  -3.324  11.676  -1.424
  107    HG2  ARG  18           2HG      ARG  18  -4.433  14.259  -0.720
  108    HG3  ARG  18           1HG      ARG  18  -4.881  13.793  -2.357
  109    HD2  ARG  18           2HD      ARG  18  -5.157  11.910  -0.033
  110    HD3  ARG  18           1HD      ARG  18  -6.429  13.047  -0.477
  111    HE   ARG  18           HE       ARG  18  -5.545  11.460  -2.686
  112   HH11  ARG  18          1HH1      ARG  18  -7.634  11.494   0.112
  113   HH12  ARG  18          2HH1      ARG  18  -8.719  10.309  -0.530
  114   HH21  ARG  18          1HH2      ARG  18  -6.974   9.898  -3.530
  115   HH22  ARG  18          2HH2      ARG  18  -8.345   9.400  -2.596
  116    H    ASP  19           H        ASP  19  -3.797  12.415   1.106
  117    HA   ASP  19           HA       ASP  19  -4.009  14.959   2.452
  118    HB2  ASP  19           2HB      ASP  19  -5.587  12.534   2.296
  119    HB3  ASP  19           1HB      ASP  19  -5.613  13.305   3.874
  120    H    LYS  20           H        LYS  20  -2.586  11.854   3.290
  121    HA   LYS  20           HA       LYS  20  -1.451  11.152   5.098
  122    HB2  LYS  20           2HB      LYS  20   0.209  12.534   5.797
  123    HB3  LYS  20           1HB      LYS  20  -0.344  13.511   4.448
  124    HG2  LYS  20           2HG      LYS  20  -0.419  15.165   5.945
  125    HG3  LYS  20           1HG      LYS  20  -1.929  14.427   6.472
  126    HD2  LYS  20           2HD      LYS  20  -1.050  13.762   8.424
  127    HD3  LYS  20           1HD      LYS  20   0.437  13.196   7.659
  128    HE2  LYS  20           2HE      LYS  20   1.431  15.311   7.768
  129    HE3  LYS  20           1HE      LYS  20  -0.112  16.123   8.027
  130    HZ1  LYS  20           3HZ      LYS  20   0.726  14.184  10.040
  131    HZ2  LYS  20           1HZ      LYS  20  -0.094  15.651  10.226
  132    HZ3  LYS  20           2HZ      LYS  20   1.580  15.643   9.984
  133    H    ALA  21           H        ALA  21  -4.378  12.336   5.240
  134    HA   ALA  21           HA       ALA  21  -4.537  12.246   8.191
  135    HB1  ALA  21           1HB      ALA  21  -6.473  13.650   8.100
  136    HB2  ALA  21           2HB      ALA  21  -6.509  13.572   6.338
  137    HB3  ALA  21           3HB      ALA  21  -5.193  14.415   7.156
  138    H    LEU  22           H        LEU  22  -4.631  10.000   6.173
  139    HA   LEU  22           HA       LEU  22  -7.320   8.956   6.760
  140    HB2  LEU  22           2HB      LEU  22  -5.663   7.713   4.623
  141    HB3  LEU  22           1HB      LEU  22  -7.392   8.033   4.655
  142    HG   LEU  22           HG       LEU  22  -5.696  10.428   4.464
  143   HD11  LEU  22          1HD1      LEU  22  -5.979   9.311   1.832
  144   HD12  LEU  22          2HD1      LEU  22  -5.013   8.247   2.856
  145   HD13  LEU  22          3HD1      LEU  22  -4.536   9.925   2.640
  146   HD21  LEU  22          3HD2      LEU  22  -8.368   9.579   3.899
  147   HD22  LEU  22          1HD2      LEU  22  -7.639  10.219   2.424
  148   HD23  LEU  22          2HD2      LEU  22  -7.697  11.204   3.888
  149    H    HIS  23           H        HIS  23  -6.882   6.162   6.419
  150    HA   HIS  23           HA       HIS  23  -5.149   5.639   8.694
  151    HB2  HIS  23           2HB      HIS  23  -7.649   4.652   7.787
  152    HB3  HIS  23           1HB      HIS  23  -6.519   3.306   7.696
  153    HD1  HIS  23           1HD      HIS  23  -8.310   5.490  10.117
  154    HD2  HIS  23           2HD      HIS  23  -5.500   2.430  10.187
  155    HE1  HIS  23           1HE      HIS  23  -8.187   4.746  12.517
  156    HE2  HIS  23           2HE      HIS  23  -6.420   2.949  12.548
  157    H    PHE  24           H        PHE  24  -3.098   4.435   8.378
  158    HA   PHE  24           HA       PHE  24  -2.834   3.235   5.738
  159    HB2  PHE  24           2HB      PHE  24  -0.700   4.775   7.190
  160    HB3  PHE  24           1HB      PHE  24  -0.509   3.978   5.634
  161    HD1  PHE  24           2HD      PHE  24  -2.722   6.488   7.287
  162    HD2  PHE  24           1HD      PHE  24  -0.731   5.261   3.733
  163    HE1  PHE  24           2HE      PHE  24  -3.473   8.538   6.154
  164    HE2  PHE  24           1HE      PHE  24  -1.469   7.305   2.603
  165    HZ   PHE  24           HZ       PHE  24  -2.848   8.945   3.800
  166    H    TYR  25           H        TYR  25  -1.691   1.178   5.601
  167    HA   TYR  25           HA       TYR  25  -1.099  -0.098   8.143
  168    HB2  TYR  25           2HB      TYR  25  -1.343  -1.133   5.311
  169    HB3  TYR  25           1HB      TYR  25  -0.634  -2.112   6.584
  170    HD1  TYR  25           1HD      TYR  25  -3.692   0.018   6.181
  171    HD2  TYR  25           2HD      TYR  25  -2.037  -3.681   7.478
  172    HE1  TYR  25           1HE      TYR  25  -5.938  -0.751   6.823
  173    HE2  TYR  25           2HE      TYR  25  -4.271  -4.472   8.128
  174    HH   TYR  25           HH       TYR  25  -6.459  -3.492   8.751
  175    H    THR  26           H        THR  26   1.135  -1.202   8.406
  176    HA   THR  26           HA       THR  26   3.136   0.385   6.943
  177    HB   THR  26           HB       THR  26   4.336   0.570   8.857
  178    HG1  THR  26           1HG      THR  26   5.232  -1.313   9.192
  179   HG21  THR  26          3HG2      THR  26   1.976   0.940   9.664
  180   HG22  THR  26          1HG2      THR  26   3.178   0.554  10.895
  181   HG23  THR  26          2HG2      THR  26   2.054  -0.687  10.341
  182    H    PHE  27           H        PHE  27   5.384  -0.855   6.829
  183    HA   PHE  27           HA       PHE  27   4.799  -3.121   5.227
  184    HB2  PHE  27           2HB      PHE  27   6.644  -1.062   5.235
  185    HB3  PHE  27           1HB      PHE  27   7.549  -2.556   5.180
  186    HD1  PHE  27           1HD      PHE  27   4.209  -2.195   3.677
  187    HD2  PHE  27           2HD      PHE  27   8.406  -2.169   3.014
  188    HE1  PHE  27           1HE      PHE  27   3.835  -2.350   1.255
  189    HE2  PHE  27           2HE      PHE  27   8.038  -2.344   0.615
  190    HZ   PHE  27           HZ       PHE  27   5.730  -2.432  -0.285
  191    HA   PRO  28           HA       PRO  28   6.012  -6.527   8.005
  192    HB2  PRO  28           2HB      PRO  28   7.101  -7.415   5.316
  193    HB3  PRO  28           1HB      PRO  28   6.332  -8.420   6.535
  194    HG2  PRO  28           2HG      PRO  28   4.917  -7.590   4.513
  195    HG3  PRO  28           1HG      PRO  28   4.218  -7.470   6.132
  196    HD2  PRO  28           2HD      PRO  28   5.239  -5.351   4.341
  197    HD3  PRO  28           1HD      PRO  28   3.978  -5.294   5.562
  198    H    LYS  29           H        LYS  29   8.186  -7.779   8.441
  199    HA   LYS  29           HA       LYS  29  10.356  -5.837   8.341
  200    HB2  LYS  29           2HB      LYS  29  11.114  -8.273   9.663
  201    HB3  LYS  29           1HB      LYS  29  10.937  -6.658  10.331
  202    HG2  LYS  29           2HG      LYS  29   8.430  -7.186  10.434
  203    HG3  LYS  29           1HG      LYS  29   8.917  -8.865  10.193
  204    HD2  LYS  29           2HD      LYS  29   9.819  -7.043  12.425
  205    HD3  LYS  29           1HD      LYS  29   8.670  -8.373  12.566
  206    HE2  LYS  29           2HE      LYS  29  10.366  -9.743  12.989
  207    HE3  LYS  29           1HE      LYS  29  10.981  -9.439  11.365
  208    HZ1  LYS  29           3HZ      LYS  29  11.848  -7.273  12.660
  209    HZ2  LYS  29           1HZ      LYS  29  12.758  -8.691  12.486
  210    HZ3  LYS  29           2HZ      LYS  29  11.896  -8.407  13.913
  211    H    ASP  30           H        ASP  30   9.367  -8.655   6.718
  212    HA   ASP  30           HA       ASP  30  12.014  -9.474   5.867
  213    HB2  ASP  30           2HB      ASP  30   9.909 -10.548   4.229
  214    HB3  ASP  30           1HB      ASP  30  10.949 -11.415   5.351
  215    H    ALA  31           H        ALA  31  13.108  -8.292   4.357
  216    HA   ALA  31           HA       ALA  31  12.202  -6.196   2.949
  217    HB1  ALA  31           1HB      ALA  31  14.468  -8.065   2.536
  218    HB2  ALA  31           2HB      ALA  31  14.444  -6.341   2.882
  219    HB3  ALA  31           3HB      ALA  31  14.106  -6.905   1.253
  220    H    GLU  32           H        GLU  32  12.515  -9.393   1.159
  221    HA   GLU  32           HA       GLU  32  11.161  -8.488  -1.110
  222    HB2  GLU  32           2HB      GLU  32  12.272 -10.545  -1.270
  223    HB3  GLU  32           1HB      GLU  32  11.446 -11.283   0.044
  224    HG2  GLU  32           2HG      GLU  32  10.014 -10.455  -2.463
  225    HG3  GLU  32           1HG      GLU  32  10.848 -12.002  -2.334
  226    H    LEU  33           H        LEU  33   9.404 -10.465   1.444
  227    HA   LEU  33           HA       LEU  33   6.973 -10.222   0.348
  228    HB2  LEU  33           2HB      LEU  33   7.674 -10.978   2.754
  229    HB3  LEU  33           1HB      LEU  33   7.315  -9.336   3.201
  230    HG   LEU  33           HG       LEU  33   5.186  -9.810   3.411
  231   HD11  LEU  33          1HD1      LEU  33   5.293 -10.942   0.618
  232   HD12  LEU  33          2HD1      LEU  33   4.824  -9.310   1.078
  233   HD13  LEU  33          3HD1      LEU  33   3.816 -10.680   1.537
  234   HD21  LEU  33          3HD2      LEU  33   5.593 -11.886   4.270
  235   HD22  LEU  33          1HD2      LEU  33   6.228 -12.504   2.746
  236   HD23  LEU  33          2HD2      LEU  33   4.494 -12.266   2.947
  237    H    ARG  34           H        ARG  34   8.826  -7.717   1.808
  238    HA   ARG  34           HA       ARG  34   6.931  -5.644   1.816
  239    HB2  ARG  34           2HB      ARG  34   8.573  -4.276   2.597
  240    HB3  ARG  34           1HB      ARG  34   9.377  -5.801   2.878
  241    HG2  ARG  34           2HG      ARG  34  11.102  -4.989   1.752
  242    HG3  ARG  34           1HG      ARG  34  10.127  -5.041   0.298
  243    HD2  ARG  34           2HD      ARG  34   9.796  -2.822   0.271
  244    HD3  ARG  34           1HD      ARG  34   9.709  -2.711   2.026
  245    HE   ARG  34           HE       ARG  34  11.950  -2.260   2.079
  246   HH11  ARG  34          1HH1      ARG  34  11.120  -3.526  -1.065
  247   HH12  ARG  34          2HH1      ARG  34  12.675  -3.192  -1.748
  248   HH21  ARG  34          1HH2      ARG  34  13.998  -1.819   1.181
  249   HH22  ARG  34          2HH2      ARG  34  14.309  -2.223  -0.473
  250    H    ARG  35           H        ARG  35   9.509  -6.248  -0.521
  251    HA   ARG  35           HA       ARG  35   8.658  -4.267  -2.265
  252    HB2  ARG  35           2HB      ARG  35  10.019  -5.212  -3.947
  253    HB3  ARG  35           1HB      ARG  35  10.852  -5.475  -2.430
  254    HG2  ARG  35           2HG      ARG  35  11.132  -7.416  -3.723
  255    HG3  ARG  35           1HG      ARG  35   9.976  -7.831  -2.474
  256    HD2  ARG  35           2HD      ARG  35   8.467  -8.406  -4.016
  257    HD3  ARG  35           1HD      ARG  35   8.597  -6.821  -4.780
  258    HE   ARG  35           HE       ARG  35  10.770  -8.551  -5.456
  259   HH11  ARG  35          1HH1      ARG  35   7.464  -7.744  -6.225
  260   HH12  ARG  35          2HH1      ARG  35   7.573  -8.315  -7.855
  261   HH21  ARG  35          1HH2      ARG  35  10.917  -9.299  -7.602
  262   HH22  ARG  35          2HH2      ARG  35   9.533  -9.197  -8.638
  263    H    LEU  36           H        LEU  36   7.483  -7.541  -1.670
  264    HA   LEU  36           HA       LEU  36   5.879  -7.626  -4.057
  265    HB2  LEU  36           2HB      LEU  36   6.368  -9.394  -2.089
  266    HB3  LEU  36           1HB      LEU  36   4.764  -8.889  -1.640
  267    HG   LEU  36           HG       LEU  36   3.950  -9.507  -3.886
  268   HD11  LEU  36          1HD1      LEU  36   6.822 -10.316  -4.246
  269   HD12  LEU  36          2HD1      LEU  36   5.844  -9.255  -5.261
  270   HD13  LEU  36          3HD1      LEU  36   5.517 -10.988  -5.225
  271   HD21  LEU  36          3HD2      LEU  36   4.007 -11.890  -3.548
  272   HD22  LEU  36          1HD2      LEU  36   3.873 -11.088  -1.983
  273   HD23  LEU  36          2HD2      LEU  36   5.424 -11.746  -2.506
  274    H    TRP  37           H        TRP  37   5.115  -6.346  -0.820
  275    HA   TRP  37           HA       TRP  37   2.503  -5.547  -1.582
  276    HB2  TRP  37           2HB      TRP  37   4.428  -4.580   0.519
  277    HB3  TRP  37           1HB      TRP  37   2.903  -3.747   0.230
  278    HD1  TRP  37           HD       TRP  37   3.125  -7.505  -0.092
  279    HE1  TRP  37           1HE      TRP  37   1.815  -8.618   1.865
  280    HE3  TRP  37           3HE      TRP  37   1.931  -3.331   2.560
  281    HZ2  TRP  37           2HZ      TRP  37   0.427  -7.765   4.203
  282    HZ3  TRP  37           3HZ      TRP  37   0.669  -3.558   4.622
  283    HH2  TRP  37           HH       TRP  37  -0.090  -5.684   5.400
  284    H    LEU  38           H        LEU  38   5.757  -4.001  -1.929
  285    HA   LEU  38           HA       LEU  38   5.206  -1.430  -2.599
  286    HB2  LEU  38           2HB      LEU  38   6.995  -3.379  -4.080
  287    HB3  LEU  38           1HB      LEU  38   6.893  -1.697  -4.477
  288    HG   LEU  38           HG       LEU  38   7.889  -2.905  -1.933
  289   HD11  LEU  38          1HD1      LEU  38   9.171  -1.164  -4.025
  290   HD12  LEU  38          2HD1      LEU  38   9.494  -2.873  -3.733
  291   HD13  LEU  38          3HD1      LEU  38   9.935  -1.672  -2.518
  292   HD21  LEU  38          3HD2      LEU  38   8.262  -0.602  -1.150
  293   HD22  LEU  38          1HD2      LEU  38   6.552  -0.988  -1.320
  294   HD23  LEU  38          2HD2      LEU  38   7.358  -0.003  -2.541
  295    H    LYS  39           H        LYS  39   4.817  -4.348  -4.755
  296    HA   LYS  39           HA       LYS  39   3.769  -3.196  -6.963
  297    HB2  LYS  39           2HB      LYS  39   3.688  -5.804  -5.611
  298    HB3  LYS  39           1HB      LYS  39   2.412  -5.563  -6.777
  299    HG2  LYS  39           2HG      LYS  39   4.571  -6.690  -7.507
  300    HG3  LYS  39           1HG      LYS  39   3.923  -5.414  -8.547
  301    HD2  LYS  39           2HD      LYS  39   5.541  -3.947  -6.975
  302    HD3  LYS  39           1HD      LYS  39   6.388  -5.490  -6.903
  303    HE2  LYS  39           2HE      LYS  39   6.238  -5.521  -9.437
  304    HE3  LYS  39           1HE      LYS  39   5.736  -3.833  -9.327
  305    HZ1  LYS  39           3HZ      LYS  39   7.866  -3.578  -7.930
  306    HZ2  LYS  39           1HZ      LYS  39   8.007  -3.689  -9.613
  307    HZ3  LYS  39           2HZ      LYS  39   8.338  -5.035  -8.646
  308    H    ASN  40           H        ASN  40   1.695  -4.553  -4.400
  309    HA   ASN  40           HA       ASN  40  -0.698  -3.627  -5.461
  310    HB2  ASN  40           2HB      ASN  40  -0.894  -3.720  -2.587
  311    HB3  ASN  40           1HB      ASN  40  -1.604  -4.785  -3.786
  312   HD21  ASN  40          1HD2      ASN  40  -1.153  -6.123  -1.717
  313   HD22  ASN  40          2HD2      ASN  40   0.325  -7.010  -1.731
  314    H    VAL  41           H        VAL  41   1.498  -2.081  -3.252
  315    HA   VAL  41           HA       VAL  41  -0.334   0.048  -2.751
  316    HB   VAL  41           HB       VAL  41   1.721  -0.862  -1.242
  317   HG11  VAL  41          1HG1      VAL  41   3.251   0.511  -2.846
  318   HG12  VAL  41          2HG1      VAL  41   3.472   0.671  -1.108
  319   HG13  VAL  41          3HG1      VAL  41   2.587   1.903  -2.004
  320   HG21  VAL  41          3HG2      VAL  41   0.801   0.527   0.273
  321   HG22  VAL  41          1HG2      VAL  41  -0.412   0.755  -0.985
  322   HG23  VAL  41          2HG2      VAL  41   0.890   1.929  -0.787
  323    H    SER  42           H        SER  42   2.125  -0.376  -5.187
  324    HA   SER  42           HA       SER  42   1.577   1.646  -6.779
  325    HB2  SER  42           2HB      SER  42   1.432   3.581  -5.503
  326    HB3  SER  42           1HB      SER  42   2.412   2.925  -4.178
  327    HG   SER  42           HG       SER  42   3.572   4.550  -5.146
  328    H    ARG  43           H        ARG  43   4.851   2.297  -5.284
  329    HA   ARG  43           HA       ARG  43   6.897   1.595  -5.923
  330    HB2  ARG  43           2HB      ARG  43   6.918  -0.621  -6.051
  331    HB3  ARG  43           1HB      ARG  43   5.242  -0.660  -6.559
  332    HG2  ARG  43           2HG      ARG  43   7.438  -0.114  -8.525
  333    HG3  ARG  43           1HG      ARG  43   7.021  -1.753  -8.044
  334    HD2  ARG  43           2HD      ARG  43   4.731  -1.415  -8.784
  335    HD3  ARG  43           1HD      ARG  43   5.104   0.250  -9.223
  336    HE   ARG  43           HE       ARG  43   6.757  -1.711 -10.530
  337   HH11  ARG  43          1HH1      ARG  43   3.770   0.088 -10.678
  338   HH12  ARG  43          2HH1      ARG  43   3.625  -0.054 -12.397
  339   HH21  ARG  43          1HH2      ARG  43   6.566  -1.898 -12.793
  340   HH22  ARG  43          2HH2      ARG  43   5.210  -1.183 -13.597
  341    H    ALA  44           H        ALA  44   4.504   2.268  -8.325
  342    HA   ALA  44           HA       ALA  44   5.634   2.304 -10.740
  343    HB1  ALA  44           1HB      ALA  44   3.608   3.268 -10.893
  344    HB2  ALA  44           2HB      ALA  44   4.518   4.777 -10.814
  345    HB3  ALA  44           3HB      ALA  44   3.775   4.118  -9.356
  346    H    GLY  45           H        GLY  45   8.132   2.476  -9.932
  347    HA2  GLY  45           2HA      GLY  45   9.275   4.734 -11.065
  348    HA3  GLY  45           1HA      GLY  45   9.080   5.095  -9.370
  349    H    VAL  46           H        VAL  46  10.331   2.420 -11.387
  350    HA   VAL  46           HA       VAL  46  12.738   2.412  -9.737
  351    HB   VAL  46           HB       VAL  46  11.262   0.758  -8.692
  352   HG11  VAL  46          1HG1      VAL  46  10.422  -1.152  -9.799
  353   HG12  VAL  46          2HG1      VAL  46  11.361  -0.820 -11.252
  354   HG13  VAL  46          3HG1      VAL  46  10.008   0.225 -10.817
  355   HG21  VAL  46          3HG2      VAL  46  12.904  -1.299  -9.472
  356   HG22  VAL  46          1HG2      VAL  46  13.266  -0.110  -8.223
  357   HG23  VAL  46          2HG2      VAL  46  13.858   0.131  -9.866
  358    H    SER  47           H        SER  47  12.792   3.450 -12.216
  359    HA   SER  47           HA       SER  47  14.656   1.745 -13.570
  360    HB2  SER  47           2HB      SER  47  13.448   1.112 -15.485
  361    HB3  SER  47           1HB      SER  47  12.285   0.840 -14.189
  362    HG   SER  47           HG       SER  47  11.051   2.353 -14.982
  363    H    GLY  48           H        GLY  48  12.206   4.473 -14.389
  364    HA2  GLY  48           2HA      GLY  48  14.134   5.765 -16.052
  365    HA3  GLY  48           1HA      GLY  48  12.621   6.444 -15.475
  366    H    CYS  49           H        CYS  49  14.022   5.506 -12.717
  367    HA   CYS  49           HA       CYS  49  15.263   6.483 -11.079
  368    HB2  CYS  49           2HB      CYS  49  16.387   8.382 -13.137
  369    HB3  CYS  49           1HB      CYS  49  17.107   7.889 -11.607
  370    HG   CYS  49           HG       CYS  49  17.718   5.622 -12.641
  371    H    PHE  50           H        PHE  50  12.615   7.398 -11.905
  372    HA   PHE  50           HA       PHE  50  12.407  10.221 -11.781
  373    HB2  PHE  50           2HB      PHE  50  10.640   7.991 -11.976
  374    HB3  PHE  50           1HB      PHE  50  10.091   8.961 -10.614
  375    HD1  PHE  50           2HD      PHE  50   9.854  11.505 -11.042
  376    HD2  PHE  50           1HD      PHE  50  10.028   8.573 -14.122
  377    HE1  PHE  50           2HE      PHE  50   8.779  13.081 -12.597
  378    HE2  PHE  50           1HE      PHE  50   8.954  10.143 -15.684
  379    HZ   PHE  50           HZ       PHE  50   8.328  12.400 -14.923
  380    H    SER  51           H        SER  51  11.897   7.695  -9.149
  381    HA   SER  51           HA       SER  51  12.217   7.851  -6.909
  382    HB2  SER  51           2HB      SER  51  14.320   9.127  -7.626
  383    HB3  SER  51           1HB      SER  51  13.409  10.598  -7.284
  384    HG   SER  51           HG       SER  51  13.498  10.190  -5.197
  385    H    THR  52           H        THR  52   9.843   8.845  -8.283
  386    HA   THR  52           HA       THR  52   8.853  11.208  -7.178
  387    HB   THR  52           HB       THR  52   6.590  10.204  -7.654
  388    HG1  THR  52           1HG      THR  52   6.448   8.178  -8.375
  389   HG21  THR  52          3HG2      THR  52   6.990  11.148  -9.618
  390   HG22  THR  52          1HG2      THR  52   7.502   9.554 -10.173
  391   HG23  THR  52          2HG2      THR  52   8.696  10.704  -9.572
  392    H    PHE  53           H        PHE  53   8.869   7.919  -5.944
  393    HA   PHE  53           HA       PHE  53   8.382   8.909  -3.269
  394    HB2  PHE  53           2HB      PHE  53   6.474   7.287  -2.923
  395    HB3  PHE  53           1HB      PHE  53   6.094   8.676  -3.932
  396    HD1  PHE  53           2HD      PHE  53   7.003   5.081  -4.051
  397    HD2  PHE  53           1HD      PHE  53   5.306   8.390  -6.115
  398    HE1  PHE  53           2HE      PHE  53   6.247   3.572  -5.819
  399    HE2  PHE  53           1HE      PHE  53   4.534   6.876  -7.898
  400    HZ   PHE  53           HZ       PHE  53   5.001   4.461  -7.744
  401    H    GLN  54           H        GLN  54  10.714   7.839  -4.016
  402    HA   GLN  54           HA       GLN  54  11.367   5.269  -4.193
  403    HB2  GLN  54           2HB      GLN  54  12.806   7.362  -3.654
  404    HB3  GLN  54           1HB      GLN  54  12.644   6.851  -1.984
  405    HG2  GLN  54           2HG      GLN  54  13.585   4.622  -2.720
  406    HG3  GLN  54           1HG      GLN  54  13.981   5.406  -4.250
  407   HE21  GLN  54          1HE2      GLN  54  14.862   7.821  -3.559
  408   HE22  GLN  54          2HE2      GLN  54  16.268   7.710  -2.562
  409    HA   PRO  55           HA       PRO  55   9.213   3.238  -0.785
  410    HB2  PRO  55           2HB      PRO  55  10.671   0.815  -1.449
  411    HB3  PRO  55           1HB      PRO  55   8.947   1.155  -1.572
  412    HG2  PRO  55           2HG      PRO  55  10.582   0.872  -3.739
  413    HG3  PRO  55           1HG      PRO  55   9.089   1.825  -3.742
  414    HD2  PRO  55           2HD      PRO  55  11.923   2.729  -3.598
  415    HD3  PRO  55           1HD      PRO  55  10.522   3.498  -4.377
  416    H    THR  56           H        THR  56  12.620   3.506  -1.210
  417    HA   THR  56           HA       THR  56  13.655   2.118   0.965
  418    HB   THR  56           HB       THR  56  14.473   4.854  -0.094
  419    HG1  THR  56           1HG      THR  56  15.915   3.665  -1.334
  420   HG21  THR  56          3HG2      THR  56  16.244   4.888   1.239
  421   HG22  THR  56          1HG2      THR  56  16.579   3.175   0.971
  422   HG23  THR  56          2HG2      THR  56  15.413   3.665   2.202
  423    H    THR  57           H        THR  57  12.130   5.444   0.882
  424    HA   THR  57           HA       THR  57  12.592   6.105   3.550
  425    HB   THR  57           HB       THR  57  11.807   7.801   2.088
  426    HG1  THR  57           1HG      THR  57  10.377   8.673   3.398
  427   HG21  THR  57          3HG2      THR  57  10.456   7.316   0.405
  428   HG22  THR  57          1HG2      THR  57   9.125   7.304   1.560
  429   HG23  THR  57          2HG2      THR  57   9.956   5.803   1.159
  430    H    GLY  58           H        GLY  58  10.308   3.879   2.140
  431    HA2  GLY  58           2HA      GLY  58   9.526   2.147   3.759
  432    HA3  GLY  58           1HA      GLY  58   9.186   3.477   4.837
  433    H    HIS  59           H        HIS  59   7.911   1.852   1.839
  434    HA   HIS  59           HA       HIS  59   5.733   3.724   1.734
  435    HB2  HIS  59           2HB      HIS  59   6.713   1.526   0.080
  436    HB3  HIS  59           1HB      HIS  59   4.961   1.524   0.222
  437    HD1  HIS  59           1HD      HIS  59   7.213   4.548  -0.020
  438    HD2  HIS  59           2HD      HIS  59   4.264   2.611  -2.234
  439    HE1  HIS  59           1HE      HIS  59   6.715   6.056  -1.963
  440    HE2  HIS  59           2HE      HIS  59   4.819   4.941  -3.177
  441    H    ARG  60           H        ARG  60   3.675   3.414   2.311
  442    HA   ARG  60           HA       ARG  60   3.103   1.216   4.203
  443    HB2  ARG  60           2HB      ARG  60   1.859   2.731   5.486
  444    HB3  ARG  60           1HB      ARG  60   3.215   3.696   4.942
  445    HG2  ARG  60           2HG      ARG  60   0.570   3.711   3.524
  446    HG3  ARG  60           1HG      ARG  60   0.956   4.797   4.858
  447    HD2  ARG  60           2HD      ARG  60   3.106   5.251   3.393
  448    HD3  ARG  60           1HD      ARG  60   2.036   4.725   2.093
  449    HE   ARG  60           HE       ARG  60   1.055   6.769   2.218
  450   HH11  ARG  60          1HH1      ARG  60   2.411   6.046   5.355
  451   HH12  ARG  60          2HH1      ARG  60   1.896   7.543   6.058
  452   HH21  ARG  60          1HH2      ARG  60   0.380   8.734   3.144
  453   HH22  ARG  60          2HH2      ARG  60   0.743   9.067   4.803
  454    H    LEU  61           H        LEU  61   0.563   0.797   4.239
  455    HA   LEU  61           HA       LEU  61  -0.395   0.639   1.450
  456    HB2  LEU  61           2HB      LEU  61  -0.001  -1.267   3.489
  457    HB3  LEU  61           1HB      LEU  61  -1.727  -1.083   3.401
  458    HG   LEU  61           HG       LEU  61  -0.078  -2.757   1.870
  459   HD11  LEU  61          1HD1      LEU  61  -2.122  -3.503   2.584
  460   HD12  LEU  61          2HD1      LEU  61  -2.284  -3.359   0.843
  461   HD13  LEU  61          3HD1      LEU  61  -2.975  -2.126   1.907
  462   HD21  LEU  61          3HD2      LEU  61   0.406  -1.312   0.183
  463   HD22  LEU  61          1HD2      LEU  61  -1.160  -0.510   0.273
  464   HD23  LEU  61          2HD2      LEU  61  -1.034  -2.137  -0.397
  465    H    CYS  62           H        CYS  62  -2.957   0.887   1.230
  466    HA   CYS  62           HA       CYS  62  -3.925   2.353   3.530
  467    HB2  CYS  62           2HB      CYS  62  -4.414   4.187   2.378
  468    HB3  CYS  62           1HB      CYS  62  -3.256   3.518   1.264
  469    H    SER  63           H        SER  63  -6.462   2.698   3.305
  470    HA   SER  63           HA       SER  63  -7.537   0.738   4.572
  471    HB2  SER  63           2HB      SER  63  -8.450   3.126   3.381
  472    HB3  SER  63           1HB      SER  63  -9.714   1.919   3.206
  473    HG   SER  63           HG       SER  63  -9.265   1.485   5.532
  474    H    VAL  64           H        VAL  64  -9.333   1.149   1.720
  475    HA   VAL  64           HA       VAL  64 -10.514  -1.381   2.031
  476    HB   VAL  64           HB       VAL  64 -11.721  -0.848  -0.111
  477   HG11  VAL  64          1HG1      VAL  64 -13.122  -0.185   1.495
  478   HG12  VAL  64          2HG1      VAL  64 -12.482   1.440   1.251
  479   HG13  VAL  64          3HG1      VAL  64 -11.802   0.404   2.505
  480   HG21  VAL  64          3HG2      VAL  64 -10.920   0.756  -1.397
  481   HG22  VAL  64          1HG2      VAL  64  -9.596   1.017  -0.257
  482   HG23  VAL  64          2HG2      VAL  64 -11.110   1.911  -0.076
  483    H    HIS  65           H        HIS  65  -7.730  -1.949   1.237
  484    HA   HIS  65           HA       HIS  65  -8.473  -3.608  -1.112
  485    HB2  HIS  65           2HB      HIS  65  -5.729  -3.407  -1.270
  486    HB3  HIS  65           1HB      HIS  65  -6.914  -2.615  -2.278
  487    HD1  HIS  65           1HD      HIS  65  -7.900  -0.412  -0.575
  488    HD2  HIS  65           2HD      HIS  65  -3.914  -1.506  -0.765
  489    HE1  HIS  65           1HE      HIS  65  -6.634   1.542   0.286
  490    H    PHE  66           H        PHE  66  -8.858  -4.325   1.557
  491    HA   PHE  66           HA       PHE  66  -6.895  -6.506   1.906
  492    HB2  PHE  66           2HB      PHE  66  -8.198  -4.649   3.803
  493    HB3  PHE  66           1HB      PHE  66  -8.057  -6.325   4.327
  494    HD1  PHE  66           1HD      PHE  66  -5.692  -7.396   3.984
  495    HD2  PHE  66           2HD      PHE  66  -6.457  -3.215   4.194
  496    HE1  PHE  66           1HE      PHE  66  -3.348  -7.000   4.606
  497    HE2  PHE  66           2HE      PHE  66  -4.112  -2.812   4.818
  498    HZ   PHE  66           HZ       PHE  66  -2.558  -4.707   5.024
  499    H    GLN  67           H        GLN  67  -8.397  -8.035   0.488
  500    HA   GLN  67           HA       GLN  67 -11.125  -8.242   0.945
  501    HB2  GLN  67           2HB      GLN  67  -9.300  -9.382  -0.733
  502    HB3  GLN  67           1HB      GLN  67  -9.771 -10.752   0.258
  503    HG2  GLN  67           2HG      GLN  67 -11.204 -10.771  -1.597
  504    HG3  GLN  67           1HG      GLN  67 -12.162 -10.158  -0.251
  505   HE21  GLN  67          1HE2      GLN  67 -11.754  -9.791  -3.391
  506   HE22  GLN  67          2HE2      GLN  67 -12.078  -8.105  -3.577
  507    H    GLY  68           H        GLY  68 -11.857  -8.726   3.339
  508    HA2  GLY  68           2HA      GLY  68 -11.815  -9.797   5.353
  509    HA3  GLY  68           1HA      GLY  68 -11.939 -11.196   4.299
  510    H    GLY  69           H        GLY  69 -10.865 -12.026   6.463
  511    HA2  GLY  69           2HA      GLY  69  -9.031 -13.186   7.172
  512    HA3  GLY  69           1HA      GLY  69  -8.124 -12.564   5.814
  513    H    ARG  70           H        ARG  70  -7.423 -10.068   6.144
  514    HA   ARG  70           HA       ARG  70  -6.401  -8.499   7.404
  515    HB2  ARG  70           2HB      ARG  70  -7.280  -7.924   9.417
  516    HB3  ARG  70           1HB      ARG  70  -8.526  -9.067   8.957
  517    HG2  ARG  70           2HG      ARG  70  -8.175  -9.996  10.946
  518    HG3  ARG  70           1HG      ARG  70  -6.698 -10.663  10.257
  519    HD2  ARG  70           2HD      ARG  70  -6.034  -9.611  12.254
  520    HD3  ARG  70           1HD      ARG  70  -5.569  -8.500  10.968
  521    HE   ARG  70           HE       ARG  70  -7.102  -6.982  11.753
  522   HH11  ARG  70          1HH1      ARG  70  -7.650 -10.068  13.286
  523   HH12  ARG  70          2HH1      ARG  70  -8.773  -9.436  14.441
  524   HH21  ARG  70          1HH2      ARG  70  -8.578  -6.148  13.272
  525   HH22  ARG  70          2HH2      ARG  70  -9.301  -7.210  14.433
  526    H    LYS  71           H        LYS  71  -5.293 -10.927   6.556
  527    HA   LYS  71           HA       LYS  71  -3.253 -11.899   6.595
  528    HB2  LYS  71           2HB      LYS  71  -2.928  -9.787   8.510
  529    HB3  LYS  71           1HB      LYS  71  -2.083 -11.220   9.065
  530    HG2  LYS  71           2HG      LYS  71  -0.511 -11.049   7.475
  531    HG3  LYS  71           1HG      LYS  71  -1.694 -10.649   6.231
  532    HD2  LYS  71           2HD      LYS  71  -0.588  -8.761   8.302
  533    HD3  LYS  71           1HD      LYS  71  -0.175  -8.790   6.590
  534    HE2  LYS  71           2HE      LYS  71  -2.846  -8.585   6.383
  535    HE3  LYS  71           1HE      LYS  71  -2.604  -7.803   7.942
  536    HZ1  LYS  71           3HZ      LYS  71  -0.826  -6.464   6.765
  537    HZ2  LYS  71           1HZ      LYS  71  -2.440  -6.084   6.443
  538    HZ3  LYS  71           2HZ      LYS  71  -1.546  -6.987   5.326
  539    H    THR  72           H        THR  72  -3.977 -13.908   6.729
  540    HA   THR  72           HA       THR  72  -3.778 -15.226   9.323
  541    HB   THR  72           HB       THR  72  -5.844 -16.477   8.988
  542    HG1  THR  72           1HG      THR  72  -6.275 -14.832   6.721
  543   HG21  THR  72          3HG2      THR  72  -7.180 -14.929   9.865
  544   HG22  THR  72          1HG2      THR  72  -6.986 -13.841   8.491
  545   HG23  THR  72          2HG2      THR  72  -5.771 -13.871   9.771
  546    H    TYR  73           H        TYR  73  -4.738 -16.071   5.973
  547    HA   TYR  73           HA       TYR  73  -2.356 -17.675   5.662
  548    HB2  TYR  73           2HB      TYR  73  -4.024 -19.630   4.909
  549    HB3  TYR  73           1HB      TYR  73  -3.381 -19.504   6.541
  550    HD1  TYR  73           1HD      TYR  73  -4.831 -18.316   8.295
  551    HD2  TYR  73           2HD      TYR  73  -6.333 -19.633   4.539
  552    HE1  TYR  73           1HE      TYR  73  -7.118 -18.245   9.191
  553    HE2  TYR  73           2HE      TYR  73  -8.625 -19.564   5.427
  554    HH   TYR  73           HH       TYR  73  -9.624 -19.758   7.962
  555    H    THR  74           H        THR  74  -5.584 -17.564   4.179
  556    HA   THR  74           HA       THR  74  -4.659 -17.808   1.537
  557    HB   THR  74           HB       THR  74  -7.140 -16.381   1.578
  558    HG1  THR  74           1HG      THR  74  -8.113 -17.114   3.272
  559   HG21  THR  74          3HG2      THR  74  -6.718 -19.343   1.285
  560   HG22  THR  74          1HG2      THR  74  -6.472 -18.172  -0.011
  561   HG23  THR  74          2HG2      THR  74  -8.075 -18.382   0.692
  562    H    VAL  75           H        VAL  75  -5.703 -14.972   3.363
  563    HA   VAL  75           HA       VAL  75  -5.055 -13.120   1.262
  564    HB   VAL  75           HB       VAL  75  -6.865 -12.970   3.113
  565   HG11  VAL  75          1HG1      VAL  75  -5.046 -13.319   4.890
  566   HG12  VAL  75          2HG1      VAL  75  -6.384 -12.217   5.209
  567   HG13  VAL  75          3HG1      VAL  75  -4.809 -11.577   4.742
  568   HG21  VAL  75          3HG2      VAL  75  -5.257 -10.445   2.745
  569   HG22  VAL  75          1HG2      VAL  75  -6.980 -10.600   3.070
  570   HG23  VAL  75          2HG2      VAL  75  -6.337 -11.109   1.514
  571    H    ARG  76           H        ARG  76  -2.777 -13.292   0.824
  572    HA   ARG  76           HA       ARG  76  -0.992 -12.777   3.099
  573    HB2  ARG  76           2HB      ARG  76  -0.803 -14.391   0.717
  574    HB3  ARG  76           1HB      ARG  76   0.521 -13.237   0.758
  575    HG2  ARG  76           2HG      ARG  76   1.206 -14.032   2.927
  576    HG3  ARG  76           1HG      ARG  76  -0.186 -15.113   3.003
  577    HD2  ARG  76           2HD      ARG  76   2.011 -15.250   0.940
  578    HD3  ARG  76           1HD      ARG  76   1.900 -16.275   2.370
  579    HE   ARG  76           HE       ARG  76  -0.441 -16.355   0.702
  580   HH11  ARG  76          1HH1      ARG  76   2.730 -17.707   1.252
  581   HH12  ARG  76          2HH1      ARG  76   2.370 -19.198   0.449
  582   HH21  ARG  76          1HH2      ARG  76  -0.914 -18.318  -0.354
  583   HH22  ARG  76          2HH2      ARG  76   0.302 -19.546  -0.462
  584    H    VAL  77           H        VAL  77  -1.651 -11.641  -0.226
  585    HA   VAL  77           HA       VAL  77  -0.490  -9.061   0.575
  586    HB   VAL  77           HB       VAL  77   0.642  -8.792  -1.511
  587   HG11  VAL  77          1HG1      VAL  77   2.300 -10.192  -1.052
  588   HG12  VAL  77          2HG1      VAL  77   1.316 -11.608  -1.420
  589   HG13  VAL  77          3HG1      VAL  77   1.249 -10.881   0.184
  590   HG21  VAL  77          3HG2      VAL  77  -1.259 -10.838  -2.444
  591   HG22  VAL  77          1HG2      VAL  77   0.362 -10.907  -3.132
  592   HG23  VAL  77          2HG2      VAL  77  -0.589  -9.432  -3.271
  593    HA   PRO  78           HA       PRO  78  -4.606  -7.427  -0.425
  594    HB2  PRO  78           2HB      PRO  78  -2.843  -5.029  -0.693
  595    HB3  PRO  78           1HB      PRO  78  -4.396  -5.169   0.120
  596    HG2  PRO  78           2HG      PRO  78  -2.306  -5.168   1.624
  597    HG3  PRO  78           1HG      PRO  78  -3.439  -6.519   1.856
  598    HD2  PRO  78           2HD      PRO  78  -0.918  -6.441   0.235
  599    HD3  PRO  78           1HD      PRO  78  -1.383  -7.612   1.505
  600    H    THR  79           H        THR  79  -4.352  -8.654  -2.776
  601    HA   THR  79           HA       THR  79  -3.960  -6.317  -4.537
  602    HB   THR  79           HB       THR  79  -2.909  -7.660  -6.023
  603    HG1  THR  79           1HG      THR  79  -4.871  -8.414  -6.825
  604   HG21  THR  79          3HG2      THR  79  -2.206  -9.909  -5.375
  605   HG22  THR  79          1HG2      THR  79  -3.260  -9.819  -3.963
  606   HG23  THR  79          2HG2      THR  79  -1.901  -8.707  -4.121
  607    H    ILE  80           H        ILE  80  -5.682  -5.379  -4.640
  608    HA   ILE  80           HA       ILE  80  -8.095  -6.552  -5.796
  609    HB   ILE  80           HB       ILE  80  -7.894  -4.953  -3.348
  610   HG12  ILE  80          2HG1      ILE  80  -9.954  -6.626  -4.745
  611   HG13  ILE  80          1HG1      ILE  80  -9.168  -6.900  -3.198
  612   HG21  ILE  80          1HG2      ILE  80 -10.207  -3.936  -4.822
  613   HG22  ILE  80          2HG2      ILE  80  -8.668  -3.356  -5.434
  614   HG23  ILE  80          3HG2      ILE  80  -9.089  -3.101  -3.750
  615   HD11  ILE  80          3HD1      ILE  80 -11.548  -6.330  -2.981
  616   HD12  ILE  80          1HD1      ILE  80 -11.230  -4.771  -3.737
  617   HD13  ILE  80          2HD1      ILE  80 -10.504  -5.157  -2.179
  618    H    PHE  81           H        PHE  81  -8.830  -5.130  -7.647
  619    HA   PHE  81           HA       PHE  81  -8.478  -3.573  -9.301
  620    HB2  PHE  81           2HB      PHE  81  -7.085  -1.482  -8.748
  621    HB3  PHE  81           1HB      PHE  81  -8.553  -1.708  -7.816
  622    HD1  PHE  81           1HD      PHE  81  -4.878  -2.479  -7.588
  623    HD2  PHE  81           2HD      PHE  81  -8.449  -1.373  -5.549
  624    HE1  PHE  81           1HE      PHE  81  -3.631  -2.372  -5.461
  625    HE2  PHE  81           2HE      PHE  81  -7.220  -1.263  -3.435
  626    HZ   PHE  81           HZ       PHE  81  -4.807  -1.807  -3.350
  Start of MODEL   16
    1    H1   GLY   1           1HT      GLY   1   5.639  15.648   8.316
    2    H2   GLY   1           2HT      GLY   1   6.434  14.437   9.189
    3    H3   GLY   1           3HT      GLY   1   4.785  14.717   9.442
    4    HA2  GLY   1           1HA      GLY   1   5.419  12.717   8.029
    5    HA3  GLY   1           2HA      GLY   1   4.155  13.782   7.436
    6    H    SER   2           H        SER   2   4.857  12.630   5.403
    7    HA   SER   2           HA       SER   2   7.048  14.143   4.138
    8    HB2  SER   2           2HB      SER   2   6.682  11.294   4.371
    9    HB3  SER   2           1HB      SER   2   6.662  11.763   2.671
   10    HG   SER   2           HG       SER   2   8.736  11.949   2.822
   11    HA   PRO   3           HA       PRO   3   4.283  15.293   0.902
   12    HB2  PRO   3           2HB      PRO   3   5.614  14.862  -1.403
   13    HB3  PRO   3           1HB      PRO   3   6.096  16.115  -0.252
   14    HG2  PRO   3           2HG      PRO   3   7.236  13.378  -0.662
   15    HG3  PRO   3           1HG      PRO   3   8.081  14.914  -0.400
   16    HD2  PRO   3           2HD      PRO   3   7.668  13.084   1.571
   17    HD3  PRO   3           1HD      PRO   3   7.792  14.827   1.877
   18    H    GLY   4           H        GLY   4   3.361  12.924   1.790
   19    HA2  GLY   4           2HA      GLY   4   2.105  11.102   1.236
   20    HA3  GLY   4           1HA      GLY   4   1.846  11.930  -0.296
   21    H    PHE   5           H        PHE   5   1.833   9.308  -0.706
   22    HA   PHE   5           HA       PHE   5   4.354   8.821  -2.037
   23    HB2  PHE   5           2HB      PHE   5   3.646   6.449  -0.480
   24    HB3  PHE   5           1HB      PHE   5   5.207   7.207  -0.748
   25    HD1  PHE   5           2HD      PHE   5   5.950   9.063   0.693
   26    HD2  PHE   5           1HD      PHE   5   2.408   6.854   1.516
   27    HE1  PHE   5           2HE      PHE   5   5.963   9.905   3.004
   28    HE2  PHE   5           1HE      PHE   5   2.414   7.694   3.825
   29    HZ   PHE   5           HZ       PHE   5   4.194   9.221   4.573
   30    H    THR   6           H        THR   6   1.088   8.589  -2.259
   31    HA   THR   6           HA       THR   6  -0.401   7.599  -3.676
   32    HB   THR   6           HB       THR   6   2.019   6.708  -5.246
   33    HG1  THR   6           1HG      THR   6   0.678   9.201  -5.381
   34   HG21  THR   6          3HG2      THR   6   0.515   5.979  -6.694
   35   HG22  THR   6          1HG2      THR   6   0.059   7.664  -6.955
   36   HG23  THR   6          2HG2      THR   6  -0.812   6.686  -5.773
   37    H    CYS   7           H        CYS   7  -1.545   5.860  -2.977
   38    HA   CYS   7           HA       CYS   7  -0.191   3.372  -2.296
   39    HB2  CYS   7           2HB      CYS   7  -1.905   3.756  -0.701
   40    HB3  CYS   7           1HB      CYS   7  -3.063   4.316  -1.897
   41    H    CYS   8           H        CYS   8  -0.913   4.654  -5.134
   42    HA   CYS   8           HA       CYS   8  -1.492   3.804  -7.182
   43    HB2  CYS   8           2HB      CYS   8   0.217   2.162  -6.830
   44    HB3  CYS   8           1HB      CYS   8  -0.749   1.280  -5.669
   45    HG   CYS   8           HG       CYS   8  -0.785   0.899  -8.676
   46    H    VAL   9           H        VAL   9  -3.204   4.329  -4.946
   47    HA   VAL   9           HA       VAL   9  -5.331   2.472  -4.736
   48    HB   VAL   9           HB       VAL   9  -4.989   3.834  -2.852
   49   HG11  VAL   9          1HG1      VAL   9  -5.236   6.485  -3.452
   50   HG12  VAL   9          2HG1      VAL   9  -4.332   5.859  -4.829
   51   HG13  VAL   9          3HG1      VAL   9  -3.724   5.617  -3.192
   52   HG21  VAL   9          3HG2      VAL   9  -7.454   3.882  -3.848
   53   HG22  VAL   9          1HG2      VAL   9  -7.112   5.608  -3.913
   54   HG23  VAL   9          2HG2      VAL   9  -7.008   4.750  -2.370
   55    HA   PRO  10           HA       PRO  10  -7.057   3.986  -8.664
   56    HB2  PRO  10           2HB      PRO  10  -8.600   1.814  -9.099
   57    HB3  PRO  10           1HB      PRO  10  -6.866   1.807  -9.440
   58    HG2  PRO  10           2HG      PRO  10  -8.325   0.744  -7.044
   59    HG3  PRO  10           1HG      PRO  10  -7.027  -0.007  -7.988
   60    HD2  PRO  10           2HD      PRO  10  -6.548   1.245  -5.634
   61    HD3  PRO  10           1HD      PRO  10  -5.386   1.232  -6.971
   62    H    GLY  11           H        GLY  11  -8.600   2.577  -5.863
   63    HA2  GLY  11           2HA      GLY  11 -10.480   4.662  -5.622
   64    HA3  GLY  11           1HA      GLY  11 -11.246   3.257  -6.348
   65    H    CYS  12           H        CYS  12  -8.655   2.722  -4.036
   66    HA   CYS  12           HA       CYS  12 -10.442   1.253  -2.423
   67    HB2  CYS  12           2HB      CYS  12  -8.306   1.647  -0.713
   68    HB3  CYS  12           1HB      CYS  12  -8.531   0.299  -1.796
   69    H    TYR  13           H        TYR  13  -8.937   2.765   0.075
   70    HA   TYR  13           HA       TYR  13 -11.308   4.384   0.522
   71    HB2  TYR  13           2HB      TYR  13 -10.529   2.622   2.154
   72    HB3  TYR  13           1HB      TYR  13  -9.238   3.739   2.569
   73    HD1  TYR  13           2HD      TYR  13 -11.825   5.848   1.766
   74    HD2  TYR  13           1HD      TYR  13 -10.763   3.053   4.794
   75    HE1  TYR  13           2HE      TYR  13 -13.331   6.982   3.339
   76    HE2  TYR  13           1HE      TYR  13 -12.267   4.179   6.371
   77    HH   TYR  13           HH       TYR  13 -13.282   6.416   6.667
   78    H    ASN  14           H        ASN  14  -7.908   4.591   1.127
   79    HA   ASN  14           HA       ASN  14  -7.970   7.501   0.864
   80    HB2  ASN  14           2HB      ASN  14  -5.779   6.659   2.405
   81    HB3  ASN  14           1HB      ASN  14  -7.126   7.646   2.907
   82   HD21  ASN  14          1HD2      ASN  14  -9.192   6.214   3.194
   83   HD22  ASN  14          2HD2      ASN  14  -8.966   4.802   4.163
   84    H    ASN  15           H        ASN  15  -5.816   8.509   0.046
   85    HA   ASN  15           HA       ASN  15  -4.537   6.522  -1.667
   86    HB2  ASN  15           2HB      ASN  15  -5.604   8.395  -2.856
   87    HB3  ASN  15           1HB      ASN  15  -4.612   9.538  -1.958
   88   HD21  ASN  15          1HD2      ASN  15  -4.955   8.275  -4.866
   89   HD22  ASN  15          2HD2      ASN  15  -3.316   8.253  -5.413
   90    H    SER  16           H        SER  16  -1.980   6.658  -1.835
   91    HA   SER  16           HA       SER  16  -0.875   7.144   0.700
   92    HB2  SER  16           2HB      SER  16  -0.007   5.259  -0.583
   93    HB3  SER  16           1HB      SER  16   0.281   6.264  -1.953
   94    HG   SER  16           HG       SER  16   1.711   7.405  -0.185
   95    H    HIS  17           H        HIS  17  -0.972   9.065  -2.319
   96    HA   HIS  17           HA       HIS  17   0.372  11.214  -0.854
   97    HB2  HIS  17           2HB      HIS  17   2.070  10.195  -2.338
   98    HB3  HIS  17           1HB      HIS  17   1.037  10.471  -3.719
   99    HD1  HIS  17           1HD      HIS  17   3.283  11.809  -4.495
  100    HD2  HIS  17           2HD      HIS  17   0.998  13.532  -1.482
  101    HE1  HIS  17           1HE      HIS  17   3.988  14.221  -4.412
  102    HE2  HIS  17           2HE      HIS  17   2.528  15.264  -2.643
  103    H    ARG  18           H        ARG  18  -2.388  11.051  -1.179
  104    HA   ARG  18           HA       ARG  18  -2.817  13.472  -2.733
  105    HB2  ARG  18           2HB      ARG  18  -4.733  11.185  -3.173
  106    HB3  ARG  18           1HB      ARG  18  -4.555  12.661  -4.100
  107    HG2  ARG  18           2HG      ARG  18  -2.404  10.577  -3.993
  108    HG3  ARG  18           1HG      ARG  18  -3.712  10.547  -5.175
  109    HD2  ARG  18           2HD      ARG  18  -2.493  13.161  -5.038
  110    HD3  ARG  18           1HD      ARG  18  -1.291  11.918  -5.371
  111    HE   ARG  18           HE       ARG  18  -2.328  11.468  -7.401
  112   HH11  ARG  18          1HH1      ARG  18  -4.138  13.854  -5.598
  113   HH12  ARG  18          2HH1      ARG  18  -5.094  14.334  -6.958
  114   HH21  ARG  18          1HH2      ARG  18  -3.589  12.103  -9.185
  115   HH22  ARG  18          2HH2      ARG  18  -4.783  13.341  -8.991
  116    H    ASP  19           H        ASP  19  -2.982  12.265   0.148
  117    HA   ASP  19           HA       ASP  19  -5.137  13.918   1.021
  118    HB2  ASP  19           2HB      ASP  19  -5.540  11.027   1.642
  119    HB3  ASP  19           1HB      ASP  19  -6.655  12.369   1.842
  120    H    LYS  20           H        LYS  20  -3.787  10.934   2.318
  121    HA   LYS  20           HA       LYS  20  -2.507  10.505   4.144
  122    HB2  LYS  20           2HB      LYS  20  -1.850  13.444   4.194
  123    HB3  LYS  20           1HB      LYS  20  -0.928  12.135   4.917
  124    HG2  LYS  20           2HG      LYS  20   0.185  11.764   3.033
  125    HG3  LYS  20           1HG      LYS  20  -1.302  11.717   2.083
  126    HD2  LYS  20           2HD      LYS  20  -0.703  14.416   2.907
  127    HD3  LYS  20           1HD      LYS  20   0.672  13.704   2.060
  128    HE2  LYS  20           2HE      LYS  20  -0.896  13.031   0.239
  129    HE3  LYS  20           1HE      LYS  20  -2.165  13.936   1.064
  130    HZ1  LYS  20           3HZ      LYS  20  -0.475  15.863   0.927
  131    HZ2  LYS  20           1HZ      LYS  20  -1.367  15.452  -0.452
  132    HZ3  LYS  20           2HZ      LYS  20   0.240  14.945  -0.300
  133    H    ALA  21           H        ALA  21  -5.359  11.902   4.267
  134    HA   ALA  21           HA       ALA  21  -5.219  12.593   7.127
  135    HB1  ALA  21           1HB      ALA  21  -7.224  13.280   5.002
  136    HB2  ALA  21           2HB      ALA  21  -6.161  14.363   5.901
  137    HB3  ALA  21           3HB      ALA  21  -7.509  13.571   6.718
  138    H    LEU  22           H        LEU  22  -5.690   9.768   5.632
  139    HA   LEU  22           HA       LEU  22  -7.930   9.021   7.387
  140    HB2  LEU  22           2HB      LEU  22  -7.275   7.618   4.773
  141    HB3  LEU  22           1HB      LEU  22  -8.741   7.459   5.738
  142    HG   LEU  22           HG       LEU  22  -9.018   8.707   3.627
  143   HD11  LEU  22          1HD1      LEU  22  -9.816   9.632   6.330
  144   HD12  LEU  22          2HD1      LEU  22 -10.788   8.942   5.031
  145   HD13  LEU  22          3HD1      LEU  22 -10.251  10.619   4.936
  146   HD21  LEU  22          3HD2      LEU  22  -8.184  10.738   3.236
  147   HD22  LEU  22          1HD2      LEU  22  -6.836  10.101   4.173
  148   HD23  LEU  22          2HD2      LEU  22  -8.031  11.154   4.935
  149    H    HIS  23           H        HIS  23  -7.150   5.919   6.849
  150    HA   HIS  23           HA       HIS  23  -5.070   5.970   8.842
  151    HB2  HIS  23           2HB      HIS  23  -7.441   4.497   8.482
  152    HB3  HIS  23           1HB      HIS  23  -6.135   3.347   8.236
  153    HD1  HIS  23           1HD      HIS  23  -8.167   3.571  10.747
  154    HD2  HIS  23           2HD      HIS  23  -4.165   4.684  10.629
  155    HE1  HIS  23           1HE      HIS  23  -7.381   3.510  13.135
  156    HE2  HIS  23           2HE      HIS  23  -4.977   4.261  13.048
  157    H    PHE  24           H        PHE  24  -3.113   4.537   8.605
  158    HA   PHE  24           HA       PHE  24  -2.796   3.500   5.902
  159    HB2  PHE  24           2HB      PHE  24  -0.738   5.088   7.435
  160    HB3  PHE  24           1HB      PHE  24  -0.402   4.210   5.951
  161    HD1  PHE  24           2HD      PHE  24  -2.451   6.938   7.380
  162    HD2  PHE  24           1HD      PHE  24  -0.888   5.151   3.849
  163    HE1  PHE  24           2HE      PHE  24  -3.207   8.872   6.059
  164    HE2  PHE  24           1HE      PHE  24  -1.630   7.075   2.532
  165    HZ   PHE  24           HZ       PHE  24  -2.803   8.931   3.631
  166    H    TYR  25           H        TYR  25  -1.531   1.495   5.733
  167    HA   TYR  25           HA       TYR  25  -1.046   0.163   8.284
  168    HB2  TYR  25           2HB      TYR  25  -1.650  -0.804   5.506
  169    HB3  TYR  25           1HB      TYR  25  -0.739  -1.852   6.588
  170    HD1  TYR  25           1HD      TYR  25  -3.758   0.346   6.877
  171    HD2  TYR  25           2HD      TYR  25  -2.014  -3.463   7.618
  172    HE1  TYR  25           1HE      TYR  25  -5.860  -0.411   7.906
  173    HE2  TYR  25           2HE      TYR  25  -4.110  -4.231   8.648
  174    HH   TYR  25           HH       TYR  25  -6.098  -3.212   9.758
  175    H    THR  26           H        THR  26   1.132  -1.074   8.465
  176    HA   THR  26           HA       THR  26   3.131   0.428   6.926
  177    HB   THR  26           HB       THR  26   4.405   0.545   8.788
  178    HG1  THR  26           1HG      THR  26   5.245  -1.206   9.559
  179   HG21  THR  26          3HG2      THR  26   2.039   0.892   9.684
  180   HG22  THR  26          1HG2      THR  26   3.332   0.582  10.843
  181   HG23  THR  26          2HG2      THR  26   2.220  -0.711  10.395
  182    H    PHE  27           H        PHE  27   5.306  -0.856   6.675
  183    HA   PHE  27           HA       PHE  27   4.679  -3.030   4.994
  184    HB2  PHE  27           2HB      PHE  27   6.631  -1.101   5.222
  185    HB3  PHE  27           1HB      PHE  27   7.483  -2.620   5.272
  186    HD1  PHE  27           1HD      PHE  27   4.475  -2.777   3.343
  187    HD2  PHE  27           2HD      PHE  27   8.563  -1.588   3.198
  188    HE1  PHE  27           1HE      PHE  27   4.429  -2.864   0.904
  189    HE2  PHE  27           2HE      PHE  27   8.509  -1.696   0.757
  190    HZ   PHE  27           HZ       PHE  27   6.431  -2.333  -0.404
  191    HA   PRO  28           HA       PRO  28   5.379  -6.553   7.816
  192    HB2  PRO  28           2HB      PRO  28   6.624  -7.491   5.211
  193    HB3  PRO  28           1HB      PRO  28   5.712  -8.460   6.363
  194    HG2  PRO  28           2HG      PRO  28   4.490  -7.541   4.260
  195    HG3  PRO  28           1HG      PRO  28   3.691  -7.369   5.829
  196    HD2  PRO  28           2HD      PRO  28   4.969  -5.319   4.123
  197    HD3  PRO  28           1HD      PRO  28   3.642  -5.161   5.264
  198    H    LYS  29           H        LYS  29   7.394  -7.933   8.487
  199    HA   LYS  29           HA       LYS  29   9.683  -6.161   8.648
  200    HB2  LYS  29           2HB      LYS  29  10.369  -8.545   9.929
  201    HB3  LYS  29           1HB      LYS  29   9.803  -7.064  10.684
  202    HG2  LYS  29           2HG      LYS  29   7.522  -7.866  10.627
  203    HG3  LYS  29           1HG      LYS  29   8.031  -9.318   9.763
  204    HD2  LYS  29           2HD      LYS  29   8.979  -8.535  12.518
  205    HD3  LYS  29           1HD      LYS  29   7.684  -9.689  12.191
  206    HE2  LYS  29           2HE      LYS  29   9.339 -11.008  10.840
  207    HE3  LYS  29           1HE      LYS  29  10.593  -9.928  11.446
  208    HZ1  LYS  29           3HZ      LYS  29  10.162 -10.638  13.665
  209    HZ2  LYS  29           1HZ      LYS  29  10.353 -12.026  12.717
  210    HZ3  LYS  29           2HZ      LYS  29   8.807 -11.532  13.192
  211    H    ASP  30           H        ASP  30   8.730  -8.890   6.835
  212    HA   ASP  30           HA       ASP  30  11.414  -9.746   6.160
  213    HB2  ASP  30           2HB      ASP  30   9.398 -10.695   4.334
  214    HB3  ASP  30           1HB      ASP  30  10.351 -11.637   5.468
  215    H    ALA  31           H        ALA  31  12.650  -8.538   4.774
  216    HA   ALA  31           HA       ALA  31  11.882  -6.386   3.361
  217    HB1  ALA  31           1HB      ALA  31  13.910  -7.083   1.802
  218    HB2  ALA  31           2HB      ALA  31  14.154  -8.271   3.086
  219    HB3  ALA  31           3HB      ALA  31  14.121  -6.557   3.466
  220    H    GLU  32           H        GLU  32  12.308  -9.542   1.529
  221    HA   GLU  32           HA       GLU  32  11.162  -8.601  -0.831
  222    HB2  GLU  32           2HB      GLU  32  12.247 -10.679  -0.894
  223    HB3  GLU  32           1HB      GLU  32  11.293 -11.400   0.340
  224    HG2  GLU  32           2HG      GLU  32  10.114 -10.553  -2.287
  225    HG3  GLU  32           1HG      GLU  32  10.899 -12.116  -2.074
  226    H    LEU  33           H        LEU  33   9.148 -10.544   1.555
  227    HA   LEU  33           HA       LEU  33   6.831 -10.255   0.249
  228    HB2  LEU  33           2HB      LEU  33   7.277 -11.029   2.700
  229    HB3  LEU  33           1HB      LEU  33   6.939  -9.378   3.126
  230    HG   LEU  33           HG       LEU  33   4.777  -9.773   3.138
  231   HD11  LEU  33          1HD1      LEU  33   4.701  -9.294   0.755
  232   HD12  LEU  33          2HD1      LEU  33   3.545 -10.556   1.165
  233   HD13  LEU  33          3HD1      LEU  33   5.066 -10.975   0.387
  234   HD21  LEU  33          3HD2      LEU  33   5.770 -12.510   2.564
  235   HD22  LEU  33          1HD2      LEU  33   4.039 -12.199   2.637
  236   HD23  LEU  33          2HD2      LEU  33   5.051 -11.859   4.037
  237    H    ARG  34           H        ARG  34   8.590  -7.778   1.868
  238    HA   ARG  34           HA       ARG  34   6.732  -5.672   1.701
  239    HB2  ARG  34           2HB      ARG  34   8.331  -4.259   2.542
  240    HB3  ARG  34           1HB      ARG  34   8.998  -5.797   3.044
  241    HG2  ARG  34           2HG      ARG  34  10.900  -5.236   2.066
  242    HG3  ARG  34           1HG      ARG  34  10.097  -5.192   0.506
  243    HD2  ARG  34           2HD      ARG  34   9.942  -2.942   0.495
  244    HD3  ARG  34           1HD      ARG  34   9.736  -2.843   2.243
  245    HE   ARG  34           HE       ARG  34  12.326  -3.655   1.869
  246   HH11  ARG  34          1HH1      ARG  34  10.407  -0.912   0.885
  247   HH12  ARG  34          2HH1      ARG  34  11.752   0.176   0.852
  248   HH21  ARG  34          1HH2      ARG  34  14.096  -2.227   1.828
  249   HH22  ARG  34          2HH2      ARG  34  13.849  -0.571   1.385
  250    H    ARG  35           H        ARG  35   9.507  -6.334  -0.370
  251    HA   ARG  35           HA       ARG  35   8.882  -4.333  -2.177
  252    HB2  ARG  35           2HB      ARG  35  10.431  -5.249  -3.667
  253    HB3  ARG  35           1HB      ARG  35  11.044  -5.681  -2.085
  254    HG2  ARG  35           2HG      ARG  35  11.358  -7.527  -3.525
  255    HG3  ARG  35           1HG      ARG  35  10.068  -7.962  -2.419
  256    HD2  ARG  35           2HD      ARG  35   8.614  -8.227  -4.105
  257    HD3  ARG  35           1HD      ARG  35   9.061  -6.681  -4.821
  258    HE   ARG  35           HE       ARG  35  10.595  -7.763  -6.181
  259   HH11  ARG  35          1HH1      ARG  35   9.162 -10.017  -3.926
  260   HH12  ARG  35          2HH1      ARG  35   9.742 -11.414  -4.766
  261   HH21  ARG  35          1HH2      ARG  35  11.355  -9.602  -7.280
  262   HH22  ARG  35          2HH2      ARG  35  10.986 -11.180  -6.669
  263    H    LEU  36           H        LEU  36   7.555  -7.582  -1.723
  264    HA   LEU  36           HA       LEU  36   6.202  -7.626  -4.272
  265    HB2  LEU  36           2HB      LEU  36   5.603  -8.933  -1.642
  266    HB3  LEU  36           1HB      LEU  36   4.443  -9.005  -2.946
  267    HG   LEU  36           HG       LEU  36   7.254 -10.097  -2.969
  268   HD11  LEU  36          1HD1      LEU  36   4.534 -11.386  -2.986
  269   HD12  LEU  36          2HD1      LEU  36   5.778 -11.515  -1.742
  270   HD13  LEU  36          3HD1      LEU  36   6.036 -12.245  -3.328
  271   HD21  LEU  36          3HD2      LEU  36   5.216  -9.819  -5.159
  272   HD22  LEU  36          1HD2      LEU  36   6.505 -11.019  -5.214
  273   HD23  LEU  36          2HD2      LEU  36   6.902  -9.302  -5.156
  274    H    TRP  37           H        TRP  37   5.207  -6.332  -1.146
  275    HA   TRP  37           HA       TRP  37   2.705  -5.434  -2.050
  276    HB2  TRP  37           2HB      TRP  37   4.582  -4.630   0.159
  277    HB3  TRP  37           1HB      TRP  37   3.135  -3.675  -0.171
  278    HD1  TRP  37           HD       TRP  37   3.188  -7.459  -0.516
  279    HE1  TRP  37           1HE      TRP  37   1.582  -8.465   1.291
  280    HE3  TRP  37           3HE      TRP  37   2.101  -3.190   1.998
  281    HZ2  TRP  37           2HZ      TRP  37  -0.046  -7.443   3.457
  282    HZ3  TRP  37           3HZ      TRP  37   0.525  -3.246   3.851
  283    HH2  TRP  37           HH       TRP  37  -0.538  -5.278   4.550
  284    H    LEU  38           H        LEU  38   6.009  -3.962  -2.117
  285    HA   LEU  38           HA       LEU  38   5.534  -1.385  -2.803
  286    HB2  LEU  38           2HB      LEU  38   7.463  -3.341  -4.065
  287    HB3  LEU  38           1HB      LEU  38   7.411  -1.673  -4.514
  288    HG   LEU  38           HG       LEU  38   8.099  -2.788  -1.815
  289   HD11  LEU  38          1HD1      LEU  38   9.728  -2.513  -3.885
  290   HD12  LEU  38          2HD1      LEU  38  10.246  -2.157  -2.238
  291   HD13  LEU  38          3HD1      LEU  38   9.765  -0.845  -3.315
  292   HD21  LEU  38          3HD2      LEU  38   7.733   0.101  -2.596
  293   HD22  LEU  38          1HD2      LEU  38   8.326  -0.495  -1.046
  294   HD23  LEU  38          2HD2      LEU  38   6.667  -0.820  -1.537
  295    H    LYS  39           H        LYS  39   5.334  -4.272  -5.033
  296    HA   LYS  39           HA       LYS  39   4.525  -3.016  -7.308
  297    HB2  LYS  39           2HB      LYS  39   4.353  -5.686  -6.100
  298    HB3  LYS  39           1HB      LYS  39   3.179  -5.404  -7.359
  299    HG2  LYS  39           2HG      LYS  39   5.551  -6.424  -7.819
  300    HG3  LYS  39           1HG      LYS  39   4.762  -5.362  -8.991
  301    HD2  LYS  39           2HD      LYS  39   6.404  -3.985  -6.974
  302    HD3  LYS  39           1HD      LYS  39   7.299  -5.050  -8.055
  303    HE2  LYS  39           2HE      LYS  39   5.342  -3.410  -9.453
  304    HE3  LYS  39           1HE      LYS  39   6.541  -2.452  -8.585
  305    HZ1  LYS  39           3HZ      LYS  39   7.767  -2.784 -10.411
  306    HZ2  LYS  39           1HZ      LYS  39   6.854  -4.113 -10.926
  307    HZ3  LYS  39           2HZ      LYS  39   8.068  -4.318  -9.766
  308    H    ASN  40           H        ASN  40   2.227  -4.515  -5.032
  309    HA   ASN  40           HA       ASN  40  -0.058  -3.554  -6.324
  310    HB2  ASN  40           2HB      ASN  40  -0.677  -3.863  -3.569
  311    HB3  ASN  40           1HB      ASN  40  -1.048  -4.943  -4.896
  312   HD21  ASN  40          1HD2      ASN  40  -0.398  -5.417  -2.102
  313   HD22  ASN  40          2HD2      ASN  40   0.939  -6.502  -2.116
  314    H    VAL  41           H        VAL  41   1.960  -2.066  -3.982
  315    HA   VAL  41           HA       VAL  41  -0.042  -0.190  -3.237
  316    HB   VAL  41           HB       VAL  41   2.177  -1.076  -1.938
  317   HG11  VAL  41          1HG1      VAL  41   2.623   1.802  -2.664
  318   HG12  VAL  41          2HG1      VAL  41   3.557   0.459  -3.306
  319   HG13  VAL  41          3HG1      VAL  41   3.608   0.823  -1.581
  320   HG21  VAL  41          3HG2      VAL  41   1.380   1.318  -0.704
  321   HG22  VAL  41          1HG2      VAL  41   0.797  -0.312  -0.377
  322   HG23  VAL  41          2HG2      VAL  41  -0.044   0.704  -1.552
  323    H    SER  42           H        SER  42   2.401  -0.119  -5.764
  324    HA   SER  42           HA       SER  42   1.614   1.908  -7.214
  325    HB2  SER  42           2HB      SER  42   1.104   3.710  -5.872
  326    HB3  SER  42           1HB      SER  42   2.143   3.188  -4.528
  327    HG   SER  42           HG       SER  42   3.374   4.747  -5.226
  328    H    ARG  43           H        ARG  43   4.680   2.977  -5.532
  329    HA   ARG  43           HA       ARG  43   6.818   2.850  -6.224
  330    HB2  ARG  43           2HB      ARG  43   7.075   0.598  -6.163
  331    HB3  ARG  43           1HB      ARG  43   5.696   0.287  -7.200
  332    HG2  ARG  43           2HG      ARG  43   6.951   0.284  -9.085
  333    HG3  ARG  43           1HG      ARG  43   8.047   1.533  -8.490
  334    HD2  ARG  43           2HD      ARG  43   8.970  -0.212  -6.911
  335    HD3  ARG  43           1HD      ARG  43   8.049  -1.402  -7.828
  336    HE   ARG  43           HE       ARG  43   9.642  -1.299  -9.455
  337   HH11  ARG  43          1HH1      ARG  43   9.883   1.583  -7.500
  338   HH12  ARG  43          2HH1      ARG  43  11.312   2.153  -8.296
  339   HH21  ARG  43          1HH2      ARG  43  11.520  -0.552 -10.501
  340   HH22  ARG  43          2HH2      ARG  43  12.242   0.942  -9.999
  341    H    ALA  44           H        ALA  44   4.913   1.914  -9.125
  342    HA   ALA  44           HA       ALA  44   6.553   3.482 -10.869
  343    HB1  ALA  44           1HB      ALA  44   5.187   1.333 -11.358
  344    HB2  ALA  44           2HB      ALA  44   5.292   2.579 -12.602
  345    HB3  ALA  44           3HB      ALA  44   3.837   2.441 -11.611
  346    H    GLY  45           H        GLY  45   6.152   5.673  -9.509
  347    HA2  GLY  45           2HA      GLY  45   3.760   6.931  -9.249
  348    HA3  GLY  45           1HA      GLY  45   5.245   7.778  -9.632
  349    H    VAL  46           H        VAL  46   5.646   6.778 -12.219
  350    HA   VAL  46           HA       VAL  46   5.211   7.504 -14.356
  351    HB   VAL  46           HB       VAL  46   3.908   5.458 -14.282
  352   HG11  VAL  46          1HG1      VAL  46   1.701   7.212 -13.223
  353   HG12  VAL  46          2HG1      VAL  46   2.438   5.818 -12.446
  354   HG13  VAL  46          3HG1      VAL  46   1.437   5.596 -13.876
  355   HG21  VAL  46          3HG2      VAL  46   2.135   7.411 -15.693
  356   HG22  VAL  46          1HG2      VAL  46   2.667   5.810 -16.206
  357   HG23  VAL  46          2HG2      VAL  46   3.796   7.164 -16.232
  358    H    SER  47           H        SER  47   5.222   9.841 -13.066
  359    HA   SER  47           HA       SER  47   2.939  11.225 -14.293
  360    HB2  SER  47           2HB      SER  47   2.206  12.298 -12.318
  361    HB3  SER  47           1HB      SER  47   2.425  10.606 -11.863
  362    HG   SER  47           HG       SER  47   4.033  11.142 -10.583
  363    H    GLY  48           H        GLY  48   5.920  11.939 -12.099
  364    HA2  GLY  48           2HA      GLY  48   6.985  13.565 -14.218
  365    HA3  GLY  48           1HA      GLY  48   6.284  14.531 -12.930
  366    H    CYS  49           H        CYS  49   7.815  11.458 -12.295
  367    HA   CYS  49           HA       CYS  49   9.528  10.940 -10.880
  368    HB2  CYS  49           2HB      CYS  49  10.846  13.036 -12.617
  369    HB3  CYS  49           1HB      CYS  49  11.714  11.912 -11.576
  370    HG   CYS  49           HG       CYS  49  11.268  11.249 -14.270
  371    H    PHE  50           H        PHE  50  11.327  13.807 -10.846
  372    HA   PHE  50           HA       PHE  50  11.763  15.397  -9.280
  373    HB2  PHE  50           2HB      PHE  50   9.288  15.903  -9.767
  374    HB3  PHE  50           1HB      PHE  50   8.920  15.034  -8.281
  375    HD1  PHE  50           2HD      PHE  50  11.588  17.476  -9.197
  376    HD2  PHE  50           1HD      PHE  50   8.321  16.523  -6.643
  377    HE1  PHE  50           2HE      PHE  50  12.009  19.525  -7.901
  378    HE2  PHE  50           1HE      PHE  50   8.735  18.571  -5.343
  379    HZ   PHE  50           HZ       PHE  50  10.580  20.074  -5.971
  380    H    SER  51           H        SER  51   9.368  13.264  -7.484
  381    HA   SER  51           HA       SER  51  11.565  12.692  -5.598
  382    HB2  SER  51           2HB      SER  51   8.675  13.357  -5.100
  383    HB3  SER  51           1HB      SER  51   9.584  12.396  -3.934
  384    HG   SER  51           HG       SER  51   9.674  14.641  -3.473
  385    H    THR  52           H        THR  52   8.738  11.510  -7.302
  386    HA   THR  52           HA       THR  52   7.992   9.427  -7.803
  387    HB   THR  52           HB       THR  52   9.580   7.790  -8.340
  388    HG1  THR  52           1HG      THR  52  11.430   8.961  -6.546
  389   HG21  THR  52          3HG2      THR  52  11.721   9.689  -8.526
  390   HG22  THR  52          1HG2      THR  52  10.193  10.427  -9.007
  391   HG23  THR  52          2HG2      THR  52  10.751   8.957  -9.804
  392    H    PHE  53           H        PHE  53   8.186  10.413  -4.903
  393    HA   PHE  53           HA       PHE  53   7.932   9.624  -2.763
  394    HB2  PHE  53           2HB      PHE  53   5.998   8.047  -2.602
  395    HB3  PHE  53           1HB      PHE  53   5.675   9.465  -3.596
  396    HD1  PHE  53           1HD      PHE  53   6.871   5.936  -3.927
  397    HD2  PHE  53           2HD      PHE  53   4.694   9.164  -5.645
  398    HE1  PHE  53           1HE      PHE  53   6.191   4.482  -5.771
  399    HE2  PHE  53           2HE      PHE  53   4.005   7.709  -7.502
  400    HZ   PHE  53           HZ       PHE  53   4.752   5.362  -7.571
  401    H    GLN  54           H        GLN  54  10.144   8.308  -4.165
  402    HA   GLN  54           HA       GLN  54  10.670   5.790  -4.264
  403    HB2  GLN  54           2HB      GLN  54  12.154   7.969  -3.283
  404    HB3  GLN  54           1HB      GLN  54  12.432   6.648  -2.159
  405    HG2  GLN  54           2HG      GLN  54  12.584   5.775  -4.915
  406    HG3  GLN  54           1HG      GLN  54  13.719   7.078  -4.565
  407   HE21  GLN  54          1HE2      GLN  54  15.435   6.706  -3.228
  408   HE22  GLN  54          2HE2      GLN  54  15.856   5.140  -2.632
  409    HA   PRO  55           HA       PRO  55   8.791   3.622  -0.866
  410    HB2  PRO  55           2HB      PRO  55  10.471   1.333  -1.484
  411    HB3  PRO  55           1HB      PRO  55   8.727   1.517  -1.650
  412    HG2  PRO  55           2HG      PRO  55  10.426   1.370  -3.776
  413    HG3  PRO  55           1HG      PRO  55   8.864   2.200  -3.819
  414    HD2  PRO  55           2HD      PRO  55  11.610   3.334  -3.599
  415    HD3  PRO  55           1HD      PRO  55  10.177   3.984  -4.421
  416    H    THR  56           H        THR  56  12.248   3.869  -1.300
  417    HA   THR  56           HA       THR  56  13.255   2.685   0.990
  418    HB   THR  56           HB       THR  56  14.924   4.686   0.922
  419    HG1  THR  56           1HG      THR  56  13.602   6.140  -0.200
  420   HG21  THR  56          3HG2      THR  56  14.559   3.003  -1.543
  421   HG22  THR  56          1HG2      THR  56  15.451   2.546  -0.093
  422   HG23  THR  56          2HG2      THR  56  16.022   3.881  -1.094
  423    H    THR  57           H        THR  57  11.700   5.968   0.627
  424    HA   THR  57           HA       THR  57  12.154   6.915   3.196
  425    HB   THR  57           HB       THR  57  11.191   8.236   1.338
  426    HG1  THR  57           1HG      THR  57  10.577   9.454   2.909
  427   HG21  THR  57          3HG2      THR  57   9.305   6.210   1.142
  428   HG22  THR  57          1HG2      THR  57   9.301   7.752   0.288
  429   HG23  THR  57          2HG2      THR  57   8.425   7.584   1.809
  430    H    GLY  58           H        GLY  58   9.988   4.419   2.102
  431    HA2  GLY  58           2HA      GLY  58   9.334   2.841   3.927
  432    HA3  GLY  58           1HA      GLY  58   8.911   4.267   4.842
  433    H    HIS  59           H        HIS  59   7.838   2.371   1.912
  434    HA   HIS  59           HA       HIS  59   5.455   3.971   1.762
  435    HB2  HIS  59           2HB      HIS  59   6.722   1.945   0.116
  436    HB3  HIS  59           1HB      HIS  59   5.001   1.622   0.294
  437    HD1  HIS  59           1HD      HIS  59   6.985   4.819  -0.286
  438    HD2  HIS  59           2HD      HIS  59   3.722   2.761  -1.870
  439    HE1  HIS  59           1HE      HIS  59   6.100   6.255  -2.142
  440    HE2  HIS  59           2HE      HIS  59   4.185   4.960  -3.125
  441    H    ARG  60           H        ARG  60   3.554   3.601   2.563
  442    HA   ARG  60           HA       ARG  60   3.096   1.219   4.254
  443    HB2  ARG  60           2HB      ARG  60   1.693   2.633   5.620
  444    HB3  ARG  60           1HB      ARG  60   3.194   3.492   5.364
  445    HG2  ARG  60           2HG      ARG  60   1.891   4.565   3.365
  446    HG3  ARG  60           1HG      ARG  60   0.486   4.081   4.312
  447    HD2  ARG  60           2HD      ARG  60   2.697   5.968   5.058
  448    HD3  ARG  60           1HD      ARG  60   0.963   6.275   5.007
  449    HE   ARG  60           HE       ARG  60   1.349   4.295   6.896
  450   HH11  ARG  60          1HH1      ARG  60   2.336   7.609   6.431
  451   HH12  ARG  60          2HH1      ARG  60   2.438   7.947   8.127
  452   HH21  ARG  60          1HH2      ARG  60   1.480   4.738   9.126
  453   HH22  ARG  60          2HH2      ARG  60   1.951   6.318   9.656
  454    H    LEU  61           H        LEU  61   0.548   0.676   4.256
  455    HA   LEU  61           HA       LEU  61  -0.394   1.150   1.531
  456    HB2  LEU  61           2HB      LEU  61   0.311  -1.205   2.210
  457    HB3  LEU  61           1HB      LEU  61  -1.172  -1.275   3.147
  458    HG   LEU  61           HG       LEU  61  -2.418  -1.693   1.359
  459   HD11  LEU  61          1HD1      LEU  61  -0.836   0.472   0.197
  460   HD12  LEU  61          2HD1      LEU  61  -2.568   0.268   0.272
  461   HD13  LEU  61          3HD1      LEU  61  -1.624  -0.618  -0.924
  462   HD21  LEU  61          3HD2      LEU  61   0.231  -2.132  -0.001
  463   HD22  LEU  61          1HD2      LEU  61  -1.315  -2.809  -0.490
  464   HD23  LEU  61          2HD2      LEU  61  -0.594  -3.297   1.035
  465    H    CYS  62           H        CYS  62  -2.962   1.264   1.297
  466    HA   CYS  62           HA       CYS  62  -3.930   2.469   3.736
  467    HB2  CYS  62           2HB      CYS  62  -4.697   4.216   2.568
  468    HB3  CYS  62           1HB      CYS  62  -3.483   3.653   1.451
  469    H    SER  63           H        SER  63  -6.561   2.611   3.678
  470    HA   SER  63           HA       SER  63  -7.311   0.381   4.881
  471    HB2  SER  63           2HB      SER  63  -8.457   2.913   4.134
  472    HB3  SER  63           1HB      SER  63  -9.690   1.662   4.094
  473    HG   SER  63           HG       SER  63  -7.902   1.935   6.267
  474    H    VAL  64           H        VAL  64  -9.803   1.047   3.010
  475    HA   VAL  64           HA       VAL  64 -11.020  -1.265   2.777
  476    HB   VAL  64           HB       VAL  64 -12.320  -0.481   0.873
  477   HG11  VAL  64          1HG1      VAL  64 -11.782   1.030   3.325
  478   HG12  VAL  64          2HG1      VAL  64 -13.313   0.486   2.639
  479   HG13  VAL  64          3HG1      VAL  64 -12.561   1.971   2.053
  480   HG21  VAL  64          3HG2      VAL  64 -11.230   0.706  -0.652
  481   HG22  VAL  64          1HG2      VAL  64  -9.927   1.104   0.474
  482   HG23  VAL  64          2HG2      VAL  64 -11.408   2.071   0.452
  483    H    HIS  65           H        HIS  65  -8.569  -2.189   2.174
  484    HA   HIS  65           HA       HIS  65  -8.880  -3.225  -0.578
  485    HB2  HIS  65           2HB      HIS  65  -6.386  -3.645   0.985
  486    HB3  HIS  65           1HB      HIS  65  -6.603  -3.580  -0.762
  487    HD1  HIS  65           1HD      HIS  65  -8.231  -0.718   0.708
  488    HD2  HIS  65           2HD      HIS  65  -4.397  -1.743  -0.374
  489    HE1  HIS  65           1HE      HIS  65  -6.963   1.408   0.734
  490    H    PHE  66           H        PHE  66  -7.681  -4.585   2.625
  491    HA   PHE  66           HA       PHE  66  -8.022  -7.211   1.755
  492    HB2  PHE  66           2HB      PHE  66  -8.260  -6.550   4.666
  493    HB3  PHE  66           1HB      PHE  66  -7.349  -7.831   3.876
  494    HD1  PHE  66           2HD      PHE  66  -7.312  -4.204   4.745
  495    HD2  PHE  66           1HD      PHE  66  -5.110  -7.529   3.227
  496    HE1  PHE  66           2HE      PHE  66  -5.219  -2.934   4.959
  497    HE2  PHE  66           1HE      PHE  66  -3.032  -6.253   3.439
  498    HZ   PHE  66           HZ       PHE  66  -3.078  -3.964   4.302
  499    H    GLN  67           H        GLN  67  -9.694  -8.782   3.025
  500    HA   GLN  67           HA       GLN  67 -12.264  -7.401   2.859
  501    HB2  GLN  67           2HB      GLN  67 -13.153  -9.798   2.803
  502    HB3  GLN  67           1HB      GLN  67 -12.295  -9.193   1.394
  503    HG2  GLN  67           2HG      GLN  67 -10.366 -10.399   3.051
  504    HG3  GLN  67           1HG      GLN  67 -11.749 -11.484   2.999
  505   HE21  GLN  67          1HE2      GLN  67 -10.564 -13.000   1.816
  506   HE22  GLN  67          2HE2      GLN  67 -10.233 -12.780   0.135
  507    H    GLY  68           H        GLY  68 -12.736  -6.709   5.270
  508    HA2  GLY  68           2HA      GLY  68 -12.836  -6.945   7.525
  509    HA3  GLY  68           1HA      GLY  68 -13.675  -8.421   7.077
  510    H    GLY  69           H        GLY  69 -12.678  -8.697   9.444
  511    HA2  GLY  69           2HA      GLY  69 -11.300  -9.824  10.818
  512    HA3  GLY  69           1HA      GLY  69 -10.930 -10.827   9.441
  513    H    ARG  70           H        ARG  70  -8.929 -10.056   8.071
  514    HA   ARG  70           HA       ARG  70  -7.246  -8.004   8.810
  515    HB2  ARG  70           2HB      ARG  70  -5.536  -9.123  10.142
  516    HB3  ARG  70           1HB      ARG  70  -7.071  -9.172  10.991
  517    HG2  ARG  70           2HG      ARG  70  -7.241 -11.510   9.732
  518    HG3  ARG  70           1HG      ARG  70  -5.484 -11.368   9.812
  519    HD2  ARG  70           2HD      ARG  70  -5.605 -11.059  12.224
  520    HD3  ARG  70           1HD      ARG  70  -7.365 -11.147  12.159
  521    HE   ARG  70           HE       ARG  70  -5.551 -13.335  12.194
  522   HH11  ARG  70          1HH1      ARG  70  -8.627 -12.299  10.910
  523   HH12  ARG  70          2HH1      ARG  70  -9.251 -13.909  10.769
  524   HH21  ARG  70          1HH2      ARG  70  -6.371 -15.453  12.012
  525   HH22  ARG  70          2HH2      ARG  70  -7.972 -15.698  11.395
  526    H    LYS  71           H        LYS  71  -8.160  -9.282   6.553
  527    HA   LYS  71           HA       LYS  71  -7.555 -10.089   4.566
  528    HB2  LYS  71           2HB      LYS  71  -5.721  -9.132   3.679
  529    HB3  LYS  71           1HB      LYS  71  -5.704  -8.267   5.205
  530    HG2  LYS  71           2HG      LYS  71  -4.195 -10.412   5.847
  531    HG3  LYS  71           1HG      LYS  71  -3.829 -10.261   4.131
  532    HD2  LYS  71           2HD      LYS  71  -2.231  -8.988   5.385
  533    HD3  LYS  71           1HD      LYS  71  -3.287  -7.869   4.529
  534    HE2  LYS  71           2HE      LYS  71  -4.515  -8.352   7.016
  535    HE3  LYS  71           1HE      LYS  71  -2.787  -8.124   7.338
  536    HZ1  LYS  71           3HZ      LYS  71  -4.655  -6.241   6.030
  537    HZ2  LYS  71           1HZ      LYS  71  -2.974  -6.060   5.932
  538    HZ3  LYS  71           2HZ      LYS  71  -3.747  -6.005   7.436
  539    H    THR  72           H        THR  72  -7.905 -12.185   4.355
  540    HA   THR  72           HA       THR  72  -5.838 -14.032   4.254
  541    HB   THR  72           HB       THR  72  -6.902 -15.441   6.285
  542    HG1  THR  72           1HG      THR  72  -6.794 -12.868   7.407
  543   HG21  THR  72          3HG2      THR  72  -4.513 -13.990   5.828
  544   HG22  THR  72          1HG2      THR  72  -4.776 -15.392   6.868
  545   HG23  THR  72          2HG2      THR  72  -4.994 -13.764   7.512
  546    H    TYR  73           H        TYR  73  -6.808 -16.403   4.450
  547    HA   TYR  73           HA       TYR  73  -8.326 -17.955   3.751
  548    HB2  TYR  73           2HB      TYR  73 -10.005 -15.800   4.485
  549    HB3  TYR  73           1HB      TYR  73 -10.560 -16.352   2.910
  550    HD1  TYR  73           1HD      TYR  73  -9.986 -17.347   6.411
  551    HD2  TYR  73           2HD      TYR  73 -11.651 -18.469   2.659
  552    HE1  TYR  73           1HE      TYR  73 -11.172 -19.205   7.500
  553    HE2  TYR  73           2HE      TYR  73 -12.842 -20.331   3.739
  554    HH   TYR  73           HH       TYR  73 -12.178 -21.319   6.958
  555    H    THR  74           H        THR  74  -7.038 -15.472   1.952
  556    HA   THR  74           HA       THR  74  -6.956 -16.917  -0.429
  557    HB   THR  74           HB       THR  74  -8.546 -14.799  -1.420
  558    HG1  THR  74           1HG      THR  74  -9.422 -14.771   0.754
  559   HG21  THR  74          3HG2      THR  74  -9.346 -17.684  -1.105
  560   HG22  THR  74          1HG2      THR  74  -8.322 -17.060  -2.397
  561   HG23  THR  74          2HG2      THR  74  -9.993 -16.512  -2.254
  562    H    VAL  75           H        VAL  75  -7.352 -13.561   0.657
  563    HA   VAL  75           HA       VAL  75  -5.406 -12.647  -1.268
  564    HB   VAL  75           HB       VAL  75  -6.422 -10.791   0.819
  565   HG11  VAL  75          1HG1      VAL  75  -6.552  -9.291  -1.134
  566   HG12  VAL  75          2HG1      VAL  75  -6.032 -10.625  -2.164
  567   HG13  VAL  75          3HG1      VAL  75  -4.947  -9.990  -0.925
  568   HG21  VAL  75          3HG2      VAL  75  -8.234 -11.255  -1.487
  569   HG22  VAL  75          1HG2      VAL  75  -8.586 -10.655   0.132
  570   HG23  VAL  75          2HG2      VAL  75  -8.334 -12.379  -0.136
  571    H    ARG  76           H        ARG  76  -3.282 -12.298  -0.912
  572    HA   ARG  76           HA       ARG  76  -2.364 -12.213   1.892
  573    HB2  ARG  76           2HB      ARG  76  -1.059 -13.244  -0.617
  574    HB3  ARG  76           1HB      ARG  76  -0.088 -12.765   0.767
  575    HG2  ARG  76           2HG      ARG  76  -1.774 -14.357   2.039
  576    HG3  ARG  76           1HG      ARG  76  -1.911 -15.077   0.433
  577    HD2  ARG  76           2HD      ARG  76   0.847 -14.549   1.126
  578    HD3  ARG  76           1HD      ARG  76   0.065 -15.567   2.334
  579    HE   ARG  76           HE       ARG  76  -0.035 -17.265   0.797
  580   HH11  ARG  76          1HH1      ARG  76   0.739 -14.284  -0.846
  581   HH12  ARG  76          2HH1      ARG  76   1.080 -15.060  -2.356
  582   HH21  ARG  76          1HH2      ARG  76   0.413 -18.286  -1.189
  583   HH22  ARG  76          2HH2      ARG  76   0.894 -17.331  -2.551
  584    H    VAL  77           H        VAL  77  -1.927 -10.810  -1.335
  585    HA   VAL  77           HA       VAL  77  -0.630  -8.468  -0.128
  586    HB   VAL  77           HB       VAL  77   0.617  -8.177  -2.051
  587   HG11  VAL  77          1HG1      VAL  77  -0.030 -11.063  -2.533
  588   HG12  VAL  77          2HG1      VAL  77   0.938 -10.520  -1.163
  589   HG13  VAL  77          3HG1      VAL  77   1.492 -10.214  -2.810
  590   HG21  VAL  77          3HG2      VAL  77  -1.217  -7.747  -3.552
  591   HG22  VAL  77          1HG2      VAL  77  -1.608  -9.466  -3.621
  592   HG23  VAL  77          2HG2      VAL  77  -0.093  -8.876  -4.308
  593    HA   PRO  78           HA       PRO  78  -4.512  -6.224  -0.501
  594    HB2  PRO  78           2HB      PRO  78  -2.456  -4.091  -0.897
  595    HB3  PRO  78           1HB      PRO  78  -3.964  -4.005   0.006
  596    HG2  PRO  78           2HG      PRO  78  -1.852  -4.413   1.410
  597    HG3  PRO  78           1HG      PRO  78  -3.154  -5.606   1.606
  598    HD2  PRO  78           2HD      PRO  78  -0.717  -5.779  -0.117
  599    HD3  PRO  78           1HD      PRO  78  -1.307  -6.966   1.077
  600    H    THR  79           H        THR  79  -4.128  -7.429  -3.045
  601    HA   THR  79           HA       THR  79  -4.374  -4.926  -4.570
  602    HB   THR  79           HB       THR  79  -4.405  -7.069  -6.401
  603    HG1  THR  79           1HG      THR  79  -3.522  -8.563  -5.158
  604   HG21  THR  79          3HG2      THR  79  -2.759  -4.795  -5.838
  605   HG22  THR  79          1HG2      THR  79  -3.036  -5.632  -7.366
  606   HG23  THR  79          2HG2      THR  79  -1.762  -6.182  -6.275
  607    H    ILE  80           H        ILE  80  -6.361  -4.320  -4.452
  608    HA   ILE  80           HA       ILE  80  -8.474  -6.157  -5.339
  609    HB   ILE  80           HB       ILE  80  -8.372  -4.716  -2.806
  610   HG12  ILE  80          2HG1      ILE  80 -10.753  -6.124  -2.876
  611   HG13  ILE  80          1HG1      ILE  80  -9.744  -6.997  -4.029
  612   HG21  ILE  80          1HG2      ILE  80 -10.848  -4.027  -2.944
  613   HG22  ILE  80          2HG2      ILE  80 -10.583  -3.972  -4.686
  614   HG23  ILE  80          3HG2      ILE  80  -9.633  -2.942  -3.614
  615   HD11  ILE  80          3HD1      ILE  80  -8.256  -6.428  -1.643
  616   HD12  ILE  80          1HD1      ILE  80  -8.653  -7.983  -2.374
  617   HD13  ILE  80          2HD1      ILE  80  -9.778  -7.228  -1.239
  618    H    PHE  81           H        PHE  81  -8.510  -5.345  -7.510
  619    HA   PHE  81           HA       PHE  81  -9.670  -2.755  -7.819
  620    HB2  PHE  81           2HB      PHE  81  -7.055  -2.814  -9.253
  621    HB3  PHE  81           1HB      PHE  81  -7.975  -1.445  -8.664
  622    HD1  PHE  81           1HD      PHE  81  -7.950  -1.154  -5.980
  623    HD2  PHE  81           2HD      PHE  81  -5.071  -3.355  -8.245
  624    HE1  PHE  81           1HE      PHE  81  -6.336  -0.942  -4.140
  625    HE2  PHE  81           2HE      PHE  81  -3.450  -3.125  -6.376
  626    HZ   PHE  81           HZ       PHE  81  -4.106  -1.950  -4.311
  Start of MODEL   17
    1    H1   GLY   1           1HT      GLY   1   9.261  14.877  -6.248
    2    H2   GLY   1           2HT      GLY   1   9.279  14.087  -4.752
    3    H3   GLY   1           3HT      GLY   1  10.727  14.636  -5.435
    4    HA2  GLY   1           1HA      GLY   1  10.018  16.099  -3.649
    5    HA3  GLY   1           2HA      GLY   1  10.034  16.923  -5.200
    6    H    SER   2           H        SER   2   7.946  15.336  -2.838
    7    HA   SER   2           HA       SER   2   5.947  17.306  -3.011
    8    HB2  SER   2           2HB      SER   2   4.185  16.192  -4.184
    9    HB3  SER   2           1HB      SER   2   5.606  16.123  -5.226
   10    HG   SER   2           HG       SER   2   4.489  14.066  -3.640
   11    HA   PRO   3           HA       PRO   3   4.951  15.278   0.792
   12    HB2  PRO   3           2HB      PRO   3   2.597  16.433   1.374
   13    HB3  PRO   3           1HB      PRO   3   4.112  17.346   1.398
   14    HG2  PRO   3           2HG      PRO   3   2.005  17.228  -0.727
   15    HG3  PRO   3           1HG      PRO   3   2.875  18.637  -0.093
   16    HD2  PRO   3           2HD      PRO   3   3.536  17.382  -2.427
   17    HD3  PRO   3           1HD      PRO   3   4.709  18.253  -1.419
   18    H    GLY   4           H        GLY   4   4.554  13.432  -1.124
   19    HA2  GLY   4           2HA      GLY   4   2.353  11.936  -0.123
   20    HA3  GLY   4           1HA      GLY   4   1.995  12.578  -1.722
   21    H    PHE   5           H        PHE   5   1.923   9.946  -1.864
   22    HA   PHE   5           HA       PHE   5   4.451   9.233  -3.123
   23    HB2  PHE   5           2HB      PHE   5   3.322   7.176  -1.294
   24    HB3  PHE   5           1HB      PHE   5   4.980   7.444  -1.802
   25    HD1  PHE   5           2HD      PHE   5   6.252   9.385  -0.834
   26    HD2  PHE   5           1HD      PHE   5   2.535   8.035   0.740
   27    HE1  PHE   5           2HE      PHE   5   6.730  10.547   1.280
   28    HE2  PHE   5           1HE      PHE   5   3.005   9.196   2.856
   29    HZ   PHE   5           HZ       PHE   5   5.105  10.453   3.130
   30    H    THR   6           H        THR   6   1.127   8.231  -2.467
   31    HA   THR   6           HA       THR   6  -0.459   7.597  -4.072
   32    HB   THR   6           HB       THR   6   1.738   6.443  -5.779
   33    HG1  THR   6           1HG      THR   6   0.884   9.103  -5.530
   34   HG21  THR   6          3HG2      THR   6  -0.171   7.433  -7.438
   35   HG22  THR   6          1HG2      THR   6  -1.136   6.853  -6.079
   36   HG23  THR   6          2HG2      THR   6  -0.044   5.752  -6.922
   37    H    CYS   7           H        CYS   7  -1.586   5.948  -3.200
   38    HA   CYS   7           HA       CYS   7  -0.238   3.519  -2.321
   39    HB2  CYS   7           2HB      CYS   7  -1.931   4.098  -0.771
   40    HB3  CYS   7           1HB      CYS   7  -3.112   4.496  -2.011
   41    H    CYS   8           H        CYS   8  -0.798   4.388  -5.311
   42    HA   CYS   8           HA       CYS   8  -1.400   3.287  -7.246
   43    HB2  CYS   8           2HB      CYS   8   0.094   1.530  -6.597
   44    HB3  CYS   8           1HB      CYS   8  -0.971   0.971  -5.333
   45    HG   CYS   8           HG       CYS   8  -1.323   0.381  -8.364
   46    H    VAL   9           H        VAL   9  -3.147   4.217  -5.076
   47    HA   VAL   9           HA       VAL   9  -5.406   2.542  -4.832
   48    HB   VAL   9           HB       VAL   9  -4.953   4.006  -3.044
   49   HG11  VAL   9          1HG1      VAL   9  -4.269   5.862  -5.159
   50   HG12  VAL   9          2HG1      VAL   9  -3.658   5.730  -3.510
   51   HG13  VAL   9          3HG1      VAL   9  -5.150   6.613  -3.831
   52   HG21  VAL   9          3HG2      VAL   9  -7.028   5.800  -4.103
   53   HG22  VAL   9          1HG2      VAL   9  -6.975   4.878  -2.596
   54   HG23  VAL   9          2HG2      VAL   9  -7.430   4.087  -4.114
   55    HA   PRO  10           HA       PRO  10  -6.966   3.890  -8.895
   56    HB2  PRO  10           2HB      PRO  10  -8.677   1.816  -9.170
   57    HB3  PRO  10           1HB      PRO  10  -6.948   1.643  -9.504
   58    HG2  PRO  10           2HG      PRO  10  -8.480   0.889  -7.035
   59    HG3  PRO  10           1HG      PRO  10  -7.253  -0.041  -7.915
   60    HD2  PRO  10           2HD      PRO  10  -6.662   1.347  -5.666
   61    HD3  PRO  10           1HD      PRO  10  -5.510   1.148  -6.999
   62    H    GLY  11           H        GLY  11  -8.198   3.449  -5.810
   63    HA2  GLY  11           2HA      GLY  11  -9.903   5.417  -5.499
   64    HA3  GLY  11           1HA      GLY  11 -10.904   4.291  -6.411
   65    H    CYS  12           H        CYS  12  -8.526   2.884  -4.297
   66    HA   CYS  12           HA       CYS  12 -10.341   1.366  -2.931
   67    HB2  CYS  12           2HB      CYS  12  -8.391   1.696  -0.976
   68    HB3  CYS  12           1HB      CYS  12  -8.453   0.434  -2.181
   69    H    TYR  13           H        TYR  13  -8.647   3.530  -0.758
   70    HA   TYR  13           HA       TYR  13 -11.236   4.629   0.089
   71    HB2  TYR  13           2HB      TYR  13  -9.760   2.769   1.482
   72    HB3  TYR  13           1HB      TYR  13  -9.323   4.284   2.242
   73    HD1  TYR  13           1HD      TYR  13 -12.630   3.502   0.757
   74    HD2  TYR  13           2HD      TYR  13 -10.388   3.982   4.344
   75    HE1  TYR  13           1HE      TYR  13 -14.711   3.444   2.061
   76    HE2  TYR  13           2HE      TYR  13 -12.464   3.925   5.655
   77    HH   TYR  13           HH       TYR  13 -15.346   2.829   4.492
   78    H    ASN  14           H        ASN  14  -7.859   4.851   0.760
   79    HA   ASN  14           HA       ASN  14  -7.876   7.766   0.550
   80    HB2  ASN  14           2HB      ASN  14  -5.807   6.644   2.215
   81    HB3  ASN  14           1HB      ASN  14  -6.927   7.935   2.581
   82   HD21  ASN  14          1HD2      ASN  14  -9.319   6.814   2.576
   83   HD22  ASN  14          2HD2      ASN  14  -9.440   5.502   3.693
   84    H    ASN  15           H        ASN  15  -5.659   8.706  -0.258
   85    HA   ASN  15           HA       ASN  15  -4.404   6.633  -1.919
   86    HB2  ASN  15           2HB      ASN  15  -5.428   8.480  -3.172
   87    HB3  ASN  15           1HB      ASN  15  -4.465   9.645  -2.274
   88   HD21  ASN  15          1HD2      ASN  15  -4.737   8.217  -5.150
   89   HD22  ASN  15          2HD2      ASN  15  -3.090   8.235  -5.669
   90    H    SER  16           H        SER  16  -1.824   6.946  -2.215
   91    HA   SER  16           HA       SER  16  -0.791   7.542   0.393
   92    HB2  SER  16           2HB      SER  16  -0.178   5.409  -1.005
   93    HB3  SER  16           1HB      SER  16   0.817   6.453  -1.952
   94    HG   SER  16           HG       SER  16   1.996   5.519  -0.258
   95    H    HIS  17           H        HIS  17  -1.565   9.563  -2.015
   96    HA   HIS  17           HA       HIS  17   0.497  11.456  -1.306
   97    HB2  HIS  17           2HB      HIS  17   1.452  11.797  -3.389
   98    HB3  HIS  17           1HB      HIS  17   1.187  10.061  -3.452
   99    HD1  HIS  17           1HD      HIS  17  -1.279   9.451  -4.627
  100    HD2  HIS  17           2HD      HIS  17   0.523  13.072  -5.577
  101    HE1  HIS  17           1HE      HIS  17  -2.350  10.191  -6.777
  102    HE2  HIS  17           2HE      HIS  17  -1.314  12.430  -7.280
  103    H    ARG  18           H        ARG  18  -2.579  11.109  -1.222
  104    HA   ARG  18           HA       ARG  18  -3.131  13.751  -2.402
  105    HB2  ARG  18           2HB      ARG  18  -4.882  13.042  -3.621
  106    HB3  ARG  18           1HB      ARG  18  -4.094  11.477  -3.497
  107    HG2  ARG  18           2HG      ARG  18  -5.529  11.154  -1.386
  108    HG3  ARG  18           1HG      ARG  18  -6.480  12.503  -2.009
  109    HD2  ARG  18           2HD      ARG  18  -5.933  10.534  -4.062
  110    HD3  ARG  18           1HD      ARG  18  -6.755   9.821  -2.676
  111    HE   ARG  18           HE       ARG  18  -7.831  11.747  -4.543
  112   HH11  ARG  18          1HH1      ARG  18  -8.169  10.243  -1.408
  113   HH12  ARG  18          2HH1      ARG  18  -9.858  10.601  -1.284
  114   HH21  ARG  18          1HH2      ARG  18 -10.051  12.219  -4.374
  115   HH22  ARG  18          2HH2      ARG  18 -10.926  11.722  -2.964
  116    H    ASP  19           H        ASP  19  -2.811  12.407   0.455
  117    HA   ASP  19           HA       ASP  19  -4.415  14.294   1.809
  118    HB2  ASP  19           2HB      ASP  19  -5.494  11.520   1.657
  119    HB3  ASP  19           1HB      ASP  19  -5.773  12.550   3.054
  120    H    LYS  20           H        LYS  20  -3.481  10.974   2.553
  121    HA   LYS  20           HA       LYS  20  -2.092  10.125   4.128
  122    HB2  LYS  20           2HB      LYS  20  -0.160  11.190   3.725
  123    HB3  LYS  20           1HB      LYS  20  -0.953  12.736   3.518
  124    HG2  LYS  20           2HG      LYS  20   0.536  13.043   5.285
  125    HG3  LYS  20           1HG      LYS  20  -1.035  12.861   6.062
  126    HD2  LYS  20           2HD      LYS  20  -0.147  11.237   7.307
  127    HD3  LYS  20           1HD      LYS  20  -0.001  10.267   5.841
  128    HE2  LYS  20           2HE      LYS  20   2.203  11.533   5.468
  129    HE3  LYS  20           1HE      LYS  20   2.057  12.005   7.160
  130    HZ1  LYS  20           3HZ      LYS  20   2.062   9.708   7.807
  131    HZ2  LYS  20           1HZ      LYS  20   3.410   9.994   6.824
  132    HZ3  LYS  20           2HZ      LYS  20   2.058   9.198   6.194
  133    H    ALA  21           H        ALA  21  -4.709  11.830   4.750
  134    HA   ALA  21           HA       ALA  21  -4.258  12.037   7.647
  135    HB1  ALA  21           1HB      ALA  21  -5.096  14.064   7.125
  136    HB2  ALA  21           2HB      ALA  21  -6.622  13.216   7.383
  137    HB3  ALA  21           3HB      ALA  21  -6.012  13.457   5.745
  138    H    LEU  22           H        LEU  22  -5.340   9.569   5.772
  139    HA   LEU  22           HA       LEU  22  -7.562   8.951   7.594
  140    HB2  LEU  22           2HB      LEU  22  -7.110   7.677   4.861
  141    HB3  LEU  22           1HB      LEU  22  -8.552   7.557   5.872
  142    HG   LEU  22           HG       LEU  22  -8.788   9.019   3.900
  143   HD11  LEU  22          1HD1      LEU  22  -9.719  10.951   5.417
  144   HD12  LEU  22          2HD1      LEU  22  -9.346   9.808   6.707
  145   HD13  LEU  22          3HD1      LEU  22 -10.457   9.349   5.414
  146   HD21  LEU  22          3HD2      LEU  22  -7.773  11.006   3.668
  147   HD22  LEU  22          1HD2      LEU  22  -6.450  10.060   4.349
  148   HD23  LEU  22          2HD2      LEU  22  -7.380  11.155   5.380
  149    H    HIS  23           H        HIS  23  -7.013   5.778   6.720
  150    HA   HIS  23           HA       HIS  23  -5.100   5.506   8.861
  151    HB2  HIS  23           2HB      HIS  23  -7.503   4.218   8.208
  152    HB3  HIS  23           1HB      HIS  23  -6.252   3.027   7.875
  153    HD1  HIS  23           1HD      HIS  23  -8.437   3.693  10.438
  154    HD2  HIS  23           2HD      HIS  23  -4.300   3.289  10.367
  155    HE1  HIS  23           1HE      HIS  23  -7.776   3.114  12.795
  156    HE2  HIS  23           2HE      HIS  23  -5.261   2.966  12.746
  157    H    PHE  24           H        PHE  24  -3.042   4.308   8.522
  158    HA   PHE  24           HA       PHE  24  -2.685   3.333   5.802
  159    HB2  PHE  24           2HB      PHE  24  -0.740   5.002   7.372
  160    HB3  PHE  24           1HB      PHE  24  -0.312   4.123   5.918
  161    HD1  PHE  24           2HD      PHE  24  -2.455   6.826   7.237
  162    HD2  PHE  24           1HD      PHE  24  -0.817   5.004   3.752
  163    HE1  PHE  24           2HE      PHE  24  -3.196   8.736   5.874
  164    HE2  PHE  24           1HE      PHE  24  -1.541   6.906   2.401
  165    HZ   PHE  24           HZ       PHE  24  -2.736   8.775   3.449
  166    H    TYR  25           H        TYR  25  -1.773   1.155   5.701
  167    HA   TYR  25           HA       TYR  25  -1.062  -0.076   8.222
  168    HB2  TYR  25           2HB      TYR  25  -1.332  -1.143   5.394
  169    HB3  TYR  25           1HB      TYR  25  -0.583  -2.095   6.658
  170    HD1  TYR  25           2HD      TYR  25  -3.685   0.001   6.445
  171    HD2  TYR  25           1HD      TYR  25  -1.932  -3.750   7.428
  172    HE1  TYR  25           2HE      TYR  25  -5.899  -0.849   7.104
  173    HE2  TYR  25           1HE      TYR  25  -4.132  -4.631   8.077
  174    HH   TYR  25           HH       TYR  25  -6.595  -2.979   8.895
  175    H    THR  26           H        THR  26   1.175  -1.163   8.466
  176    HA   THR  26           HA       THR  26   3.142   0.417   6.957
  177    HB   THR  26           HB       THR  26   4.324  -1.031   9.166
  178    HG1  THR  26           1HG      THR  26   2.599  -1.084  10.387
  179   HG21  THR  26          3HG2      THR  26   5.449   0.873   9.218
  180   HG22  THR  26          1HG2      THR  26   4.015   1.672   9.864
  181   HG23  THR  26          2HG2      THR  26   4.287   1.626   8.123
  182    H    PHE  27           H        PHE  27   5.349  -0.853   6.701
  183    HA   PHE  27           HA       PHE  27   4.682  -3.094   5.121
  184    HB2  PHE  27           2HB      PHE  27   6.660  -1.137   5.237
  185    HB3  PHE  27           1HB      PHE  27   7.454  -2.684   5.112
  186    HD1  PHE  27           2HD      PHE  27   4.174  -2.348   3.581
  187    HD2  PHE  27           1HD      PHE  27   8.360  -1.900   2.982
  188    HE1  PHE  27           2HE      PHE  27   3.832  -2.328   1.154
  189    HE2  PHE  27           1HE      PHE  27   8.023  -1.890   0.569
  190    HZ   PHE  27           HZ       PHE  27   5.728  -2.102  -0.364
  191    HA   PRO  28           HA       PRO  28   5.696  -6.558   7.906
  192    HB2  PRO  28           2HB      PRO  28   6.864  -7.447   5.245
  193    HB3  PRO  28           1HB      PRO  28   6.037  -8.451   6.429
  194    HG2  PRO  28           2HG      PRO  28   4.706  -7.571   4.376
  195    HG3  PRO  28           1HG      PRO  28   3.958  -7.449   5.974
  196    HD2  PRO  28           2HD      PRO  28   5.075  -5.340   4.233
  197    HD3  PRO  28           1HD      PRO  28   3.791  -5.255   5.429
  198    H    LYS  29           H        LYS  29   7.806  -7.828   8.495
  199    HA   LYS  29           HA       LYS  29  10.026  -5.954   8.491
  200    HB2  LYS  29           2HB      LYS  29  10.592  -8.481   9.798
  201    HB3  LYS  29           1HB      LYS  29  10.586  -6.856  10.462
  202    HG2  LYS  29           2HG      LYS  29   8.098  -7.041  10.668
  203    HG3  LYS  29           1HG      LYS  29   8.254  -8.739  10.209
  204    HD2  LYS  29           2HD      LYS  29   9.982  -8.833  12.147
  205    HD3  LYS  29           1HD      LYS  29   9.191  -7.351  12.690
  206    HE2  LYS  29           2HE      LYS  29   7.071  -8.470  12.832
  207    HE3  LYS  29           1HE      LYS  29   7.743  -9.928  12.103
  208    HZ1  LYS  29           3HZ      LYS  29   9.359  -9.684  14.170
  209    HZ2  LYS  29           1HZ      LYS  29   7.891 -10.519  14.265
  210    HZ3  LYS  29           2HZ      LYS  29   7.996  -8.928  14.828
  211    H    ASP  30           H        ASP  30   9.066  -8.746   6.801
  212    HA   ASP  30           HA       ASP  30  11.738  -9.577   6.053
  213    HB2  ASP  30           2HB      ASP  30   9.715 -10.631   4.311
  214    HB3  ASP  30           1HB      ASP  30  10.675 -11.505   5.493
  215    H    ALA  31           H        ALA  31  12.897  -8.386   4.593
  216    HA   ALA  31           HA       ALA  31  12.031  -6.274   3.169
  217    HB1  ALA  31           1HB      ALA  31  14.331  -8.117   2.844
  218    HB2  ALA  31           2HB      ALA  31  14.276  -6.394   3.188
  219    HB3  ALA  31           3HB      ALA  31  14.012  -6.960   1.548
  220    H    GLU  32           H        GLU  32  12.433  -9.469   1.404
  221    HA   GLU  32           HA       GLU  32  11.197  -8.601  -0.935
  222    HB2  GLU  32           2HB      GLU  32  12.313 -10.661  -0.985
  223    HB3  GLU  32           1HB      GLU  32  11.403 -11.371   0.288
  224    HG2  GLU  32           2HG      GLU  32  10.139 -10.588  -2.318
  225    HG3  GLU  32           1HG      GLU  32  10.950 -12.136  -2.102
  226    H    LEU  33           H        LEU  33   9.291 -10.526   1.554
  227    HA   LEU  33           HA       LEU  33   6.929 -10.292   0.322
  228    HB2  LEU  33           2HB      LEU  33   7.467 -11.047   2.750
  229    HB3  LEU  33           1HB      LEU  33   7.143  -9.391   3.187
  230    HG   LEU  33           HG       LEU  33   4.955  -9.701   3.162
  231   HD11  LEU  33          1HD1      LEU  33   4.824  -9.589   0.739
  232   HD12  LEU  33          2HD1      LEU  33   3.731 -10.840   1.331
  233   HD13  LEU  33          3HD1      LEU  33   5.272 -11.288   0.614
  234   HD21  LEU  33          3HD2      LEU  33   4.203 -12.124   3.156
  235   HD22  LEU  33          1HD2      LEU  33   5.365 -11.618   4.379
  236   HD23  LEU  33          2HD2      LEU  33   5.908 -12.513   2.958
  237    H    ARG  34           H        ARG  34   8.713  -7.770   1.830
  238    HA   ARG  34           HA       ARG  34   6.854  -5.670   1.723
  239    HB2  ARG  34           2HB      ARG  34   8.467  -4.341   2.586
  240    HB3  ARG  34           1HB      ARG  34   9.289  -5.862   2.853
  241    HG2  ARG  34           2HG      ARG  34  11.021  -4.944   1.802
  242    HG3  ARG  34           1HG      ARG  34  10.110  -5.100   0.312
  243    HD2  ARG  34           2HD      ARG  34   9.579  -2.897   0.243
  244    HD3  ARG  34           1HD      ARG  34   9.554  -2.744   1.995
  245    HE   ARG  34           HE       ARG  34  11.863  -2.395   1.996
  246   HH11  ARG  34          1HH1      ARG  34  10.662  -2.937  -1.241
  247   HH12  ARG  34          2HH1      ARG  34  12.081  -2.303  -2.003
  248   HH21  ARG  34          1HH2      ARG  34  13.721  -1.566   0.995
  249   HH22  ARG  34          2HH2      ARG  34  13.821  -1.527  -0.733
  250    H    ARG  35           H        ARG  35   9.524  -6.350  -0.483
  251    HA   ARG  35           HA       ARG  35   8.824  -4.389  -2.291
  252    HB2  ARG  35           2HB      ARG  35  10.027  -5.684  -4.018
  253    HB3  ARG  35           1HB      ARG  35  10.951  -5.477  -2.543
  254    HG2  ARG  35           2HG      ARG  35  11.342  -7.667  -3.224
  255    HG3  ARG  35           1HG      ARG  35  10.193  -7.794  -1.906
  256    HD2  ARG  35           2HD      ARG  35   9.786  -9.220  -3.983
  257    HD3  ARG  35           1HD      ARG  35   8.423  -8.321  -3.346
  258    HE   ARG  35           HE       ARG  35   8.382  -7.077  -5.269
  259   HH11  ARG  35          1HH1      ARG  35  11.428  -8.771  -5.076
  260   HH12  ARG  35          2HH1      ARG  35  11.920  -8.327  -6.674
  261   HH21  ARG  35          1HH2      ARG  35   9.029  -6.490  -7.371
  262   HH22  ARG  35          2HH2      ARG  35  10.559  -7.031  -7.978
  263    H    LEU  36           H        LEU  36   7.536  -7.636  -1.736
  264    HA   LEU  36           HA       LEU  36   5.994  -7.685  -4.177
  265    HB2  LEU  36           2HB      LEU  36   5.588  -8.978  -1.503
  266    HB3  LEU  36           1HB      LEU  36   4.331  -9.056  -2.713
  267    HG   LEU  36           HG       LEU  36   7.144 -10.105  -3.015
  268   HD11  LEU  36          1HD1      LEU  36   5.846 -11.486  -1.532
  269   HD12  LEU  36          2HD1      LEU  36   6.008 -12.299  -3.087
  270   HD13  LEU  36          3HD1      LEU  36   4.494 -11.499  -2.666
  271   HD21  LEU  36          3HD2      LEU  36   6.667  -9.649  -5.188
  272   HD22  LEU  36          1HD2      LEU  36   4.920  -9.687  -4.930
  273   HD23  LEU  36          2HD2      LEU  36   5.828 -11.194  -5.054
  274    H    TRP  37           H        TRP  37   5.156  -6.382  -0.974
  275    HA   TRP  37           HA       TRP  37   2.621  -5.496  -1.794
  276    HB2  TRP  37           2HB      TRP  37   4.521  -4.603   0.362
  277    HB3  TRP  37           1HB      TRP  37   3.012  -3.748   0.064
  278    HD1  TRP  37           HD       TRP  37   3.276  -7.541  -0.256
  279    HE1  TRP  37           1HE      TRP  37   1.879  -8.648   1.620
  280    HE3  TRP  37           3HE      TRP  37   1.879  -3.360   2.331
  281    HZ2  TRP  37           2HZ      TRP  37   0.345  -7.824   3.862
  282    HZ3  TRP  37           3HZ      TRP  37   0.480  -3.609   4.297
  283    HH2  TRP  37           HH       TRP  37  -0.295  -5.752   5.038
  284    H    LEU  38           H        LEU  38   5.917  -4.035  -2.037
  285    HA   LEU  38           HA       LEU  38   5.474  -1.454  -2.729
  286    HB2  LEU  38           2HB      LEU  38   7.249  -3.478  -4.100
  287    HB3  LEU  38           1HB      LEU  38   7.184  -1.826  -4.604
  288    HG   LEU  38           HG       LEU  38   8.060  -2.844  -1.923
  289   HD11  LEU  38          1HD1      LEU  38  10.040  -1.267  -2.917
  290   HD12  LEU  38          2HD1      LEU  38   9.409  -2.010  -4.387
  291   HD13  LEU  38          3HD1      LEU  38   9.983  -3.023  -3.065
  292   HD21  LEU  38          3HD2      LEU  38   8.648  -0.335  -1.659
  293   HD22  LEU  38          1HD2      LEU  38   7.000  -0.875  -1.338
  294   HD23  LEU  38          2HD2      LEU  38   7.389  -0.089  -2.869
  295    H    LYS  39           H        LYS  39   5.071  -4.346  -4.914
  296    HA   LYS  39           HA       LYS  39   4.156  -3.107  -7.152
  297    HB2  LYS  39           2HB      LYS  39   4.024  -5.750  -5.883
  298    HB3  LYS  39           1HB      LYS  39   2.779  -5.479  -7.078
  299    HG2  LYS  39           2HG      LYS  39   5.044  -6.569  -7.697
  300    HG3  LYS  39           1HG      LYS  39   4.290  -5.414  -8.805
  301    HD2  LYS  39           2HD      LYS  39   5.928  -3.940  -7.013
  302    HD3  LYS  39           1HD      LYS  39   6.865  -5.327  -7.561
  303    HE2  LYS  39           2HE      LYS  39   5.782  -4.531  -9.895
  304    HE3  LYS  39           1HE      LYS  39   5.888  -2.982  -9.059
  305    HZ1  LYS  39           3HZ      LYS  39   8.091  -4.858  -9.695
  306    HZ2  LYS  39           1HZ      LYS  39   8.269  -3.584  -8.596
  307    HZ3  LYS  39           2HZ      LYS  39   7.903  -3.259 -10.214
  308    H    ASN  40           H        ASN  40   2.000  -4.518  -4.700
  309    HA   ASN  40           HA       ASN  40  -0.363  -3.617  -5.855
  310    HB2  ASN  40           2HB      ASN  40  -0.766  -3.834  -3.030
  311    HB3  ASN  40           1HB      ASN  40  -1.274  -4.928  -4.303
  312   HD21  ASN  40          1HD2      ASN  40  -0.831  -6.200  -2.091
  313   HD22  ASN  40          2HD2      ASN  40   0.703  -6.986  -2.051
  314    H    VAL  41           H        VAL  41   1.796  -1.975  -3.695
  315    HA   VAL  41           HA       VAL  41  -0.193  -0.013  -3.080
  316    HB   VAL  41           HB       VAL  41   1.824  -0.767  -1.567
  317   HG11  VAL  41          1HG1      VAL  41   3.574   0.872  -1.505
  318   HG12  VAL  41          2HG1      VAL  41   2.797   1.806  -2.784
  319   HG13  VAL  41          3HG1      VAL  41   3.479   0.230  -3.143
  320   HG21  VAL  41          3HG2      VAL  41   1.115   0.928  -0.145
  321   HG22  VAL  41          1HG2      VAL  41  -0.239   0.806  -1.278
  322   HG23  VAL  41          2HG2      VAL  41   0.953   2.096  -1.459
  323    H    SER  42           H        SER  42   2.220  -0.168  -5.625
  324    HA   SER  42           HA       SER  42   1.227   1.971  -6.988
  325    HB2  SER  42           2HB      SER  42   1.540   3.922  -5.911
  326    HB3  SER  42           1HB      SER  42   2.300   3.080  -4.550
  327    HG   SER  42           HG       SER  42   3.450   4.749  -6.182
  328    H    ARG  43           H        ARG  43   4.833   2.459  -6.431
  329    HA   ARG  43           HA       ARG  43   5.490   0.533  -8.430
  330    HB2  ARG  43           2HB      ARG  43   4.226   2.594  -9.565
  331    HB3  ARG  43           1HB      ARG  43   5.853   3.258  -9.545
  332    HG2  ARG  43           2HG      ARG  43   5.874   2.237 -11.573
  333    HG3  ARG  43           1HG      ARG  43   6.466   0.912 -10.567
  334    HD2  ARG  43           2HD      ARG  43   3.619   0.848 -10.566
  335    HD3  ARG  43           1HD      ARG  43   4.172   0.981 -12.234
  336    HE   ARG  43           HE       ARG  43   5.722  -0.980 -11.053
  337   HH11  ARG  43          1HH1      ARG  43   2.337  -0.461 -11.730
  338   HH12  ARG  43          2HH1      ARG  43   1.984  -2.148 -11.891
  339   HH21  ARG  43          1HH2      ARG  43   5.257  -3.199 -11.263
  340   HH22  ARG  43          2HH2      ARG  43   3.640  -3.703 -11.625
  341    H    ALA  44           H        ALA  44   6.842   0.651  -6.196
  342    HA   ALA  44           HA       ALA  44   8.723   2.344  -5.416
  343    HB1  ALA  44           1HB      ALA  44  10.235   0.277  -5.091
  344    HB2  ALA  44           2HB      ALA  44   8.901  -0.627  -5.809
  345    HB3  ALA  44           3HB      ALA  44   8.646   0.290  -4.324
  346    H    GLY  45           H        GLY  45   9.121   3.619  -7.664
  347    HA2  GLY  45           2HA      GLY  45  10.690   2.497  -9.677
  348    HA3  GLY  45           1HA      GLY  45  10.625   4.205  -9.276
  349    H    VAL  46           H        VAL  46  11.611   3.665  -6.526
  350    HA   VAL  46           HA       VAL  46  13.598   3.683  -5.412
  351    HB   VAL  46           HB       VAL  46  15.055   2.007  -7.357
  352   HG11  VAL  46          1HG1      VAL  46  14.633   2.162  -4.413
  353   HG12  VAL  46          2HG1      VAL  46  16.132   2.203  -5.340
  354   HG13  VAL  46          3HG1      VAL  46  15.269   0.680  -5.126
  355   HG21  VAL  46          3HG2      VAL  46  13.047   0.916  -7.793
  356   HG22  VAL  46          1HG2      VAL  46  12.462   1.129  -6.142
  357   HG23  VAL  46          2HG2      VAL  46  13.748  -0.030  -6.479
  358    H    SER  47           H        SER  47  13.093   5.561  -7.655
  359    HA   SER  47           HA       SER  47  15.678   6.788  -7.681
  360    HB2  SER  47           2HB      SER  47  16.437   6.340  -9.817
  361    HB3  SER  47           1HB      SER  47  15.622   4.810  -9.479
  362    HG   SER  47           HG       SER  47  14.689   6.983 -11.036
  363    H    GLY  48           H        GLY  48  12.699   6.654  -9.965
  364    HA2  GLY  48           2HA      GLY  48  11.366   8.829  -9.153
  365    HA3  GLY  48           1HA      GLY  48  12.736   9.565  -9.969
  366    H    CYS  49           H        CYS  49   9.658   9.047 -10.435
  367    HA   CYS  49           HA       CYS  49   9.986   8.523 -13.313
  368    HB2  CYS  49           2HB      CYS  49   8.947   6.593 -12.009
  369    HB3  CYS  49           1HB      CYS  49   7.566   7.650 -11.737
  370    HG   CYS  49           HG       CYS  49   8.385   6.489 -14.495
  371    H    PHE  50           H        PHE  50   7.477   9.593 -11.013
  372    HA   PHE  50           HA       PHE  50   7.069  11.977 -12.724
  373    HB2  PHE  50           2HB      PHE  50   5.262   9.958 -12.594
  374    HB3  PHE  50           1HB      PHE  50   4.724  10.916 -11.218
  375    HD1  PHE  50           1HD      PHE  50   5.746  11.390 -14.776
  376    HD2  PHE  50           2HD      PHE  50   3.164  12.551 -11.598
  377    HE1  PHE  50           1HE      PHE  50   4.553  12.904 -16.304
  378    HE2  PHE  50           2HE      PHE  50   1.966  14.067 -13.122
  379    HZ   PHE  50           HZ       PHE  50   2.660  14.245 -15.479
  380    H    SER  51           H        SER  51   6.149  10.631  -9.419
  381    HA   SER  51           HA       SER  51   6.539  13.356  -8.382
  382    HB2  SER  51           2HB      SER  51   5.034  10.976  -7.282
  383    HB3  SER  51           1HB      SER  51   5.303  12.461  -6.370
  384    HG   SER  51           HG       SER  51   3.924  12.209  -8.838
  385    H    THR  52           H        THR  52   8.066  10.340  -8.533
  386    HA   THR  52           HA       THR  52   9.952   9.505  -7.571
  387    HB   THR  52           HB       THR  52  10.581  11.917  -5.995
  388    HG1  THR  52           1HG      THR  52  10.157  12.015  -8.785
  389   HG21  THR  52          3HG2      THR  52  12.493  11.491  -7.977
  390   HG22  THR  52          1HG2      THR  52  11.982   9.886  -7.454
  391   HG23  THR  52          2HG2      THR  52  12.590  11.045  -6.273
  392    H    PHE  53           H        PHE  53   7.761   8.684  -6.328
  393    HA   PHE  53           HA       PHE  53   7.823   9.294  -3.501
  394    HB2  PHE  53           2HB      PHE  53   5.968   7.644  -3.381
  395    HB3  PHE  53           1HB      PHE  53   5.660   8.916  -4.559
  396    HD1  PHE  53           1HD      PHE  53   6.667   5.384  -4.155
  397    HD2  PHE  53           2HD      PHE  53   5.377   8.410  -6.852
  398    HE1  PHE  53           1HE      PHE  53   6.317   3.678  -5.878
  399    HE2  PHE  53           2HE      PHE  53   5.011   6.703  -8.588
  400    HZ   PHE  53           HZ       PHE  53   5.481   4.338  -8.099
  401    H    GLN  54           H        GLN  54  10.284   8.197  -4.382
  402    HA   GLN  54           HA       GLN  54  10.897   5.622  -4.356
  403    HB2  GLN  54           2HB      GLN  54  12.174   7.983  -3.277
  404    HB3  GLN  54           1HB      GLN  54  12.614   6.553  -2.357
  405    HG2  GLN  54           2HG      GLN  54  13.359   5.452  -4.390
  406    HG3  GLN  54           1HG      GLN  54  12.876   6.856  -5.340
  407   HE21  GLN  54          1HE2      GLN  54  14.597   6.549  -2.256
  408   HE22  GLN  54          2HE2      GLN  54  16.000   7.424  -2.754
  409    HA   PRO  55           HA       PRO  55   8.969   3.740  -0.807
  410    HB2  PRO  55           2HB      PRO  55  10.699   1.433  -1.166
  411    HB3  PRO  55           1HB      PRO  55   8.961   1.574  -1.424
  412    HG2  PRO  55           2HG      PRO  55  10.765   1.271  -3.449
  413    HG3  PRO  55           1HG      PRO  55   9.189   2.059  -3.630
  414    HD2  PRO  55           2HD      PRO  55  11.901   3.279  -3.388
  415    HD3  PRO  55           1HD      PRO  55  10.500   3.803  -4.345
  416    H    THR  56           H        THR  56  12.363   4.273  -1.164
  417    HA   THR  56           HA       THR  56  13.476   3.222   1.137
  418    HB   THR  56           HB       THR  56  14.012   5.994  -0.004
  419    HG1  THR  56           1HG      THR  56  14.354   4.646  -1.662
  420   HG21  THR  56          3HG2      THR  56  16.022   6.030   1.062
  421   HG22  THR  56          1HG2      THR  56  16.113   4.274   1.190
  422   HG23  THR  56          2HG2      THR  56  15.051   5.183   2.264
  423    H    THR  57           H        THR  57  11.623   6.358   0.770
  424    HA   THR  57           HA       THR  57  11.883   7.261   3.383
  425    HB   THR  57           HB       THR  57  10.913   8.644   1.651
  426    HG1  THR  57           1HG      THR  57   9.169   9.440   2.802
  427   HG21  THR  57          3HG2      THR  57   8.243   7.657   1.532
  428   HG22  THR  57          1HG2      THR  57   9.356   6.390   1.017
  429   HG23  THR  57          2HG2      THR  57   9.378   7.961   0.218
  430    H    GLY  58           H        GLY  58  10.021   4.616   2.115
  431    HA2  GLY  58           2HA      GLY  58   9.388   2.902   3.772
  432    HA3  GLY  58           1HA      GLY  58   8.902   4.220   4.811
  433    H    HIS  59           H        HIS  59   7.816   2.376   1.855
  434    HA   HIS  59           HA       HIS  59   5.444   3.994   1.732
  435    HB2  HIS  59           2HB      HIS  59   6.646   1.940   0.071
  436    HB3  HIS  59           1HB      HIS  59   4.923   1.660   0.283
  437    HD1  HIS  59           1HD      HIS  59   7.056   4.716  -0.435
  438    HD2  HIS  59           2HD      HIS  59   3.538   2.894  -1.758
  439    HE1  HIS  59           1HE      HIS  59   6.181   6.180  -2.267
  440    HE2  HIS  59           2HE      HIS  59   4.111   5.019  -3.109
  441    H    ARG  60           H        ARG  60   3.552   3.630   2.498
  442    HA   ARG  60           HA       ARG  60   3.100   1.321   4.277
  443    HB2  ARG  60           2HB      ARG  60   1.847   2.768   5.680
  444    HB3  ARG  60           1HB      ARG  60   3.268   3.679   5.233
  445    HG2  ARG  60           2HG      ARG  60   1.734   4.572   3.309
  446    HG3  ARG  60           1HG      ARG  60   0.455   4.107   4.429
  447    HD2  ARG  60           2HD      ARG  60   2.662   6.102   4.819
  448    HD3  ARG  60           1HD      ARG  60   0.922   6.353   4.948
  449    HE   ARG  60           HE       ARG  60   1.338   4.611   6.919
  450   HH11  ARG  60          1HH1      ARG  60   3.089   7.508   6.056
  451   HH12  ARG  60          2HH1      ARG  60   3.589   7.836   7.680
  452   HH21  ARG  60          1HH2      ARG  60   1.996   5.043   9.050
  453   HH22  ARG  60          2HH2      ARG  60   2.968   6.437   9.382
  454    H    LEU  61           H        LEU  61   0.538   0.899   4.393
  455    HA   LEU  61           HA       LEU  61  -0.444   0.895   1.618
  456    HB2  LEU  61           2HB      LEU  61  -0.016  -1.117   3.523
  457    HB3  LEU  61           1HB      LEU  61  -1.749  -0.945   3.462
  458    HG   LEU  61           HG       LEU  61  -0.110  -2.475   1.781
  459   HD11  LEU  61          1HD1      LEU  61  -2.304  -3.019   0.774
  460   HD12  LEU  61          2HD1      LEU  61  -2.994  -1.830   1.893
  461   HD13  LEU  61          3HD1      LEU  61  -2.149  -3.229   2.504
  462   HD21  LEU  61          3HD2      LEU  61  -1.013  -1.704  -0.416
  463   HD22  LEU  61          1HD2      LEU  61   0.330  -0.791   0.260
  464   HD23  LEU  61          2HD2      LEU  61  -1.310  -0.150   0.362
  465    H    CYS  62           H        CYS  62  -3.010   1.083   1.387
  466    HA   CYS  62           HA       CYS  62  -4.032   2.491   3.711
  467    HB2  CYS  62           2HB      CYS  62  -4.594   4.280   2.536
  468    HB3  CYS  62           1HB      CYS  62  -3.479   3.629   1.362
  469    H    SER  63           H        SER  63  -6.604   2.687   3.508
  470    HA   SER  63           HA       SER  63  -7.512   0.575   4.733
  471    HB2  SER  63           2HB      SER  63  -8.572   3.017   3.757
  472    HB3  SER  63           1HB      SER  63  -9.804   1.772   3.600
  473    HG   SER  63           HG       SER  63  -8.989   3.007   5.803
  474    H    VAL  64           H        VAL  64  -9.581   1.127   2.163
  475    HA   VAL  64           HA       VAL  64 -10.725  -1.361   2.264
  476    HB   VAL  64           HB       VAL  64 -11.923  -0.680   0.136
  477   HG11  VAL  64          1HG1      VAL  64 -11.994   1.266   2.432
  478   HG12  VAL  64          2HG1      VAL  64 -12.671  -0.360   2.515
  479   HG13  VAL  64          3HG1      VAL  64 -13.318   0.807   1.362
  480   HG21  VAL  64          3HG2      VAL  64  -9.790   1.172   0.122
  481   HG22  VAL  64          1HG2      VAL  64 -11.283   2.073   0.408
  482   HG23  VAL  64          2HG2      VAL  64 -11.138   1.027  -1.009
  483    H    HIS  65           H        HIS  65  -8.011  -1.984   1.498
  484    HA   HIS  65           HA       HIS  65  -8.730  -3.623  -0.872
  485    HB2  HIS  65           2HB      HIS  65  -5.995  -3.379  -1.075
  486    HB3  HIS  65           1HB      HIS  65  -7.205  -2.602  -2.075
  487    HD1  HIS  65           1HD      HIS  65  -8.204  -0.393  -0.423
  488    HD2  HIS  65           2HD      HIS  65  -4.208  -1.450  -0.571
  489    HE1  HIS  65           1HE      HIS  65  -6.959   1.571   0.460
  490    H    PHE  66           H        PHE  66  -9.137  -4.381   1.694
  491    HA   PHE  66           HA       PHE  66  -7.125  -6.505   2.101
  492    HB2  PHE  66           2HB      PHE  66  -8.392  -4.616   4.016
  493    HB3  PHE  66           1HB      PHE  66  -8.141  -6.274   4.557
  494    HD1  PHE  66           1HD      PHE  66  -5.696  -7.187   3.781
  495    HD2  PHE  66           2HD      PHE  66  -6.750  -3.145   4.602
  496    HE1  PHE  66           1HE      PHE  66  -3.335  -6.662   4.257
  497    HE2  PHE  66           2HE      PHE  66  -4.395  -2.628   5.087
  498    HZ   PHE  66           HZ       PHE  66  -2.689  -4.395   4.923
  499    H    GLN  67           H        GLN  67  -8.793  -7.792   0.603
  500    HA   GLN  67           HA       GLN  67 -11.434  -8.065   1.359
  501    HB2  GLN  67           2HB      GLN  67 -11.482 -10.032  -0.102
  502    HB3  GLN  67           1HB      GLN  67 -10.574  -8.719  -0.840
  503    HG2  GLN  67           2HG      GLN  67  -8.943 -10.171  -1.196
  504    HG3  GLN  67           1HG      GLN  67  -8.667 -10.180   0.546
  505   HE21  GLN  67          1HE2      GLN  67  -9.465 -11.876   1.782
  506   HE22  GLN  67          2HE2      GLN  67  -9.985 -13.365   1.078
  507    H    GLY  68           H        GLY  68 -12.540  -9.986   2.670
  508    HA2  GLY  68           2HA      GLY  68 -12.505 -11.712   4.171
  509    HA3  GLY  68           1HA      GLY  68 -10.790 -11.920   3.877
  510    H    GLY  69           H        GLY  69  -9.342 -10.117   4.985
  511    HA2  GLY  69           2HA      GLY  69  -9.525  -8.384   6.794
  512    HA3  GLY  69           1HA      GLY  69 -10.548  -9.549   7.622
  513    H    ARG  70           H        ARG  70  -7.838  -8.276   8.231
  514    HA   ARG  70           HA       ARG  70  -5.897  -8.879   9.245
  515    HB2  ARG  70           2HB      ARG  70  -6.580 -11.722   9.630
  516    HB3  ARG  70           1HB      ARG  70  -6.105 -10.514  10.816
  517    HG2  ARG  70           2HG      ARG  70  -8.549  -9.626  10.346
  518    HG3  ARG  70           1HG      ARG  70  -8.791 -11.310   9.878
  519    HD2  ARG  70           2HD      ARG  70  -8.086 -12.082  12.028
  520    HD3  ARG  70           1HD      ARG  70  -7.571 -10.462  12.497
  521    HE   ARG  70           HE       ARG  70 -10.363 -10.641  11.837
  522   HH11  ARG  70          1HH1      ARG  70  -7.992 -11.016  14.370
  523   HH12  ARG  70          2HH1      ARG  70  -9.133 -10.764  15.648
  524   HH21  ARG  70          1HH2      ARG  70 -11.867 -10.310  13.517
  525   HH22  ARG  70          2HH2      ARG  70 -11.332 -10.363  15.165
  526    H    LYS  71           H        LYS  71  -4.112 -10.882   9.083
  527    HA   LYS  71           HA       LYS  71  -3.975 -11.423   6.199
  528    HB2  LYS  71           2HB      LYS  71  -1.572 -11.230   7.995
  529    HB3  LYS  71           1HB      LYS  71  -1.640 -11.134   6.241
  530    HG2  LYS  71           2HG      LYS  71  -3.160  -9.113   7.723
  531    HG3  LYS  71           1HG      LYS  71  -1.402  -8.995   7.790
  532    HD2  LYS  71           2HD      LYS  71  -2.001  -7.693   5.943
  533    HD3  LYS  71           1HD      LYS  71  -1.498  -9.228   5.237
  534    HE2  LYS  71           2HE      LYS  71  -4.130  -9.697   5.635
  535    HE3  LYS  71           1HE      LYS  71  -4.152  -7.968   5.344
  536    HZ1  LYS  71           3HZ      LYS  71  -2.595  -8.709   3.356
  537    HZ2  LYS  71           1HZ      LYS  71  -4.282  -8.684   3.217
  538    HZ3  LYS  71           2HZ      LYS  71  -3.479 -10.140   3.523
  539    H    THR  72           H        THR  72  -5.292 -13.307   6.897
  540    HA   THR  72           HA       THR  72  -4.126 -15.432   8.366
  541    HB   THR  72           HB       THR  72  -5.995 -16.740   7.649
  542    HG1  THR  72           1HG      THR  72  -6.877 -16.522   5.758
  543   HG21  THR  72          3HG2      THR  72  -6.529 -14.749   9.100
  544   HG22  THR  72          1HG2      THR  72  -7.872 -15.438   8.187
  545   HG23  THR  72          2HG2      THR  72  -7.098 -13.953   7.632
  546    H    TYR  73           H        TYR  73  -5.029 -17.300   5.972
  547    HA   TYR  73           HA       TYR  73  -2.326 -17.543   4.915
  548    HB2  TYR  73           2HB      TYR  73  -3.580 -19.664   3.834
  549    HB3  TYR  73           1HB      TYR  73  -2.872 -19.683   5.444
  550    HD1  TYR  73           1HD      TYR  73  -4.339 -19.444   7.436
  551    HD2  TYR  73           2HD      TYR  73  -5.936 -19.839   3.513
  552    HE1  TYR  73           1HE      TYR  73  -6.524 -20.036   8.393
  553    HE2  TYR  73           2HE      TYR  73  -8.128 -20.433   4.461
  554    HH   TYR  73           HH       TYR  73  -8.866 -20.042   7.774
  555    H    THR  74           H        THR  74  -5.652 -17.286   3.727
  556    HA   THR  74           HA       THR  74  -4.850 -17.117   0.981
  557    HB   THR  74           HB       THR  74  -7.443 -16.020   1.271
  558    HG1  THR  74           1HG      THR  74  -7.120 -18.339   2.865
  559   HG21  THR  74          3HG2      THR  74  -8.180 -18.252   0.427
  560   HG22  THR  74          1HG2      THR  74  -6.498 -18.769   0.525
  561   HG23  THR  74          2HG2      THR  74  -6.953 -17.446  -0.549
  562    H    VAL  75           H        VAL  75  -6.186 -14.759   3.294
  563    HA   VAL  75           HA       VAL  75  -5.589 -12.539   1.520
  564    HB   VAL  75           HB       VAL  75  -7.645 -12.577   2.873
  565   HG11  VAL  75          1HG1      VAL  75  -5.909 -13.432   4.921
  566   HG12  VAL  75          2HG1      VAL  75  -7.669 -13.317   4.932
  567   HG13  VAL  75          3HG1      VAL  75  -6.695 -11.946   5.454
  568   HG21  VAL  75          3HG2      VAL  75  -5.812 -10.328   3.733
  569   HG22  VAL  75          1HG2      VAL  75  -7.559 -10.359   3.934
  570   HG23  VAL  75          2HG2      VAL  75  -6.869 -10.349   2.317
  571    H    ARG  76           H        ARG  76  -3.271 -12.465   1.379
  572    HA   ARG  76           HA       ARG  76  -1.977 -11.693   3.925
  573    HB2  ARG  76           2HB      ARG  76   0.111 -12.625   2.407
  574    HB3  ARG  76           1HB      ARG  76  -0.706 -13.540   3.664
  575    HG2  ARG  76           2HG      ARG  76  -1.715 -14.927   2.194
  576    HG3  ARG  76           1HG      ARG  76  -1.894 -13.674   0.964
  577    HD2  ARG  76           2HD      ARG  76   0.449 -13.853   0.389
  578    HD3  ARG  76           1HD      ARG  76   0.704 -15.022   1.686
  579    HE   ARG  76           HE       ARG  76  -0.065 -16.645   0.286
  580   HH11  ARG  76          1HH1      ARG  76  -1.228 -13.566  -0.877
  581   HH12  ARG  76          2HH1      ARG  76  -1.946 -14.234  -2.304
  582   HH21  ARG  76          1HH2      ARG  76  -1.006 -17.525  -1.590
  583   HH22  ARG  76          2HH2      ARG  76  -1.819 -16.481  -2.710
  584    H    VAL  77           H        VAL  77  -1.942 -11.384   0.368
  585    HA   VAL  77           HA       VAL  77  -0.586  -8.803   0.740
  586    HB   VAL  77           HB       VAL  77   0.607  -9.103  -1.198
  587   HG11  VAL  77          1HG1      VAL  77  -0.166 -11.957  -1.293
  588   HG12  VAL  77          2HG1      VAL  77   0.595 -11.334   0.171
  589   HG13  VAL  77          3HG1      VAL  77   1.423 -11.199  -1.378
  590   HG21  VAL  77          3HG2      VAL  77  -1.310  -8.849  -2.645
  591   HG22  VAL  77          1HG2      VAL  77  -1.754 -10.536  -2.397
  592   HG23  VAL  77          2HG2      VAL  77  -0.256 -10.130  -3.234
  593    HA   PRO  78           HA       PRO  78  -4.584  -6.898  -0.081
  594    HB2  PRO  78           2HB      PRO  78  -2.734  -4.630  -0.656
  595    HB3  PRO  78           1HB      PRO  78  -4.176  -4.649   0.358
  596    HG2  PRO  78           2HG      PRO  78  -1.853  -4.687   1.544
  597    HG3  PRO  78           1HG      PRO  78  -3.051  -5.892   2.060
  598    HD2  PRO  78           2HD      PRO  78  -0.775  -6.195   0.129
  599    HD3  PRO  78           1HD      PRO  78  -1.169  -7.200   1.550
  600    H    THR  79           H        THR  79  -4.344  -8.359  -2.336
  601    HA   THR  79           HA       THR  79  -4.186  -6.128  -4.259
  602    HB   THR  79           HB       THR  79  -4.237  -8.847  -5.378
  603    HG1  THR  79           1HG      THR  79  -2.666  -9.573  -4.232
  604   HG21  THR  79          3HG2      THR  79  -3.074  -7.947  -7.056
  605   HG22  THR  79          1HG2      THR  79  -2.012  -7.042  -5.975
  606   HG23  THR  79          2HG2      THR  79  -3.613  -6.413  -6.370
  607    H    ILE  80           H        ILE  80  -5.933  -5.380  -4.417
  608    HA   ILE  80           HA       ILE  80  -8.224  -6.803  -5.515
  609    HB   ILE  80           HB       ILE  80  -8.210  -5.048  -3.149
  610   HG12  ILE  80          2HG1      ILE  80  -9.934  -7.113  -4.421
  611   HG13  ILE  80          1HG1      ILE  80  -9.340  -7.017  -2.774
  612   HG21  ILE  80          1HG2      ILE  80  -8.995  -3.574  -5.218
  613   HG22  ILE  80          2HG2      ILE  80  -9.758  -3.453  -3.642
  614   HG23  ILE  80          3HG2      ILE  80 -10.510  -4.411  -4.914
  615   HD11  ILE  80          3HD1      ILE  80 -11.648  -5.495  -3.966
  616   HD12  ILE  80          1HD1      ILE  80 -11.017  -5.228  -2.343
  617   HD13  ILE  80          2HD1      ILE  80 -11.724  -6.786  -2.770
  618    H    PHE  81           H        PHE  81  -9.004  -5.515  -7.446
  619    HA   PHE  81           HA       PHE  81  -8.723  -3.985  -9.142
  620    HB2  PHE  81           2HB      PHE  81  -7.493  -1.813  -8.685
  621    HB3  PHE  81           1HB      PHE  81  -8.879  -2.103  -7.651
  622    HD1  PHE  81           2HD      PHE  81  -5.143  -2.609  -7.638
  623    HD2  PHE  81           1HD      PHE  81  -8.655  -1.690  -5.401
  624    HE1  PHE  81           2HE      PHE  81  -3.768  -2.304  -5.601
  625    HE2  PHE  81           1HE      PHE  81  -7.294  -1.389  -3.381
  626    HZ   PHE  81           HZ       PHE  81  -4.854  -1.736  -3.445
  Start of MODEL   18
    1    H1   GLY   1           1HT      GLY   1   7.748  15.885   6.869
    2    H2   GLY   1           2HT      GLY   1   8.470  15.218   5.492
    3    H3   GLY   1           3HT      GLY   1   9.433  15.882   6.714
    4    HA2  GLY   1           1HA      GLY   1   9.613  13.602   7.063
    5    HA3  GLY   1           2HA      GLY   1   8.440  14.152   8.249
    6    H    SER   2           H        SER   2   6.407  14.543   6.095
    7    HA   SER   2           HA       SER   2   5.916  11.834   5.162
    8    HB2  SER   2           2HB      SER   2   3.860  13.223   6.892
    9    HB3  SER   2           1HB      SER   2   3.786  11.585   6.244
   10    HG   SER   2           HG       SER   2   5.295  12.598   8.370
   11    HA   PRO   3           HA       PRO   3   4.355  15.239   2.385
   12    HB2  PRO   3           2HB      PRO   3   5.924  14.774   0.259
   13    HB3  PRO   3           1HB      PRO   3   6.490  15.726   1.638
   14    HG2  PRO   3           2HG      PRO   3   7.021  12.853   0.978
   15    HG3  PRO   3           1HG      PRO   3   8.148  14.094   1.555
   16    HD2  PRO   3           2HD      PRO   3   6.997  12.217   3.179
   17    HD3  PRO   3           1HD      PRO   3   7.524  13.815   3.743
   18    H    GLY   4           H        GLY   4   4.327  11.902   2.509
   19    HA2  GLY   4           2HA      GLY   4   2.452  10.690   1.689
   20    HA3  GLY   4           1HA      GLY   4   2.367  11.804   0.327
   21    H    PHE   5           H        PHE   5   2.245   9.299  -0.565
   22    HA   PHE   5           HA       PHE   5   4.800   8.901  -1.841
   23    HB2  PHE   5           2HB      PHE   5   3.819   6.424  -0.530
   24    HB3  PHE   5           1HB      PHE   5   5.453   6.926  -0.925
   25    HD1  PHE   5           1HD      PHE   5   2.681   7.545   1.452
   26    HD2  PHE   5           2HD      PHE   5   6.857   7.831   0.686
   27    HE1  PHE   5           1HE      PHE   5   3.061   8.188   3.796
   28    HE2  PHE   5           2HE      PHE   5   7.246   8.475   3.029
   29    HZ   PHE   5           HZ       PHE   5   5.347   8.653   4.587
   30    H    THR   6           H        THR   6   1.403   8.438  -1.846
   31    HA   THR   6           HA       THR   6  -0.022   7.881  -3.551
   32    HB   THR   6           HB       THR   6   2.127   6.846  -5.329
   33    HG1  THR   6           1HG      THR   6   1.815   9.614  -4.819
   34   HG21  THR   6          3HG2      THR   6  -0.082   8.819  -5.840
   35   HG22  THR   6          1HG2      THR   6  -0.203   7.080  -6.105
   36   HG23  THR   6          2HG2      THR   6   0.946   8.035  -7.039
   37    H    CYS   7           H        CYS   7  -1.185   6.179  -2.888
   38    HA   CYS   7           HA       CYS   7   0.004   3.556  -2.504
   39    HB2  CYS   7           2HB      CYS   7  -1.673   4.131  -0.867
   40    HB3  CYS   7           1HB      CYS   7  -2.874   4.512  -2.097
   41    H    CYS   8           H        CYS   8  -0.625   5.126  -5.220
   42    HA   CYS   8           HA       CYS   8  -1.332   4.566  -7.323
   43    HB2  CYS   8           2HB      CYS   8   0.474   2.993  -7.162
   44    HB3  CYS   8           1HB      CYS   8  -0.479   1.887  -6.185
   45    HG   CYS   8           HG       CYS   8  -0.417   0.963  -8.608
   46    H    VAL   9           H        VAL   9  -3.112   4.773  -5.149
   47    HA   VAL   9           HA       VAL   9  -5.154   2.802  -5.162
   48    HB   VAL   9           HB       VAL   9  -4.911   4.001  -3.160
   49   HG11  VAL   9          1HG1      VAL   9  -4.416   6.264  -4.953
   50   HG12  VAL   9          2HG1      VAL   9  -3.650   5.819  -3.427
   51   HG13  VAL   9          3HG1      VAL   9  -5.206   6.653  -3.426
   52   HG21  VAL   9          3HG2      VAL   9  -7.209   5.435  -4.495
   53   HG22  VAL   9          1HG2      VAL   9  -6.923   5.300  -2.753
   54   HG23  VAL   9          2HG2      VAL   9  -7.301   3.863  -3.710
   55    HA   PRO  10           HA       PRO  10  -7.004   4.689  -8.861
   56    HB2  PRO  10           2HB      PRO  10  -8.147   2.481  -9.820
   57    HB3  PRO  10           1HB      PRO  10  -6.396   2.706  -9.936
   58    HG2  PRO  10           2HG      PRO  10  -7.968   1.060  -7.992
   59    HG3  PRO  10           1HG      PRO  10  -6.458   0.662  -8.830
   60    HD2  PRO  10           2HD      PRO  10  -6.612   1.594  -6.233
   61    HD3  PRO  10           1HD      PRO  10  -5.184   1.730  -7.272
   62    H    GLY  11           H        GLY  11  -8.148   3.420  -6.006
   63    HA2  GLY  11           2HA      GLY  11 -10.533   4.852  -5.982
   64    HA3  GLY  11           1HA      GLY  11 -10.911   3.202  -6.453
   65    H    CYS  12           H        CYS  12  -8.387   2.530  -4.591
   66    HA   CYS  12           HA       CYS  12 -10.023   1.771  -2.455
   67    HB2  CYS  12           2HB      CYS  12  -7.866   1.251  -1.209
   68    HB3  CYS  12           1HB      CYS  12  -8.188   0.360  -2.676
   69    H    TYR  13           H        TYR  13 -10.688   2.674  -0.766
   70    HA   TYR  13           HA       TYR  13 -11.369   4.747   0.172
   71    HB2  TYR  13           2HB      TYR  13 -10.319   2.725   1.550
   72    HB3  TYR  13           1HB      TYR  13  -9.269   4.034   2.078
   73    HD1  TYR  13           1HD      TYR  13 -12.913   4.007   1.279
   74    HD2  TYR  13           2HD      TYR  13  -9.909   4.584   4.234
   75    HE1  TYR  13           1HE      TYR  13 -14.635   4.736   2.877
   76    HE2  TYR  13           2HE      TYR  13 -11.622   5.316   5.842
   77    HH   TYR  13           HH       TYR  13 -14.047   5.047   6.198
   78    H    ASN  14           H        ASN  14  -7.918   4.629   0.799
   79    HA   ASN  14           HA       ASN  14  -7.811   7.533   0.457
   80    HB2  ASN  14           2HB      ASN  14  -5.800   6.525   2.221
   81    HB3  ASN  14           1HB      ASN  14  -6.978   7.760   2.477
   82   HD21  ASN  14          1HD2      ASN  14  -6.553   4.307   2.459
   83   HD22  ASN  14          2HD2      ASN  14  -7.752   3.970   3.641
   84    H    ASN  15           H        ASN  15  -5.567   8.506  -0.072
   85    HA   ASN  15           HA       ASN  15  -4.197   6.552  -1.784
   86    HB2  ASN  15           2HB      ASN  15  -5.071   8.508  -2.978
   87    HB3  ASN  15           1HB      ASN  15  -4.205   9.580  -1.888
   88   HD21  ASN  15          1HD2      ASN  15  -4.147   8.188  -4.859
   89   HD22  ASN  15          2HD2      ASN  15  -2.459   8.307  -5.202
   90    H    SER  16           H        SER  16  -1.619   6.820  -1.838
   91    HA   SER  16           HA       SER  16  -0.689   6.926   0.834
   92    HB2  SER  16           2HB      SER  16   0.369   5.215  -0.443
   93    HB3  SER  16           1HB      SER  16   0.506   6.247  -1.831
   94    HG   SER  16           HG       SER  16   2.157   6.014   0.354
   95    H    HIS  17           H        HIS  17  -1.132   9.412  -1.477
   96    HA   HIS  17           HA       HIS  17   0.545  11.180   0.104
   97    HB2  HIS  17           2HB      HIS  17   1.961  11.914  -1.601
   98    HB3  HIS  17           1HB      HIS  17   1.886  10.187  -1.903
   99    HD1  HIS  17           1HD      HIS  17  -0.920  10.248  -3.365
  100    HD2  HIS  17           2HD      HIS  17   2.350  12.665  -4.223
  101    HE1  HIS  17           1HE      HIS  17  -1.233  10.982  -5.750
  102    HE2  HIS  17           2HE      HIS  17   0.709  12.518  -6.216
  103    H    ARG  18           H        ARG  18  -2.411  10.996  -0.438
  104    HA   ARG  18           HA       ARG  18  -2.712  13.490  -1.938
  105    HB2  ARG  18           2HB      ARG  18  -4.831  12.902  -2.594
  106    HB3  ARG  18           1HB      ARG  18  -4.045  11.339  -2.491
  107    HG2  ARG  18           2HG      ARG  18  -5.268  10.670  -0.673
  108    HG3  ARG  18           1HG      ARG  18  -5.571  12.324  -0.126
  109    HD2  ARG  18           2HD      ARG  18  -6.865  10.822  -2.378
  110    HD3  ARG  18           1HD      ARG  18  -7.628  11.525  -0.954
  111    HE   ARG  18           HE       ARG  18  -6.620  13.691  -2.166
  112   HH11  ARG  18          1HH1      ARG  18  -8.523  11.028  -3.385
  113   HH12  ARG  18          2HH1      ARG  18  -9.276  11.972  -4.624
  114   HH21  ARG  18          1HH2      ARG  18  -7.613  14.932  -3.799
  115   HH22  ARG  18          2HH2      ARG  18  -8.759  14.186  -4.862
  116    H    ASP  19           H        ASP  19  -4.079  12.116   1.133
  117    HA   ASP  19           HA       ASP  19  -4.315  14.924   1.990
  118    HB2  ASP  19           2HB      ASP  19  -6.091  12.642   2.162
  119    HB3  ASP  19           1HB      ASP  19  -6.006  13.596   3.640
  120    H    LYS  20           H        LYS  20  -2.214  12.463   2.755
  121    HA   LYS  20           HA       LYS  20  -1.152  11.764   4.631
  122    HB2  LYS  20           2HB      LYS  20   0.093  13.512   5.631
  123    HB3  LYS  20           1HB      LYS  20  -0.185  13.986   3.964
  124    HG2  LYS  20           2HG      LYS  20  -1.371  15.795   4.538
  125    HG3  LYS  20           1HG      LYS  20  -2.216  14.958   5.840
  126    HD2  LYS  20           2HD      LYS  20  -0.225  15.172   7.259
  127    HD3  LYS  20           1HD      LYS  20   0.605  16.022   5.955
  128    HE2  LYS  20           2HE      LYS  20  -1.977  16.969   7.183
  129    HE3  LYS  20           1HE      LYS  20  -0.387  17.489   7.739
  130    HZ1  LYS  20           3HZ      LYS  20  -1.339  17.812   4.948
  131    HZ2  LYS  20           1HZ      LYS  20   0.057  18.475   5.637
  132    HZ3  LYS  20           2HZ      LYS  20  -1.468  19.017   6.128
  133    H    ALA  21           H        ALA  21  -4.244  12.400   4.995
  134    HA   ALA  21           HA       ALA  21  -4.118  12.214   7.940
  135    HB1  ALA  21           1HB      ALA  21  -5.980  13.623   8.202
  136    HB2  ALA  21           2HB      ALA  21  -6.358  13.572   6.480
  137    HB3  ALA  21           3HB      ALA  21  -4.922  14.428   7.041
  138    H    LEU  22           H        LEU  22  -4.504  10.030   5.792
  139    HA   LEU  22           HA       LEU  22  -7.135   9.061   6.679
  140    HB2  LEU  22           2HB      LEU  22  -5.677   7.793   4.400
  141    HB3  LEU  22           1HB      LEU  22  -7.404   8.059   4.615
  142    HG   LEU  22           HG       LEU  22  -5.849  10.524   4.311
  143   HD11  LEU  22          1HD1      LEU  22  -4.832  10.141   2.380
  144   HD12  LEU  22          2HD1      LEU  22  -6.292   9.439   1.684
  145   HD13  LEU  22          3HD1      LEU  22  -5.173   8.431   2.601
  146   HD21  LEU  22          3HD2      LEU  22  -7.955  11.171   4.013
  147   HD22  LEU  22          1HD2      LEU  22  -8.518   9.507   3.928
  148   HD23  LEU  22          2HD2      LEU  22  -7.959  10.325   2.466
  149    H    HIS  23           H        HIS  23  -6.718   6.177   6.282
  150    HA   HIS  23           HA       HIS  23  -4.908   5.763   8.526
  151    HB2  HIS  23           2HB      HIS  23  -7.426   4.717   7.787
  152    HB3  HIS  23           1HB      HIS  23  -6.293   3.374   7.700
  153    HD1  HIS  23           1HD      HIS  23  -8.609   3.908   9.892
  154    HD2  HIS  23           2HD      HIS  23  -4.510   4.390  10.384
  155    HE1  HIS  23           1HE      HIS  23  -8.204   3.736  12.368
  156    HE2  HIS  23           2HE      HIS  23  -5.711   3.984  12.639
  157    H    PHE  24           H        PHE  24  -2.910   4.481   8.269
  158    HA   PHE  24           HA       PHE  24  -2.624   3.248   5.645
  159    HB2  PHE  24           2HB      PHE  24  -0.529   4.833   7.104
  160    HB3  PHE  24           1HB      PHE  24  -0.302   4.014   5.563
  161    HD1  PHE  24           2HD      PHE  24  -2.310   6.649   7.233
  162    HD2  PHE  24           1HD      PHE  24  -0.838   5.091   3.556
  163    HE1  PHE  24           2HE      PHE  24  -3.142   8.642   6.055
  164    HE2  PHE  24           1HE      PHE  24  -1.670   7.077   2.377
  165    HZ   PHE  24           HZ       PHE  24  -2.825   8.855   3.619
  166    H    TYR  25           H        TYR  25  -1.717   1.082   5.627
  167    HA   TYR  25           HA       TYR  25  -1.041  -0.060   8.199
  168    HB2  TYR  25           2HB      TYR  25  -1.274  -1.298   5.435
  169    HB3  TYR  25           1HB      TYR  25  -0.804  -2.197   6.870
  170    HD1  TYR  25           1HD      TYR  25  -3.496   0.349   6.322
  171    HD2  TYR  25           2HD      TYR  25  -2.515  -3.650   7.401
  172    HE1  TYR  25           1HE      TYR  25  -5.858  -0.086   6.836
  173    HE2  TYR  25           2HE      TYR  25  -4.878  -4.096   7.915
  174    HH   TYR  25           HH       TYR  25  -6.923  -2.606   8.618
  175    H    THR  26           H        THR  26   1.174  -1.213   8.462
  176    HA   THR  26           HA       THR  26   3.150   0.288   6.891
  177    HB   THR  26           HB       THR  26   4.389   0.526   8.769
  178    HG1  THR  26           1HG      THR  26   3.785  -2.169   9.400
  179   HG21  THR  26          3HG2      THR  26   2.125   0.982   9.661
  180   HG22  THR  26          1HG2      THR  26   3.288   0.452  10.877
  181   HG23  THR  26          2HG2      THR  26   2.078  -0.675  10.264
  182    H    PHE  27           H        PHE  27   5.387  -0.944   6.750
  183    HA   PHE  27           HA       PHE  27   4.782  -3.214   5.191
  184    HB2  PHE  27           2HB      PHE  27   6.655  -1.186   5.187
  185    HB3  PHE  27           1HB      PHE  27   7.547  -2.689   5.156
  186    HD1  PHE  27           2HD      PHE  27   4.216  -2.347   3.669
  187    HD2  PHE  27           1HD      PHE  27   8.404  -2.310   2.917
  188    HE1  PHE  27           2HE      PHE  27   3.807  -2.552   1.268
  189    HE2  PHE  27           1HE      PHE  27   7.988  -2.539   0.543
  190    HZ   PHE  27           HZ       PHE  27   5.673  -2.654  -0.303
  191    HA   PRO  28           HA       PRO  28   5.824  -6.636   7.984
  192    HB2  PRO  28           2HB      PRO  28   6.971  -7.540   5.325
  193    HB3  PRO  28           1HB      PRO  28   6.163  -8.542   6.520
  194    HG2  PRO  28           2HG      PRO  28   4.795  -7.676   4.483
  195    HG3  PRO  28           1HG      PRO  28   4.073  -7.544   6.091
  196    HD2  PRO  28           2HD      PRO  28   5.148  -5.444   4.316
  197    HD3  PRO  28           1HD      PRO  28   3.891  -5.359   5.539
  198    H    LYS  29           H        LYS  29   7.895  -7.966   8.507
  199    HA   LYS  29           HA       LYS  29  10.147  -6.169   8.699
  200    HB2  LYS  29           2HB      LYS  29  11.137  -8.250   9.879
  201    HB3  LYS  29           1HB      LYS  29   9.860  -7.343  10.677
  202    HG2  LYS  29           2HG      LYS  29   8.760  -9.424   9.016
  203    HG3  LYS  29           1HG      LYS  29   9.947 -10.082  10.138
  204    HD2  LYS  29           2HD      LYS  29   7.721  -8.240  10.990
  205    HD3  LYS  29           1HD      LYS  29   7.568  -9.998  10.979
  206    HE2  LYS  29           2HE      LYS  29   9.404  -8.291  12.636
  207    HE3  LYS  29           1HE      LYS  29   8.172  -9.426  13.184
  208    HZ1  LYS  29           3HZ      LYS  29  10.860  -9.973  12.133
  209    HZ2  LYS  29           1HZ      LYS  29   9.647 -11.136  11.936
  210    HZ3  LYS  29           2HZ      LYS  29  10.086 -10.625  13.487
  211    H    ASP  30           H        ASP  30   9.249  -8.936   6.869
  212    HA   ASP  30           HA       ASP  30  11.909  -9.593   5.972
  213    HB2  ASP  30           2HB      ASP  30   9.809 -10.632   4.281
  214    HB3  ASP  30           1HB      ASP  30  10.905 -11.534   5.311
  215    H    ALA  31           H        ALA  31  12.983  -8.315   4.535
  216    HA   ALA  31           HA       ALA  31  12.051  -6.204   3.172
  217    HB1  ALA  31           1HB      ALA  31  14.017  -6.804   1.510
  218    HB2  ALA  31           2HB      ALA  31  14.376  -8.000   2.761
  219    HB3  ALA  31           3HB      ALA  31  14.297  -6.292   3.168
  220    H    GLU  32           H        GLU  32  12.499  -9.341   1.299
  221    HA   GLU  32           HA       GLU  32  11.194  -8.411  -0.978
  222    HB2  GLU  32           2HB      GLU  32  12.382 -10.446  -1.087
  223    HB3  GLU  32           1HB      GLU  32  11.435 -11.242   0.102
  224    HG2  GLU  32           2HG      GLU  32  10.105 -10.279  -2.383
  225    HG3  GLU  32           1HG      GLU  32  11.122 -11.717  -2.455
  226    H    LEU  33           H        LEU  33   9.380 -10.460   1.487
  227    HA   LEU  33           HA       LEU  33   6.972 -10.212   0.308
  228    HB2  LEU  33           2HB      LEU  33   7.597 -11.035   2.719
  229    HB3  LEU  33           1HB      LEU  33   7.235  -9.408   3.201
  230    HG   LEU  33           HG       LEU  33   5.089  -9.859   3.321
  231   HD11  LEU  33          1HD1      LEU  33   5.287 -11.004   0.537
  232   HD12  LEU  33          2HD1      LEU  33   4.811  -9.366   0.971
  233   HD13  LEU  33          3HD1      LEU  33   3.782 -10.728   1.406
  234   HD21  LEU  33          3HD2      LEU  33   5.483 -11.932   4.198
  235   HD22  LEU  33          1HD2      LEU  33   6.151 -12.554   2.692
  236   HD23  LEU  33          2HD2      LEU  33   4.413 -12.314   2.852
  237    H    ARG  34           H        ARG  34   8.772  -7.754   1.884
  238    HA   ARG  34           HA       ARG  34   6.902  -5.667   1.903
  239    HB2  ARG  34           2HB      ARG  34   8.556  -4.345   2.747
  240    HB3  ARG  34           1HB      ARG  34   9.353  -5.880   2.974
  241    HG2  ARG  34           2HG      ARG  34  11.083  -5.057   1.868
  242    HG3  ARG  34           1HG      ARG  34  10.107  -5.019   0.413
  243    HD2  ARG  34           2HD      ARG  34   9.785  -2.790   0.524
  244    HD3  ARG  34           1HD      ARG  34   9.767  -2.775   2.286
  245    HE   ARG  34           HE       ARG  34  11.962  -2.209   2.221
  246   HH11  ARG  34          1HH1      ARG  34  11.200  -3.878  -0.748
  247   HH12  ARG  34          2HH1      ARG  34  12.790  -3.689  -1.407
  248   HH21  ARG  34          1HH2      ARG  34  14.051  -1.959   1.355
  249   HH22  ARG  34          2HH2      ARG  34  14.407  -2.599  -0.215
  250    H    ARG  35           H        ARG  35   9.527  -6.203  -0.394
  251    HA   ARG  35           HA       ARG  35   8.733  -4.189  -2.103
  252    HB2  ARG  35           2HB      ARG  35   9.946  -5.354  -3.905
  253    HB3  ARG  35           1HB      ARG  35  10.886  -5.211  -2.434
  254    HG2  ARG  35           2HG      ARG  35  11.375  -7.328  -3.150
  255    HG3  ARG  35           1HG      ARG  35  10.108  -7.626  -1.978
  256    HD2  ARG  35           2HD      ARG  35   9.683  -8.965  -3.920
  257    HD3  ARG  35           1HD      ARG  35   8.472  -7.689  -3.865
  258    HE   ARG  35           HE       ARG  35  10.313  -6.580  -5.435
  259   HH11  ARG  35          1HH1      ARG  35   8.924  -9.785  -5.490
  260   HH12  ARG  35          2HH1      ARG  35   9.115  -9.971  -7.200
  261   HH21  ARG  35          1HH2      ARG  35  10.566  -6.827  -7.679
  262   HH22  ARG  35          2HH2      ARG  35  10.047  -8.291  -8.442
  263    H    LEU  36           H        LEU  36   7.504  -7.460  -1.617
  264    HA   LEU  36           HA       LEU  36   5.955  -7.501  -4.028
  265    HB2  LEU  36           2HB      LEU  36   5.376  -8.870  -1.398
  266    HB3  LEU  36           1HB      LEU  36   4.527  -9.159  -2.898
  267    HG   LEU  36           HG       LEU  36   7.438  -9.719  -2.375
  268   HD11  LEU  36          1HD1      LEU  36   4.962 -11.381  -2.441
  269   HD12  LEU  36          2HD1      LEU  36   6.337 -11.447  -1.337
  270   HD13  LEU  36          3HD1      LEU  36   6.491 -12.082  -2.976
  271   HD21  LEU  36          3HD2      LEU  36   7.243  -9.065  -4.651
  272   HD22  LEU  36          1HD2      LEU  36   5.758  -9.995  -4.860
  273   HD23  LEU  36          2HD2      LEU  36   7.295 -10.827  -4.628
  274    H    TRP  37           H        TRP  37   5.055  -6.296  -0.794
  275    HA   TRP  37           HA       TRP  37   2.444  -5.580  -1.576
  276    HB2  TRP  37           2HB      TRP  37   4.346  -4.612   0.538
  277    HB3  TRP  37           1HB      TRP  37   2.808  -3.792   0.270
  278    HD1  TRP  37           HD       TRP  37   3.107  -7.553  -0.161
  279    HE1  TRP  37           1HE      TRP  37   1.746  -8.715   1.737
  280    HE3  TRP  37           3HE      TRP  37   1.848  -3.461   2.595
  281    HZ2  TRP  37           2HZ      TRP  37   0.304  -7.941   4.063
  282    HZ3  TRP  37           3HZ      TRP  37   0.518  -3.726   4.606
  283    HH2  TRP  37           HH       TRP  37  -0.262  -5.905   5.325
  284    H    LEU  38           H        LEU  38   5.635  -3.923  -1.895
  285    HA   LEU  38           HA       LEU  38   5.038  -1.358  -2.567
  286    HB2  LEU  38           2HB      LEU  38   6.958  -3.351  -3.457
  287    HB3  LEU  38           1HB      LEU  38   6.648  -2.190  -4.679
  288    HG   LEU  38           HG       LEU  38   8.598  -1.745  -3.085
  289   HD11  LEU  38          1HD1      LEU  38   8.239   0.084  -4.356
  290   HD12  LEU  38          2HD1      LEU  38   7.618   0.743  -2.841
  291   HD13  LEU  38          3HD1      LEU  38   6.504   0.095  -4.043
  292   HD21  LEU  38          3HD2      LEU  38   6.349  -0.879  -1.297
  293   HD22  LEU  38          1HD2      LEU  38   8.080  -0.692  -1.005
  294   HD23  LEU  38          2HD2      LEU  38   7.365  -2.299  -1.064
  295    H    LYS  39           H        LYS  39   4.861  -4.228  -4.787
  296    HA   LYS  39           HA       LYS  39   3.853  -3.136  -7.012
  297    HB2  LYS  39           2HB      LYS  39   3.747  -5.730  -5.664
  298    HB3  LYS  39           1HB      LYS  39   2.490  -5.513  -6.853
  299    HG2  LYS  39           2HG      LYS  39   4.765  -6.575  -7.492
  300    HG3  LYS  39           1HG      LYS  39   3.967  -5.457  -8.602
  301    HD2  LYS  39           2HD      LYS  39   5.742  -4.132  -6.695
  302    HD3  LYS  39           1HD      LYS  39   6.571  -5.292  -7.732
  303    HE2  LYS  39           2HE      LYS  39   5.763  -4.194  -9.706
  304    HE3  LYS  39           1HE      LYS  39   4.739  -3.126  -8.749
  305    HZ1  LYS  39           3HZ      LYS  39   6.461  -1.729  -8.923
  306    HZ2  LYS  39           1HZ      LYS  39   7.565  -2.950  -9.313
  307    HZ3  LYS  39           2HZ      LYS  39   7.164  -2.659  -7.697
  308    H    ASN  40           H        ASN  40   1.644  -4.495  -4.552
  309    HA   ASN  40           HA       ASN  40  -0.675  -3.586  -5.796
  310    HB2  ASN  40           2HB      ASN  40  -1.456  -3.667  -3.182
  311    HB3  ASN  40           1HB      ASN  40  -1.385  -5.053  -4.261
  312   HD21  ASN  40          1HD2      ASN  40   0.285  -6.527  -4.055
  313   HD22  ASN  40          2HD2      ASN  40   1.276  -6.602  -2.642
  314    H    VAL  41           H        VAL  41   1.322  -1.983  -3.430
  315    HA   VAL  41           HA       VAL  41  -0.577   0.127  -3.122
  316    HB   VAL  41           HB       VAL  41   1.360  -0.752  -1.458
  317   HG11  VAL  41          1HG1      VAL  41   2.251   1.972  -2.338
  318   HG12  VAL  41          2HG1      VAL  41   3.041   0.493  -2.870
  319   HG13  VAL  41          3HG1      VAL  41   3.017   0.909  -1.158
  320   HG21  VAL  41          3HG2      VAL  41  -0.722   0.464  -0.940
  321   HG22  VAL  41          1HG2      VAL  41   0.049   1.961  -1.460
  322   HG23  VAL  41          2HG2      VAL  41   0.662   1.099  -0.057
  323    H    SER  42           H        SER  42   2.091  -0.297  -5.345
  324    HA   SER  42           HA       SER  42   1.515   1.820  -6.903
  325    HB2  SER  42           2HB      SER  42   1.687   3.756  -5.711
  326    HB3  SER  42           1HB      SER  42   2.410   2.937  -4.310
  327    HG   SER  42           HG       SER  42   4.215   3.825  -4.904
  328    H    ARG  43           H        ARG  43   4.979   2.161  -5.732
  329    HA   ARG  43           HA       ARG  43   5.825  -0.001  -7.354
  330    HB2  ARG  43           2HB      ARG  43   6.566   1.025  -9.316
  331    HB3  ARG  43           1HB      ARG  43   4.987   1.741  -9.037
  332    HG2  ARG  43           2HG      ARG  43   6.348   3.607  -7.836
  333    HG3  ARG  43           1HG      ARG  43   7.693   2.966  -8.781
  334    HD2  ARG  43           2HD      ARG  43   5.130   4.191  -9.757
  335    HD3  ARG  43           1HD      ARG  43   6.784   4.696 -10.085
  336    HE   ARG  43           HE       ARG  43   6.980   2.992 -11.667
  337   HH11  ARG  43          1HH1      ARG  43   3.847   2.910 -10.115
  338   HH12  ARG  43          2HH1      ARG  43   3.146   1.879 -11.315
  339   HH21  ARG  43          1HH2      ARG  43   6.048   1.643 -13.244
  340   HH22  ARG  43          2HH2      ARG  43   4.391   1.164 -13.088
  341    H    ALA  44           H        ALA  44   8.334   0.422  -8.011
  342    HA   ALA  44           HA       ALA  44   9.608   1.293  -5.503
  343    HB1  ALA  44           1HB      ALA  44  11.424  -0.198  -6.101
  344    HB2  ALA  44           2HB      ALA  44  10.685  -0.508  -7.674
  345    HB3  ALA  44           3HB      ALA  44   9.885  -1.056  -6.201
  346    H    GLY  45           H        GLY  45   9.594   3.755  -6.326
  347    HA2  GLY  45           2HA      GLY  45  10.780   4.546  -8.681
  348    HA3  GLY  45           1HA      GLY  45  10.826   5.476  -7.195
  349    H    VAL  46           H        VAL  46  12.374   3.878  -5.612
  350    HA   VAL  46           HA       VAL  46  14.604   3.851  -5.032
  351    HB   VAL  46           HB       VAL  46  14.156   1.579  -5.820
  352   HG11  VAL  46          1HG1      VAL  46  13.575   2.157  -8.159
  353   HG12  VAL  46          2HG1      VAL  46  14.732   0.836  -8.035
  354   HG13  VAL  46          3HG1      VAL  46  15.283   2.448  -8.480
  355   HG21  VAL  46          3HG2      VAL  46  16.340   0.892  -5.738
  356   HG22  VAL  46          1HG2      VAL  46  16.500   2.545  -5.146
  357   HG23  VAL  46          2HG2      VAL  46  16.898   2.168  -6.822
  358    H    SER  47           H        SER  47  14.362   6.247  -6.221
  359    HA   SER  47           HA       SER  47  16.972   6.548  -7.477
  360    HB2  SER  47           2HB      SER  47  16.287   7.339  -9.566
  361    HB3  SER  47           1HB      SER  47  15.140   6.027  -9.294
  362    HG   SER  47           HG       SER  47  14.537   8.468  -9.868
  363    H    GLY  48           H        GLY  48  13.769   8.457  -7.026
  364    HA2  GLY  48           2HA      GLY  48  13.495  10.347  -5.730
  365    HA3  GLY  48           1HA      GLY  48  15.172  10.226  -5.221
  366    H    CYS  49           H        CYS  49  16.645  11.548  -6.115
  367    HA   CYS  49           HA       CYS  49  17.547  13.216  -7.366
  368    HB2  CYS  49           2HB      CYS  49  15.844  11.754  -9.303
  369    HB3  CYS  49           1HB      CYS  49  16.357  13.370  -9.779
  370    HG   CYS  49           HG       CYS  49  18.871  12.418  -9.307
  371    H    PHE  50           H        PHE  50  14.292  13.418  -8.761
  372    HA   PHE  50           HA       PHE  50  14.186  16.246  -8.166
  373    HB2  PHE  50           2HB      PHE  50  12.044  14.424  -9.331
  374    HB3  PHE  50           1HB      PHE  50  12.032  16.184  -9.337
  375    HD1  PHE  50           2HD      PHE  50  13.716  13.198 -10.687
  376    HD2  PHE  50           1HD      PHE  50  13.237  17.417 -10.958
  377    HE1  PHE  50           2HE      PHE  50  14.917  13.193 -12.834
  378    HE2  PHE  50           1HE      PHE  50  14.434  17.420 -13.107
  379    HZ   PHE  50           HZ       PHE  50  15.277  15.305 -14.047
  380    H    SER  51           H        SER  51  11.779  13.560  -7.396
  381    HA   SER  51           HA       SER  51  11.721  14.041  -4.653
  382    HB2  SER  51           2HB      SER  51  10.655  16.226  -5.914
  383    HB3  SER  51           1HB      SER  51   9.215  15.256  -5.606
  384    HG   SER  51           HG       SER  51  11.142  16.091  -3.695
  385    H    THR  52           H        THR  52  11.621  11.797  -6.227
  386    HA   THR  52           HA       THR  52   8.988  10.815  -6.637
  387    HB   THR  52           HB       THR  52   9.985   8.812  -7.287
  388    HG1  THR  52           1HG      THR  52  11.848   9.364  -5.264
  389   HG21  THR  52          3HG2      THR  52  12.606   9.954  -7.653
  390   HG22  THR  52          1HG2      THR  52  11.341  11.100  -8.097
  391   HG23  THR  52          2HG2      THR  52  11.393   9.507  -8.853
  392    H    PHE  53           H        PHE  53   8.424   8.553  -5.405
  393    HA   PHE  53           HA       PHE  53   8.517   9.248  -2.555
  394    HB2  PHE  53           2HB      PHE  53   6.558   7.690  -2.361
  395    HB3  PHE  53           1HB      PHE  53   6.258   9.113  -3.350
  396    HD1  PHE  53           1HD      PHE  53   7.434   5.580  -3.750
  397    HD2  PHE  53           2HD      PHE  53   5.173   8.814  -5.341
  398    HE1  PHE  53           1HE      PHE  53   6.682   4.137  -5.586
  399    HE2  PHE  53           2HE      PHE  53   4.412   7.375  -7.184
  400    HZ   PHE  53           HZ       PHE  53   5.162   5.033  -7.307
  401    H    GLN  54           H        GLN  54  10.743   7.959  -3.798
  402    HA   GLN  54           HA       GLN  54  11.333   5.461  -3.920
  403    HB2  GLN  54           2HB      GLN  54  12.601   7.611  -2.427
  404    HB3  GLN  54           1HB      GLN  54  13.027   6.029  -1.799
  405    HG2  GLN  54           2HG      GLN  54  13.848   5.341  -3.946
  406    HG3  GLN  54           1HG      GLN  54  13.275   6.833  -4.687
  407   HE21  GLN  54          1HE2      GLN  54  15.977   5.397  -3.973
  408   HE22  GLN  54          2HE2      GLN  54  16.963   6.719  -3.461
  409    HA   PRO  55           HA       PRO  55   9.256   3.197  -0.694
  410    HB2  PRO  55           2HB      PRO  55  10.837   0.859  -1.322
  411    HB3  PRO  55           1HB      PRO  55   9.133   1.164  -1.645
  412    HG2  PRO  55           2HG      PRO  55  11.068   1.024  -3.591
  413    HG3  PRO  55           1HG      PRO  55   9.522   1.869  -3.762
  414    HD2  PRO  55           2HD      PRO  55  12.240   2.977  -3.247
  415    HD3  PRO  55           1HD      PRO  55  10.890   3.668  -4.168
  416    H    THR  56           H        THR  56  12.683   3.587  -0.944
  417    HA   THR  56           HA       THR  56  13.672   2.191   1.242
  418    HB   THR  56           HB       THR  56  15.093   4.492   1.440
  419    HG1  THR  56           1HG      THR  56  15.012   5.673  -0.356
  420   HG21  THR  56          3HG2      THR  56  16.342   3.625  -0.697
  421   HG22  THR  56          1HG2      THR  56  15.275   2.238  -0.481
  422   HG23  THR  56          2HG2      THR  56  16.372   2.718   0.814
  423    H    THR  57           H        THR  57  11.957   5.415   1.158
  424    HA   THR  57           HA       THR  57  12.232   6.041   3.865
  425    HB   THR  57           HB       THR  57  11.413   7.650   2.238
  426    HG1  THR  57           1HG      THR  57   9.344   7.075   4.087
  427   HG21  THR  57          3HG2      THR  57   9.833   7.234   0.752
  428   HG22  THR  57          1HG2      THR  57   8.673   6.865   2.029
  429   HG23  THR  57          2HG2      THR  57   9.711   5.592   1.383
  430    H    GLY  58           H        GLY  58  10.191   3.726   2.246
  431    HA2  GLY  58           2HA      GLY  58   9.397   1.878   3.679
  432    HA3  GLY  58           1HA      GLY  58   8.990   3.097   4.860
  433    H    HIS  59           H        HIS  59   7.777   1.615   1.767
  434    HA   HIS  59           HA       HIS  59   5.574   3.467   1.723
  435    HB2  HIS  59           2HB      HIS  59   6.569   1.332  -0.013
  436    HB3  HIS  59           1HB      HIS  59   4.815   1.320   0.132
  437    HD1  HIS  59           1HD      HIS  59   7.092   4.339  -0.041
  438    HD2  HIS  59           2HD      HIS  59   4.070   2.518  -2.262
  439    HE1  HIS  59           1HE      HIS  59   6.606   5.898  -1.941
  440    HE2  HIS  59           2HE      HIS  59   4.744   4.809  -3.230
  441    H    ARG  60           H        ARG  60   3.576   3.165   2.378
  442    HA   ARG  60           HA       ARG  60   2.983   0.855   4.127
  443    HB2  ARG  60           2HB      ARG  60   1.573   2.406   5.379
  444    HB3  ARG  60           1HB      ARG  60   3.171   3.093   5.199
  445    HG2  ARG  60           2HG      ARG  60   2.166   4.318   3.166
  446    HG3  ARG  60           1HG      ARG  60   0.617   3.913   3.902
  447    HD2  ARG  60           2HD      ARG  60   2.750   5.760   4.842
  448    HD3  ARG  60           1HD      ARG  60   1.000   5.959   4.861
  449    HE   ARG  60           HE       ARG  60   1.800   3.914   6.659
  450   HH11  ARG  60          1HH1      ARG  60   1.704   7.383   6.299
  451   HH12  ARG  60          2HH1      ARG  60   1.679   7.683   8.004
  452   HH21  ARG  60          1HH2      ARG  60   1.770   4.303   8.899
  453   HH22  ARG  60          2HH2      ARG  60   1.717   5.934   9.481
  454    H    LEU  61           H        LEU  61   0.404   0.446   4.125
  455    HA   LEU  61           HA       LEU  61  -0.492   0.711   1.316
  456    HB2  LEU  61           2HB      LEU  61  -1.085  -1.367   3.458
  457    HB3  LEU  61           1HB      LEU  61  -2.122  -1.202   2.071
  458    HG   LEU  61           HG       LEU  61   0.480  -2.469   2.337
  459   HD11  LEU  61          1HD1      LEU  61  -0.567  -4.190   1.430
  460   HD12  LEU  61          2HD1      LEU  61  -1.155  -3.218   0.089
  461   HD13  LEU  61          3HD1      LEU  61  -2.039  -3.244   1.615
  462   HD21  LEU  61          3HD2      LEU  61   1.255  -2.133   0.157
  463   HD22  LEU  61          1HD2      LEU  61   0.971  -0.540   0.852
  464   HD23  LEU  61          2HD2      LEU  61  -0.193  -1.236  -0.278
  465    H    CYS  62           H        CYS  62  -3.023   1.111   1.100
  466    HA   CYS  62           HA       CYS  62  -3.911   2.420   3.522
  467    HB2  CYS  62           2HB      CYS  62  -4.620   4.235   2.360
  468    HB3  CYS  62           1HB      CYS  62  -3.346   3.664   1.314
  469    H    SER  63           H        SER  63  -6.464   2.629   3.501
  470    HA   SER  63           HA       SER  63  -7.425   0.613   4.751
  471    HB2  SER  63           2HB      SER  63  -8.537   2.938   3.569
  472    HB3  SER  63           1HB      SER  63  -9.708   1.657   3.416
  473    HG   SER  63           HG       SER  63  -9.178   1.260   5.744
  474    H    VAL  64           H        VAL  64  -9.200   0.935   1.861
  475    HA   VAL  64           HA       VAL  64 -10.331  -1.610   2.124
  476    HB   VAL  64           HB       VAL  64 -11.470  -1.135  -0.005
  477   HG11  VAL  64          1HG1      VAL  64 -12.753  -0.246   1.633
  478   HG12  VAL  64          2HG1      VAL  64 -12.210   1.285   0.946
  479   HG13  VAL  64          3HG1      VAL  64 -11.402   0.619   2.366
  480   HG21  VAL  64          3HG2      VAL  64 -11.043   0.995  -1.088
  481   HG22  VAL  64          1HG2      VAL  64  -9.594  -0.013  -1.090
  482   HG23  VAL  64          2HG2      VAL  64  -9.732   1.325   0.056
  483    H    HIS  65           H        HIS  65  -7.449  -2.119   1.540
  484    HA   HIS  65           HA       HIS  65  -7.761  -3.396  -1.103
  485    HB2  HIS  65           2HB      HIS  65  -5.198  -3.544   0.389
  486    HB3  HIS  65           1HB      HIS  65  -5.481  -3.473  -1.349
  487    HD1  HIS  65           1HD      HIS  65  -7.529  -0.925  -0.400
  488    HD2  HIS  65           2HD      HIS  65  -3.419  -1.353  -0.262
  489    HE1  HIS  65           1HE      HIS  65  -6.653   1.327   0.167
  490    H    PHE  66           H        PHE  66  -8.721  -4.425   1.743
  491    HA   PHE  66           HA       PHE  66  -7.655  -7.117   1.295
  492    HB2  PHE  66           2HB      PHE  66  -8.513  -5.945   3.958
  493    HB3  PHE  66           1HB      PHE  66  -7.779  -7.516   3.706
  494    HD1  PHE  66           2HD      PHE  66  -7.121  -3.864   3.794
  495    HD2  PHE  66           1HD      PHE  66  -5.462  -7.775   3.333
  496    HE1  PHE  66           2HE      PHE  66  -4.849  -2.957   4.099
  497    HE2  PHE  66           1HE      PHE  66  -3.208  -6.858   3.642
  498    HZ   PHE  66           HZ       PHE  66  -2.890  -4.467   4.023
  499    H    GLN  67           H        GLN  67  -9.340  -8.912   2.156
  500    HA   GLN  67           HA       GLN  67 -11.919  -8.154   1.120
  501    HB2  GLN  67           2HB      GLN  67 -10.665 -10.349   0.704
  502    HB3  GLN  67           1HB      GLN  67 -11.177 -10.813   2.320
  503    HG2  GLN  67           2HG      GLN  67 -12.944 -11.672   1.260
  504    HG3  GLN  67           1HG      GLN  67 -13.530 -10.010   1.263
  505   HE21  GLN  67          1HE2      GLN  67 -11.768  -8.973  -0.674
  506   HE22  GLN  67          2HE2      GLN  67 -12.195  -9.650  -2.205
  507    H    GLY  68           H        GLY  68 -13.283  -6.973   2.937
  508    HA2  GLY  68           2HA      GLY  68 -14.424  -6.965   4.919
  509    HA3  GLY  68           1HA      GLY  68 -13.835  -8.584   5.249
  510    H    GLY  69           H        GLY  69 -11.364  -8.642   5.957
  511    HA2  GLY  69           2HA      GLY  69  -9.925  -6.490   6.811
  512    HA3  GLY  69           1HA      GLY  69 -11.088  -6.748   8.102
  513    H    ARG  70           H        ARG  70  -8.402  -6.932   8.623
  514    HA   ARG  70           HA       ARG  70  -6.743  -8.271   9.420
  515    HB2  ARG  70           2HB      ARG  70  -7.439  -9.960  10.967
  516    HB3  ARG  70           1HB      ARG  70  -8.581  -8.630  11.067
  517    HG2  ARG  70           2HG      ARG  70 -10.298  -9.856  10.224
  518    HG3  ARG  70           1HG      ARG  70  -9.246 -10.871   9.243
  519    HD2  ARG  70           2HD      ARG  70  -8.507 -12.063  11.217
  520    HD3  ARG  70           1HD      ARG  70  -9.474 -11.007  12.245
  521    HE   ARG  70           HE       ARG  70 -11.323 -12.031  10.595
  522   HH11  ARG  70          1HH1      ARG  70  -8.794 -13.539  12.471
  523   HH12  ARG  70          2HH1      ARG  70  -9.668 -15.019  12.689
  524   HH21  ARG  70          1HH2      ARG  70 -12.472 -13.974  10.883
  525   HH22  ARG  70          2HH2      ARG  70 -11.756 -15.265  11.790
  526    H    LYS  71           H        LYS  71  -6.912  -8.576   6.751
  527    HA   LYS  71           HA       LYS  71  -7.411 -10.936   5.552
  528    HB2  LYS  71           2HB      LYS  71  -6.464  -9.781   3.893
  529    HB3  LYS  71           1HB      LYS  71  -5.750  -8.672   5.044
  530    HG2  LYS  71           2HG      LYS  71  -4.304 -11.217   4.684
  531    HG3  LYS  71           1HG      LYS  71  -4.360 -10.160   3.285
  532    HD2  LYS  71           2HD      LYS  71  -2.412  -9.934   4.993
  533    HD3  LYS  71           1HD      LYS  71  -3.147  -8.491   4.311
  534    HE2  LYS  71           2HE      LYS  71  -4.645  -9.035   6.612
  535    HE3  LYS  71           1HE      LYS  71  -2.974  -9.358   7.064
  536    HZ1  LYS  71           3HZ      LYS  71  -2.835  -7.178   7.375
  537    HZ2  LYS  71           1HZ      LYS  71  -4.269  -6.858   6.535
  538    HZ3  LYS  71           2HZ      LYS  71  -2.811  -7.026   5.690
  539    H    THR  72           H        THR  72  -7.126 -12.864   6.415
  540    HA   THR  72           HA       THR  72  -4.551 -14.036   6.636
  541    HB   THR  72           HB       THR  72  -4.771 -14.650   9.082
  542    HG1  THR  72           1HG      THR  72  -6.532 -12.438   9.171
  543   HG21  THR  72          3HG2      THR  72  -4.539 -11.692   8.969
  544   HG22  THR  72          1HG2      THR  72  -3.362 -12.680   8.102
  545   HG23  THR  72          2HG2      THR  72  -3.564 -12.875   9.844
  546    H    TYR  73           H        TYR  73  -5.787 -15.364   5.118
  547    HA   TYR  73           HA       TYR  73  -6.673 -17.763   6.241
  548    HB2  TYR  73           2HB      TYR  73  -9.055 -17.743   5.789
  549    HB3  TYR  73           1HB      TYR  73  -8.658 -16.434   6.891
  550    HD1  TYR  73           1HD      TYR  73  -7.841 -14.236   5.268
  551    HD2  TYR  73           2HD      TYR  73 -10.816 -17.161   4.438
  552    HE1  TYR  73           1HE      TYR  73  -8.978 -12.646   3.778
  553    HE2  TYR  73           2HE      TYR  73 -11.960 -15.579   2.942
  554    HH   TYR  73           HH       TYR  73 -10.839 -13.227   1.542
  555    H    THR  74           H        THR  74  -6.963 -15.574   3.513
  556    HA   THR  74           HA       THR  74  -6.132 -17.718   1.715
  557    HB   THR  74           HB       THR  74  -8.137 -16.156   0.381
  558    HG1  THR  74           1HG      THR  74  -9.103 -17.563   2.650
  559   HG21  THR  74          3HG2      THR  74  -9.043 -18.207  -0.263
  560   HG22  THR  74          1HG2      THR  74  -8.428 -19.036   1.167
  561   HG23  THR  74          2HG2      THR  74  -7.316 -18.525  -0.102
  562    H    VAL  75           H        VAL  75  -5.813 -14.595   2.782
  563    HA   VAL  75           HA       VAL  75  -4.741 -13.740   0.189
  564    HB   VAL  75           HB       VAL  75  -5.426 -11.646   2.167
  565   HG11  VAL  75          1HG1      VAL  75  -5.972 -10.425   0.180
  566   HG12  VAL  75          2HG1      VAL  75  -6.017 -11.909  -0.778
  567   HG13  VAL  75          3HG1      VAL  75  -4.480 -11.312  -0.146
  568   HG21  VAL  75          3HG2      VAL  75  -7.363 -13.386   2.108
  569   HG22  VAL  75          1HG2      VAL  75  -7.663 -12.739   0.497
  570   HG23  VAL  75          2HG2      VAL  75  -7.732 -11.672   1.900
  571    H    ARG  76           H        ARG  76  -2.606 -13.638   0.147
  572    HA   ARG  76           HA       ARG  76  -1.123 -13.182   2.632
  573    HB2  ARG  76           2HB      ARG  76  -0.618 -14.731   0.290
  574    HB3  ARG  76           1HB      ARG  76   0.621 -13.486   0.382
  575    HG2  ARG  76           2HG      ARG  76   1.225 -14.196   2.608
  576    HG3  ARG  76           1HG      ARG  76  -0.080 -15.383   2.612
  577    HD2  ARG  76           2HD      ARG  76   2.165 -15.385   0.605
  578    HD3  ARG  76           1HD      ARG  76   2.213 -16.292   2.117
  579    HE   ARG  76           HE       ARG  76   0.838 -17.022  -0.255
  580   HH11  ARG  76          1HH1      ARG  76   0.599 -17.148   3.226
  581   HH12  ARG  76          2HH1      ARG  76  -0.411 -18.555   3.230
  582   HH21  ARG  76          1HH2      ARG  76  -0.490 -18.872  -0.249
  583   HH22  ARG  76          2HH2      ARG  76  -1.028 -19.535   1.259
  584    H    VAL  77           H        VAL  77  -1.308 -11.967  -0.702
  585    HA   VAL  77           HA       VAL  77  -0.397  -9.347   0.287
  586    HB   VAL  77           HB       VAL  77   0.752  -8.933  -1.765
  587   HG11  VAL  77          1HG1      VAL  77   1.340 -11.846  -1.469
  588   HG12  VAL  77          2HG1      VAL  77   1.688 -10.739  -0.143
  589   HG13  VAL  77          3HG1      VAL  77   2.447 -10.496  -1.715
  590   HG21  VAL  77          3HG2      VAL  77  -0.599  -9.578  -3.490
  591   HG22  VAL  77          1HG2      VAL  77  -0.903 -11.176  -2.811
  592   HG23  VAL  77          2HG2      VAL  77   0.652 -10.814  -3.565
  593    HA   PRO  78           HA       PRO  78  -4.606  -8.222  -0.836
  594    HB2  PRO  78           2HB      PRO  78  -3.416  -5.504  -0.736
  595    HB3  PRO  78           1HB      PRO  78  -4.866  -6.129   0.045
  596    HG2  PRO  78           2HG      PRO  78  -2.729  -5.753   1.501
  597    HG3  PRO  78           1HG      PRO  78  -3.603  -7.293   1.666
  598    HD2  PRO  78           2HD      PRO  78  -1.141  -6.699   0.051
  599    HD3  PRO  78           1HD      PRO  78  -1.425  -8.010   1.233
  600    H    THR  79           H        THR  79  -4.040  -9.044  -3.312
  601    HA   THR  79           HA       THR  79  -3.851  -6.461  -4.736
  602    HB   THR  79           HB       THR  79  -2.817  -7.530  -6.473
  603    HG1  THR  79           1HG      THR  79  -4.599  -9.705  -6.106
  604   HG21  THR  79          3HG2      THR  79  -1.851  -9.789  -6.013
  605   HG22  THR  79          1HG2      THR  79  -2.662  -9.739  -4.449
  606   HG23  THR  79          2HG2      THR  79  -1.443  -8.528  -4.851
  607    H    ILE  80           H        ILE  80  -5.684  -5.650  -4.697
  608    HA   ILE  80           HA       ILE  80  -8.020  -6.965  -5.874
  609    HB   ILE  80           HB       ILE  80  -7.959  -5.034  -3.515
  610   HG12  ILE  80          2HG1      ILE  80  -7.497  -7.362  -2.895
  611   HG13  ILE  80          1HG1      ILE  80  -9.063  -6.856  -2.278
  612   HG21  ILE  80          1HG2      ILE  80 -10.392  -6.144  -4.914
  613   HG22  ILE  80          2HG2      ILE  80  -9.859  -4.461  -4.934
  614   HG23  ILE  80          3HG2      ILE  80 -10.393  -5.197  -3.433
  615   HD11  ILE  80          3HD1      ILE  80  -8.409  -9.013  -4.056
  616   HD12  ILE  80          1HD1      ILE  80  -9.639  -7.954  -4.744
  617   HD13  ILE  80          2HD1      ILE  80  -9.894  -8.687  -3.157
  618    H    PHE  81           H        PHE  81  -9.002  -5.444  -7.536
  619    HA   PHE  81           HA       PHE  81  -8.935  -3.670  -8.982
  620    HB2  PHE  81           2HB      PHE  81  -7.956  -1.449  -8.063
  621    HB3  PHE  81           1HB      PHE  81  -9.404  -2.080  -7.291
  622    HD1  PHE  81           2HD      PHE  81  -5.763  -1.542  -6.891
  623    HD2  PHE  81           1HD      PHE  81  -9.378  -2.799  -5.016
  624    HE1  PHE  81           2HE      PHE  81  -4.611  -1.575  -4.700
  625    HE2  PHE  81           1HE      PHE  81  -8.243  -2.839  -2.841
  626    HZ   PHE  81           HZ       PHE  81  -5.855  -2.264  -2.670
  Start of MODEL   19
    1    H1   GLY   1           1HT      GLY   1   6.319  19.316  -4.279
    2    H2   GLY   1           2HT      GLY   1   7.313  20.675  -4.108
    3    H3   GLY   1           3HT      GLY   1   5.632  20.853  -4.105
    4    HA2  GLY   1           1HA      GLY   1   7.279  19.510  -2.035
    5    HA3  GLY   1           2HA      GLY   1   6.425  21.035  -1.864
    6    H    SER   2           H        SER   2   6.221  17.631  -1.666
    7    HA   SER   2           HA       SER   2   3.820  17.680  -0.208
    8    HB2  SER   2           2HB      SER   2   2.852  18.118  -2.456
    9    HB3  SER   2           1HB      SER   2   3.522  16.583  -3.013
   10    HG   SER   2           HG       SER   2   1.804  15.690  -2.228
   11    HA   PRO   3           HA       PRO   3   6.058  13.860   0.641
   12    HB2  PRO   3           2HB      PRO   3   4.952  13.361   3.041
   13    HB3  PRO   3           1HB      PRO   3   6.169  14.621   2.816
   14    HG2  PRO   3           2HG      PRO   3   3.192  14.876   2.999
   15    HG3  PRO   3           1HG      PRO   3   4.449  15.875   3.752
   16    HD2  PRO   3           2HD      PRO   3   3.121  16.590   1.476
   17    HD3  PRO   3           1HD      PRO   3   4.775  17.114   1.847
   18    H    GLY   4           H        GLY   4   4.195  13.459  -1.262
   19    HA2  GLY   4           2HA      GLY   4   2.232  11.569  -0.185
   20    HA3  GLY   4           1HA      GLY   4   2.232  12.242  -1.812
   21    H    PHE   5           H        PHE   5   1.860   9.612  -1.952
   22    HA   PHE   5           HA       PHE   5   4.331   8.641  -3.059
   23    HB2  PHE   5           2HB      PHE   5   3.331   6.700  -1.076
   24    HB3  PHE   5           1HB      PHE   5   4.967   7.088  -1.557
   25    HD1  PHE   5           1HD      PHE   5   2.149   8.221   0.548
   26    HD2  PHE   5           2HD      PHE   5   6.316   8.505  -0.268
   27    HE1  PHE   5           1HE      PHE   5   2.470   9.481   2.638
   28    HE2  PHE   5           2HE      PHE   5   6.643   9.764   1.818
   29    HZ   PHE   5           HZ       PHE   5   4.719  10.254   3.275
   30    H    THR   6           H        THR   6   0.980   8.599  -3.133
   31    HA   THR   6           HA       THR   6  -0.574   7.431  -4.337
   32    HB   THR   6           HB       THR   6   1.323   5.914  -5.985
   33    HG1  THR   6           1HG      THR   6   2.740   7.498  -5.901
   34   HG21  THR   6          3HG2      THR   6   0.020   7.913  -7.464
   35   HG22  THR   6          1HG2      THR   6  -1.152   7.289  -6.304
   36   HG23  THR   6          2HG2      THR   6  -0.336   6.187  -7.413
   37    H    CYS   7           H        CYS   7  -1.700   5.821  -3.360
   38    HA   CYS   7           HA       CYS   7  -0.280   3.441  -2.400
   39    HB2  CYS   7           2HB      CYS   7  -2.339   2.897  -1.134
   40    HB3  CYS   7           1HB      CYS   7  -1.748   4.502  -0.736
   41    H    CYS   8           H        CYS   8  -1.003   4.077  -5.257
   42    HA   CYS   8           HA       CYS   8  -1.845   2.994  -7.080
   43    HB2  CYS   8           2HB      CYS   8  -0.379   1.215  -6.476
   44    HB3  CYS   8           1HB      CYS   8  -1.387   0.727  -5.126
   45    HG   CYS   8           HG       CYS   8  -2.065   0.143  -8.115
   46    H    VAL   9           H        VAL   9  -3.606   4.389  -5.810
   47    HA   VAL   9           HA       VAL   9  -5.882   2.799  -4.980
   48    HB   VAL   9           HB       VAL   9  -5.353   4.696  -3.642
   49   HG11  VAL   9          1HG1      VAL   9  -5.690   6.997  -5.010
   50   HG12  VAL   9          2HG1      VAL   9  -4.924   5.970  -6.222
   51   HG13  VAL   9          3HG1      VAL   9  -4.136   6.240  -4.667
   52   HG21  VAL   9          3HG2      VAL   9  -7.849   4.341  -4.455
   53   HG22  VAL   9          1HG2      VAL   9  -7.592   5.964  -5.092
   54   HG23  VAL   9          2HG2      VAL   9  -7.380   5.658  -3.358
   55    HA   PRO  10           HA       PRO  10  -7.399   3.283  -9.276
   56    HB2  PRO  10           2HB      PRO  10  -8.838   1.021  -9.307
   57    HB3  PRO  10           1HB      PRO  10  -7.077   0.972  -9.468
   58    HG2  PRO  10           2HG      PRO  10  -8.756   0.511  -7.017
   59    HG3  PRO  10           1HG      PRO  10  -7.407  -0.456  -7.641
   60    HD2  PRO  10           2HD      PRO  10  -7.067   1.351  -5.639
   61    HD3  PRO  10           1HD      PRO  10  -5.820   0.994  -6.844
   62    H    GLY  11           H        GLY  11  -9.071   2.295  -6.366
   63    HA2  GLY  11           2HA      GLY  11 -11.024   4.349  -6.502
   64    HA3  GLY  11           1HA      GLY  11 -11.711   2.794  -6.960
   65    H    CYS  12           H        CYS  12  -9.076   2.882  -4.721
   66    HA   CYS  12           HA       CYS  12 -10.463   1.466  -2.742
   67    HB2  CYS  12           2HB      CYS  12  -8.451   1.618  -1.451
   68    HB3  CYS  12           1HB      CYS  12  -7.946   1.536  -3.132
   69    H    TYR  13           H        TYR  13  -9.345   3.163  -0.459
   70    HA   TYR  13           HA       TYR  13 -11.650   4.920  -0.282
   71    HB2  TYR  13           2HB      TYR  13 -10.048   3.435   1.703
   72    HB3  TYR  13           1HB      TYR  13 -10.818   4.931   2.215
   73    HD1  TYR  13           2HD      TYR  13 -12.445   2.919  -0.348
   74    HD2  TYR  13           1HD      TYR  13 -12.175   3.673   3.831
   75    HE1  TYR  13           2HE      TYR  13 -14.560   1.718  -0.002
   76    HE2  TYR  13           1HE      TYR  13 -14.290   2.470   4.189
   77    HH   TYR  13           HH       TYR  13 -16.397   1.951   2.658
   78    H    ASN  14           H        ASN  14  -8.251   4.881   0.441
   79    HA   ASN  14           HA       ASN  14  -8.184   7.809   0.367
   80    HB2  ASN  14           2HB      ASN  14  -6.007   6.589   1.755
   81    HB3  ASN  14           1HB      ASN  14  -7.056   7.877   2.291
   82   HD21  ASN  14          1HD2      ASN  14  -9.487   6.620   2.395
   83   HD22  ASN  14          2HD2      ASN  14  -9.450   5.358   3.573
   84    H    ASN  15           H        ASN  15  -6.042   8.796  -0.466
   85    HA   ASN  15           HA       ASN  15  -4.777   6.878  -2.290
   86    HB2  ASN  15           2HB      ASN  15  -5.948   8.944  -3.243
   87    HB3  ASN  15           1HB      ASN  15  -4.643   9.892  -2.538
   88   HD21  ASN  15          1HD2      ASN  15  -5.529   9.259  -5.361
   89   HD22  ASN  15          2HD2      ASN  15  -4.085   8.736  -6.153
   90    H    SER  16           H        SER  16  -2.210   7.193  -2.537
   91    HA   SER  16           HA       SER  16  -1.132   7.695   0.075
   92    HB2  SER  16           2HB      SER  16  -0.268   5.714  -0.964
   93    HB3  SER  16           1HB      SER  16  -0.083   6.533  -2.473
   94    HG   SER  16           HG       SER  16   1.577   6.505  -0.276
   95    H    HIS  17           H        HIS  17  -1.440   9.699  -2.790
   96    HA   HIS  17           HA       HIS  17   0.468  11.557  -1.583
   97    HB2  HIS  17           2HB      HIS  17   1.489  12.104  -3.707
   98    HB3  HIS  17           1HB      HIS  17   1.647  10.375  -3.448
   99    HD1  HIS  17           1HD      HIS  17   1.281  12.372  -6.155
  100    HD2  HIS  17           2HD      HIS  17  -1.106   9.293  -4.715
  101    HE1  HIS  17           1HE      HIS  17  -0.059  11.582  -8.131
  102    HE2  HIS  17           2HE      HIS  17  -1.405   9.636  -7.261
  103    H    ARG  18           H        ARG  18  -2.557  11.376  -1.892
  104    HA   ARG  18           HA       ARG  18  -2.872  14.105  -2.940
  105    HB2  ARG  18           2HB      ARG  18  -3.587  12.365  -4.621
  106    HB3  ARG  18           1HB      ARG  18  -4.854  11.899  -3.499
  107    HG2  ARG  18           2HG      ARG  18  -5.627  14.317  -3.605
  108    HG3  ARG  18           1HG      ARG  18  -4.536  14.488  -4.982
  109    HD2  ARG  18           2HD      ARG  18  -6.459  12.215  -4.945
  110    HD3  ARG  18           1HD      ARG  18  -7.067  13.829  -5.313
  111    HE   ARG  18           HE       ARG  18  -4.976  13.625  -6.980
  112   HH11  ARG  18          1HH1      ARG  18  -7.638  11.462  -6.319
  113   HH12  ARG  18          2HH1      ARG  18  -7.643  10.783  -7.912
  114   HH21  ARG  18          1HH2      ARG  18  -4.985  12.729  -9.074
  115   HH22  ARG  18          2HH2      ARG  18  -6.139  11.500  -9.474
  116    H    ASP  19           H        ASP  19  -2.996  12.383  -0.288
  117    HA   ASP  19           HA       ASP  19  -4.908  14.088   1.005
  118    HB2  ASP  19           2HB      ASP  19  -5.462  11.165   1.324
  119    HB3  ASP  19           1HB      ASP  19  -6.476  12.541   1.723
  120    H    LYS  20           H        LYS  20  -3.644  10.895   1.809
  121    HA   LYS  20           HA       LYS  20  -2.247  10.190   3.440
  122    HB2  LYS  20           2HB      LYS  20  -0.292  11.304   3.579
  123    HB3  LYS  20           1HB      LYS  20  -1.000  12.331   2.348
  124    HG2  LYS  20           2HG      LYS  20  -0.427  13.986   3.736
  125    HG3  LYS  20           1HG      LYS  20  -1.907  13.552   4.591
  126    HD2  LYS  20           2HD      LYS  20  -0.089  11.792   5.640
  127    HD3  LYS  20           1HD      LYS  20   0.892  13.237   5.388
  128    HE2  LYS  20           2HE      LYS  20  -0.047  14.266   7.122
  129    HE3  LYS  20           1HE      LYS  20  -1.670  13.913   6.530
  130    HZ1  LYS  20           3HZ      LYS  20  -0.234  11.684   7.715
  131    HZ2  LYS  20           1HZ      LYS  20  -1.860  12.124   7.858
  132    HZ3  LYS  20           2HZ      LYS  20  -0.686  12.915   8.783
  133    H    ALA  21           H        ALA  21  -4.903  11.816   3.995
  134    HA   ALA  21           HA       ALA  21  -4.402  12.188   6.876
  135    HB1  ALA  21           1HB      ALA  21  -6.762  13.381   6.578
  136    HB2  ALA  21           2HB      ALA  21  -6.152  13.565   4.935
  137    HB3  ALA  21           3HB      ALA  21  -5.230  14.206   6.294
  138    H    LEU  22           H        LEU  22  -5.337   9.613   5.240
  139    HA   LEU  22           HA       LEU  22  -7.663   9.118   6.966
  140    HB2  LEU  22           2HB      LEU  22  -7.105   7.895   4.246
  141    HB3  LEU  22           1HB      LEU  22  -8.487   7.484   5.278
  142    HG   LEU  22           HG       LEU  22  -9.060   9.009   3.469
  143   HD11  LEU  22          1HD1      LEU  22  -9.813  10.905   5.259
  144   HD12  LEU  22          2HD1      LEU  22  -9.477   9.538   6.321
  145   HD13  LEU  22          3HD1      LEU  22 -10.644   9.370   5.010
  146   HD21  LEU  22          3HD2      LEU  22  -8.121  10.990   3.097
  147   HD22  LEU  22          1HD2      LEU  22  -6.719  10.202   3.821
  148   HD23  LEU  22          2HD2      LEU  22  -7.736  11.277   4.789
  149    H    HIS  23           H        HIS  23  -6.580   5.925   5.895
  150    HA   HIS  23           HA       HIS  23  -5.105   5.757   8.396
  151    HB2  HIS  23           2HB      HIS  23  -7.493   4.565   7.775
  152    HB3  HIS  23           1HB      HIS  23  -6.342   3.294   7.368
  153    HD1  HIS  23           1HD      HIS  23  -4.478   4.559   9.871
  154    HD2  HIS  23           2HD      HIS  23  -8.247   2.812   9.944
  155    HE1  HIS  23           1HE      HIS  23  -4.785   3.723  12.222
  156    HE2  HIS  23           2HE      HIS  23  -7.043   2.603  12.223
  157    H    PHE  24           H        PHE  24  -3.013   4.560   8.278
  158    HA   PHE  24           HA       PHE  24  -2.482   3.403   5.653
  159    HB2  PHE  24           2HB      PHE  24  -0.650   5.199   7.215
  160    HB3  PHE  24           1HB      PHE  24  -0.184   4.307   5.777
  161    HD1  PHE  24           2HD      PHE  24  -2.788   6.692   6.948
  162    HD2  PHE  24           1HD      PHE  24  -0.422   5.331   3.684
  163    HE1  PHE  24           2HE      PHE  24  -3.710   8.476   5.520
  164    HE2  PHE  24           1HE      PHE  24  -1.333   7.099   2.267
  165    HZ   PHE  24           HZ       PHE  24  -2.978   8.673   3.172
  166    H    TYR  25           H        TYR  25  -1.827   1.159   5.822
  167    HA   TYR  25           HA       TYR  25  -0.980   0.186   8.411
  168    HB2  TYR  25           2HB      TYR  25  -1.491  -1.206   5.767
  169    HB3  TYR  25           1HB      TYR  25  -0.956  -2.046   7.220
  170    HD1  TYR  25           1HD      TYR  25  -3.593   0.492   6.404
  171    HD2  TYR  25           2HD      TYR  25  -2.637  -3.209   8.276
  172    HE1  TYR  25           1HE      TYR  25  -5.937   0.251   7.101
  173    HE2  TYR  25           2HE      TYR  25  -4.982  -3.464   8.980
  174    HH   TYR  25           HH       TYR  25  -7.441  -2.058   7.734
  175    H    THR  26           H        THR  26   1.217  -1.014   8.618
  176    HA   THR  26           HA       THR  26   3.091   0.308   6.807
  177    HB   THR  26           HB       THR  26   4.364   0.755   8.590
  178    HG1  THR  26           1HG      THR  26   4.094  -1.922   9.476
  179   HG21  THR  26          3HG2      THR  26   3.483   0.609  10.795
  180   HG22  THR  26          1HG2      THR  26   2.352  -0.656  10.320
  181   HG23  THR  26          2HG2      THR  26   2.156   0.982   9.697
  182    H    PHE  27           H        PHE  27   5.326  -0.854   6.652
  183    HA   PHE  27           HA       PHE  27   4.845  -3.144   5.110
  184    HB2  PHE  27           2HB      PHE  27   6.705  -1.109   5.277
  185    HB3  PHE  27           1HB      PHE  27   7.610  -2.600   5.317
  186    HD1  PHE  27           2HD      PHE  27   4.481  -2.587   3.492
  187    HD2  PHE  27           1HD      PHE  27   8.665  -1.866   3.200
  188    HE1  PHE  27           2HE      PHE  27   4.356  -2.750   1.060
  189    HE2  PHE  27           1HE      PHE  27   8.533  -2.049   0.765
  190    HZ   PHE  27           HZ       PHE  27   6.353  -2.488  -0.318
  191    HA   PRO  28           HA       PRO  28   5.783  -6.595   7.964
  192    HB2  PRO  28           2HB      PRO  28   6.938  -7.486   5.296
  193    HB3  PRO  28           1HB      PRO  28   6.117  -8.493   6.483
  194    HG2  PRO  28           2HG      PRO  28   4.753  -7.618   4.469
  195    HG3  PRO  28           1HG      PRO  28   4.045  -7.443   6.078
  196    HD2  PRO  28           2HD      PRO  28   5.213  -5.401   4.280
  197    HD3  PRO  28           1HD      PRO  28   3.902  -5.267   5.446
  198    H    LYS  29           H        LYS  29   7.877  -7.934   8.496
  199    HA   LYS  29           HA       LYS  29  10.131  -6.096   8.540
  200    HB2  LYS  29           2HB      LYS  29  10.890  -8.483   9.817
  201    HB3  LYS  29           1HB      LYS  29  10.431  -6.966  10.573
  202    HG2  LYS  29           2HG      LYS  29   8.130  -7.694  10.719
  203    HG3  LYS  29           1HG      LYS  29   8.523  -9.182   9.854
  204    HD2  LYS  29           2HD      LYS  29  10.333  -9.211  11.908
  205    HD3  LYS  29           1HD      LYS  29   8.920  -8.478  12.668
  206    HE2  LYS  29           2HE      LYS  29   7.868 -10.437  12.756
  207    HE3  LYS  29           1HE      LYS  29   8.152 -10.730  11.042
  208    HZ1  LYS  29           3HZ      LYS  29  10.568 -11.225  12.027
  209    HZ2  LYS  29           1HZ      LYS  29   9.379 -12.416  11.850
  210    HZ3  LYS  29           2HZ      LYS  29   9.627 -11.685  13.354
  211    H    ASP  30           H        ASP  30   9.113  -8.854   6.817
  212    HA   ASP  30           HA       ASP  30  11.763  -9.710   6.024
  213    HB2  ASP  30           2HB      ASP  30   9.723 -10.723   4.290
  214    HB3  ASP  30           1HB      ASP  30  10.662 -11.618   5.474
  215    H    ALA  31           H        ALA  31  12.929  -8.530   4.566
  216    HA   ALA  31           HA       ALA  31  12.095  -6.393   3.172
  217    HB1  ALA  31           1HB      ALA  31  14.041  -7.105   1.525
  218    HB2  ALA  31           2HB      ALA  31  14.345  -8.285   2.804
  219    HB3  ALA  31           3HB      ALA  31  14.331  -6.566   3.171
  220    H    GLU  32           H        GLU  32  12.419  -9.565   1.341
  221    HA   GLU  32           HA       GLU  32  11.154  -8.618  -0.957
  222    HB2  GLU  32           2HB      GLU  32  12.225 -10.698  -1.090
  223    HB3  GLU  32           1HB      GLU  32  11.343 -11.421   0.198
  224    HG2  GLU  32           2HG      GLU  32  10.020 -10.576  -2.363
  225    HG3  GLU  32           1HG      GLU  32  10.814 -12.139  -2.187
  226    H    LEU  33           H        LEU  33   9.259 -10.571   1.516
  227    HA   LEU  33           HA       LEU  33   6.880 -10.266   0.338
  228    HB2  LEU  33           2HB      LEU  33   7.465 -11.070   2.746
  229    HB3  LEU  33           1HB      LEU  33   7.154  -9.422   3.212
  230    HG   LEU  33           HG       LEU  33   4.972  -9.743   3.251
  231   HD11  LEU  33          1HD1      LEU  33   5.164 -11.246   0.641
  232   HD12  LEU  33          2HD1      LEU  33   4.827  -9.528   0.815
  233   HD13  LEU  33          3HD1      LEU  33   3.672 -10.718   1.412
  234   HD21  LEU  33          3HD2      LEU  33   5.372 -11.718   4.360
  235   HD22  LEU  33          1HD2      LEU  33   5.909 -12.541   2.896
  236   HD23  LEU  33          2HD2      LEU  33   4.204 -12.165   3.121
  237    H    ARG  34           H        ARG  34   8.728  -7.797   1.875
  238    HA   ARG  34           HA       ARG  34   6.856  -5.688   1.802
  239    HB2  ARG  34           2HB      ARG  34   8.500  -4.269   2.559
  240    HB3  ARG  34           1HB      ARG  34   9.140  -5.808   3.081
  241    HG2  ARG  34           2HG      ARG  34  11.015  -5.425   1.976
  242    HG3  ARG  34           1HG      ARG  34  10.146  -5.174   0.476
  243    HD2  ARG  34           2HD      ARG  34  10.656  -3.042   0.546
  244    HD3  ARG  34           1HD      ARG  34   9.782  -2.882   2.064
  245    HE   ARG  34           HE       ARG  34  12.482  -3.905   2.273
  246   HH11  ARG  34          1HH1      ARG  34  10.405  -1.101   2.404
  247   HH12  ARG  34          2HH1      ARG  34  11.501  -0.181   3.378
  248   HH21  ARG  34          1HH2      ARG  34  13.922  -2.696   3.559
  249   HH22  ARG  34          2HH2      ARG  34  13.499  -1.083   4.031
  250    H    ARG  35           H        ARG  35   9.553  -6.328  -0.379
  251    HA   ARG  35           HA       ARG  35   8.866  -4.328  -2.159
  252    HB2  ARG  35           2HB      ARG  35  10.337  -5.261  -3.718
  253    HB3  ARG  35           1HB      ARG  35  11.014  -5.699  -2.165
  254    HG2  ARG  35           2HG      ARG  35  11.248  -7.549  -3.611
  255    HG3  ARG  35           1HG      ARG  35   9.999  -7.968  -2.454
  256    HD2  ARG  35           2HD      ARG  35   8.521  -8.292  -4.095
  257    HD3  ARG  35           1HD      ARG  35   8.845  -6.692  -4.763
  258    HE   ARG  35           HE       ARG  35   9.931  -9.206  -5.664
  259   HH11  ARG  35          1HH1      ARG  35  10.310  -5.735  -5.648
  260   HH12  ARG  35          2HH1      ARG  35  11.281  -5.709  -7.080
  261   HH21  ARG  35          1HH2      ARG  35  11.212  -9.172  -7.549
  262   HH22  ARG  35          2HH2      ARG  35  11.794  -7.659  -8.159
  263    H    LEU  36           H        LEU  36   7.519  -7.557  -1.654
  264    HA   LEU  36           HA       LEU  36   6.069  -7.584  -4.142
  265    HB2  LEU  36           2HB      LEU  36   5.634  -8.897  -1.504
  266    HB3  LEU  36           1HB      LEU  36   4.344  -8.906  -2.680
  267    HG   LEU  36           HG       LEU  36   7.107 -10.041  -3.083
  268   HD11  LEU  36          1HD1      LEU  36   6.031 -12.195  -3.054
  269   HD12  LEU  36          2HD1      LEU  36   4.449 -11.442  -2.851
  270   HD13  LEU  36          3HD1      LEU  36   5.648 -11.334  -1.563
  271   HD21  LEU  36          3HD2      LEU  36   6.719 -10.010  -5.268
  272   HD22  LEU  36          1HD2      LEU  36   5.210  -9.142  -4.988
  273   HD23  LEU  36          2HD2      LEU  36   5.218 -10.905  -5.032
  274    H    TRP  37           H        TRP  37   5.174  -6.301  -0.974
  275    HA   TRP  37           HA       TRP  37   2.646  -5.381  -1.768
  276    HB2  TRP  37           2HB      TRP  37   4.634  -4.454   0.286
  277    HB3  TRP  37           1HB      TRP  37   3.116  -3.597   0.024
  278    HD1  TRP  37           HD       TRP  37   3.369  -7.399  -0.147
  279    HE1  TRP  37           1HE      TRP  37   2.019  -8.378   1.851
  280    HE3  TRP  37           3HE      TRP  37   2.150  -3.057   2.249
  281    HZ2  TRP  37           2HZ      TRP  37   0.584  -7.382   4.107
  282    HZ3  TRP  37           3HZ      TRP  37   0.851  -3.161   4.299
  283    HH2  TRP  37           HH       TRP  37   0.069  -5.265   5.175
  284    H    LEU  38           H        LEU  38   5.960  -3.927  -2.004
  285    HA   LEU  38           HA       LEU  38   5.475  -1.367  -2.692
  286    HB2  LEU  38           2HB      LEU  38   7.346  -3.325  -4.046
  287    HB3  LEU  38           1HB      LEU  38   7.327  -1.625  -4.388
  288    HG   LEU  38           HG       LEU  38   7.944  -2.903  -1.744
  289   HD11  LEU  38          1HD1      LEU  38   9.744  -1.090  -3.296
  290   HD12  LEU  38          2HD1      LEU  38   9.650  -2.806  -3.699
  291   HD13  LEU  38          3HD1      LEU  38  10.150  -2.305  -2.082
  292   HD21  LEU  38          3HD2      LEU  38   6.716  -0.910  -1.290
  293   HD22  LEU  38          1HD2      LEU  38   7.635  -0.007  -2.492
  294   HD23  LEU  38          2HD2      LEU  38   8.423  -0.568  -1.015
  295    H    LYS  39           H        LYS  39   5.195  -4.253  -4.895
  296    HA   LYS  39           HA       LYS  39   4.309  -3.036  -7.156
  297    HB2  LYS  39           2HB      LYS  39   4.169  -5.682  -5.878
  298    HB3  LYS  39           1HB      LYS  39   2.975  -5.419  -7.129
  299    HG2  LYS  39           2HG      LYS  39   5.194  -6.524  -7.705
  300    HG3  LYS  39           1HG      LYS  39   4.613  -5.241  -8.777
  301    HD2  LYS  39           2HD      LYS  39   6.112  -3.824  -6.996
  302    HD3  LYS  39           1HD      LYS  39   6.981  -5.356  -7.031
  303    HE2  LYS  39           2HE      LYS  39   6.175  -4.282  -9.652
  304    HE3  LYS  39           1HE      LYS  39   7.389  -3.344  -8.782
  305    HZ1  LYS  39           3HZ      LYS  39   7.578  -6.011  -9.940
  306    HZ2  LYS  39           1HZ      LYS  39   8.395  -5.764  -8.479
  307    HZ3  LYS  39           2HZ      LYS  39   8.751  -4.797  -9.822
  308    H    ASN  40           H        ASN  40   2.116  -4.481  -4.747
  309    HA   ASN  40           HA       ASN  40  -0.204  -3.643  -6.018
  310    HB2  ASN  40           2HB      ASN  40  -0.954  -3.870  -3.376
  311    HB3  ASN  40           1HB      ASN  40  -0.973  -5.146  -4.576
  312   HD21  ASN  40          1HD2      ASN  40  -0.552  -4.938  -1.626
  313   HD22  ASN  40          2HD2      ASN  40   0.876  -5.851  -1.339
  314    H    VAL  41           H        VAL  41   1.783  -1.886  -3.771
  315    HA   VAL  41           HA       VAL  41  -0.360  -0.054  -3.234
  316    HB   VAL  41           HB       VAL  41   1.437  -0.574  -1.546
  317   HG11  VAL  41          1HG1      VAL  41   3.270  -0.108  -3.146
  318   HG12  VAL  41          2HG1      VAL  41   3.413   0.750  -1.616
  319   HG13  VAL  41          3HG1      VAL  41   2.852   1.592  -3.062
  320   HG21  VAL  41          3HG2      VAL  41  -0.340   1.417  -1.814
  321   HG22  VAL  41          1HG2      VAL  41   1.152   2.363  -1.826
  322   HG23  VAL  41          2HG2      VAL  41   0.787   1.322  -0.454
  323    H    SER  42           H        SER  42   2.069  -0.119  -5.743
  324    HA   SER  42           HA       SER  42   1.198   1.797  -7.337
  325    HB2  SER  42           2HB      SER  42   0.780   3.737  -6.203
  326    HB3  SER  42           1HB      SER  42   1.731   3.261  -4.779
  327    HG   SER  42           HG       SER  42   2.622   4.483  -7.189
  328    H    ARG  43           H        ARG  43   4.321   2.827  -5.690
  329    HA   ARG  43           HA       ARG  43   6.387   2.928  -6.586
  330    HB2  ARG  43           2HB      ARG  43   7.348   0.770  -7.277
  331    HB3  ARG  43           1HB      ARG  43   6.447   0.669  -5.775
  332    HG2  ARG  43           2HG      ARG  43   5.938  -1.273  -6.995
  333    HG3  ARG  43           1HG      ARG  43   4.519  -0.242  -7.126
  334    HD2  ARG  43           2HD      ARG  43   5.053   0.360  -9.357
  335    HD3  ARG  43           1HD      ARG  43   6.684  -0.291  -9.213
  336    HE   ARG  43           HE       ARG  43   5.858  -2.330  -9.795
  337   HH11  ARG  43          1HH1      ARG  43   3.209  -0.369  -8.656
  338   HH12  ARG  43          2HH1      ARG  43   2.001  -1.539  -9.063
  339   HH21  ARG  43          1HH2      ARG  43   4.273  -3.874 -10.329
  340   HH22  ARG  43          2HH2      ARG  43   2.605  -3.530 -10.013
  341    H    ALA  44           H        ALA  44   4.393   3.930  -8.377
  342    HA   ALA  44           HA       ALA  44   4.723   3.045 -11.030
  343    HB1  ALA  44           1HB      ALA  44   4.171   5.652 -11.397
  344    HB2  ALA  44           2HB      ALA  44   3.723   5.497  -9.698
  345    HB3  ALA  44           3HB      ALA  44   2.957   4.469 -10.909
  346    H    GLY  45           H        GLY  45   7.309   2.664 -10.730
  347    HA2  GLY  45           2HA      GLY  45   8.632   4.666 -12.259
  348    HA3  GLY  45           1HA      GLY  45   9.045   4.805 -10.577
  349    H    VAL  46           H        VAL  46   9.196   2.529 -13.306
  350    HA   VAL  46           HA       VAL  46  10.790   0.680 -11.804
  351    HB   VAL  46           HB       VAL  46  10.955   0.436 -14.720
  352   HG11  VAL  46          1HG1      VAL  46  10.051  -1.857 -14.023
  353   HG12  VAL  46          2HG1      VAL  46  10.277  -1.277 -12.371
  354   HG13  VAL  46          3HG1      VAL  46  11.656  -1.378 -13.466
  355   HG21  VAL  46          3HG2      VAL  46   8.284   0.545 -13.355
  356   HG22  VAL  46          1HG2      VAL  46   8.549  -0.425 -14.805
  357   HG23  VAL  46          2HG2      VAL  46   8.794   1.322 -14.854
  358    H    SER  47           H        SER  47  12.067   3.105 -11.589
  359    HA   SER  47           HA       SER  47  14.690   2.452 -12.378
  360    HB2  SER  47           2HB      SER  47  15.075   3.658 -14.315
  361    HB3  SER  47           1HB      SER  47  13.396   3.181 -14.594
  362    HG   SER  47           HG       SER  47  14.376   5.685 -13.690
  363    H    GLY  48           H        GLY  48  12.669   5.601 -12.173
  364    HA2  GLY  48           2HA      GLY  48  13.962   7.521 -11.228
  365    HA3  GLY  48           1HA      GLY  48  12.754   6.889 -10.128
  366    H    CYS  49           H        CYS  49  16.022   7.613 -10.581
  367    HA   CYS  49           HA       CYS  49  16.779   6.107  -8.167
  368    HB2  CYS  49           2HB      CYS  49  19.103   6.321  -8.929
  369    HB3  CYS  49           1HB      CYS  49  18.106   5.533 -10.147
  370    HG   CYS  49           HG       CYS  49  18.828   8.539 -10.456
  371    H    PHE  50           H        PHE  50  15.340   8.601  -8.108
  372    HA   PHE  50           HA       PHE  50  17.374  10.266  -6.744
  373    HB2  PHE  50           2HB      PHE  50  14.954  11.421  -8.159
  374    HB3  PHE  50           1HB      PHE  50  16.391  12.260  -7.582
  375    HD1  PHE  50           1HD      PHE  50  15.310   9.681 -10.034
  376    HD2  PHE  50           2HD      PHE  50  18.114  12.726  -9.049
  377    HE1  PHE  50           1HE      PHE  50  16.323   9.464 -12.265
  378    HE2  PHE  50           2HE      PHE  50  19.133  12.514 -11.279
  379    HZ   PHE  50           HZ       PHE  50  18.237  10.880 -12.890
  380    H    SER  51           H        SER  51  13.706  10.103  -7.067
  381    HA   SER  51           HA       SER  51  13.565   9.717  -4.184
  382    HB2  SER  51           2HB      SER  51  11.619  11.652  -4.565
  383    HB3  SER  51           1HB      SER  51  13.182  11.899  -3.789
  384    HG   SER  51           HG       SER  51  13.985  12.730  -5.639
  385    H    THR  52           H        THR  52  11.013  10.893  -6.335
  386    HA   THR  52           HA       THR  52   8.956  10.009  -6.807
  387    HB   THR  52           HB       THR  52   9.024   7.931  -8.032
  388    HG1  THR  52           1HG      THR  52  10.938   6.664  -8.001
  389   HG21  THR  52          3HG2      THR  52  11.040   9.968  -8.491
  390   HG22  THR  52          1HG2      THR  52   9.958   9.160  -9.625
  391   HG23  THR  52          2HG2      THR  52  11.477   8.396  -9.160
  392    H    PHE  53           H        PHE  53   9.024  10.111  -4.171
  393    HA   PHE  53           HA       PHE  53   8.402   9.190  -2.185
  394    HB2  PHE  53           2HB      PHE  53   6.408   7.721  -2.311
  395    HB3  PHE  53           1HB      PHE  53   6.237   9.174  -3.289
  396    HD1  PHE  53           1HD      PHE  53   7.109   5.564  -3.499
  397    HD2  PHE  53           2HD      PHE  53   5.674   9.012  -5.537
  398    HE1  PHE  53           1HE      PHE  53   6.554   4.177  -5.436
  399    HE2  PHE  53           2HE      PHE  53   5.113   7.623  -7.489
  400    HZ   PHE  53           HZ       PHE  53   5.551   5.198  -7.437
  401    H    GLN  54           H        GLN  54  10.705   7.989  -3.418
  402    HA   GLN  54           HA       GLN  54  11.307   5.516  -3.720
  403    HB2  GLN  54           2HB      GLN  54  12.507   7.555  -2.076
  404    HB3  GLN  54           1HB      GLN  54  12.831   5.964  -1.404
  405    HG2  GLN  54           2HG      GLN  54  13.585   5.295  -3.730
  406    HG3  GLN  54           1HG      GLN  54  13.546   7.014  -4.120
  407   HE21  GLN  54          1HE2      GLN  54  15.340   8.118  -3.786
  408   HE22  GLN  54          2HE2      GLN  54  16.650   7.645  -2.763
  409    HA   PRO  55           HA       PRO  55   9.113   2.920  -0.846
  410    HB2  PRO  55           2HB      PRO  55  10.883   0.725  -1.522
  411    HB3  PRO  55           1HB      PRO  55   9.183   0.949  -1.914
  412    HG2  PRO  55           2HG      PRO  55  11.190   1.055  -3.769
  413    HG3  PRO  55           1HG      PRO  55   9.627   1.866  -3.950
  414    HD2  PRO  55           2HD      PRO  55  12.276   2.997  -3.186
  415    HD3  PRO  55           1HD      PRO  55  10.965   3.723  -4.139
  416    H    THR  56           H        THR  56  12.578   3.320  -0.836
  417    HA   THR  56           HA       THR  56  13.405   1.803   1.317
  418    HB   THR  56           HB       THR  56  14.381   4.622   1.274
  419    HG1  THR  56           1HG      THR  56  14.651   2.882  -0.948
  420   HG21  THR  56          3HG2      THR  56  15.886   2.050   0.897
  421   HG22  THR  56          1HG2      THR  56  15.515   2.743   2.475
  422   HG23  THR  56          2HG2      THR  56  16.530   3.631   1.340
  423    H    THR  57           H        THR  57  11.771   5.078   1.386
  424    HA   THR  57           HA       THR  57  11.865   5.489   4.130
  425    HB   THR  57           HB       THR  57  11.096   7.178   2.523
  426    HG1  THR  57           1HG      THR  57   9.184   6.478   4.493
  427   HG21  THR  57          3HG2      THR  57   9.392   5.190   1.567
  428   HG22  THR  57          1HG2      THR  57   9.473   6.875   1.053
  429   HG23  THR  57          2HG2      THR  57   8.345   6.392   2.318
  430    H    GLY  58           H        GLY  58   9.988   3.241   2.271
  431    HA2  GLY  58           2HA      GLY  58   9.100   1.295   3.419
  432    HA3  GLY  58           1HA      GLY  58   8.747   2.337   4.772
  433    H    HIS  59           H        HIS  59   7.365   1.230   1.607
  434    HA   HIS  59           HA       HIS  59   5.276   3.193   1.821
  435    HB2  HIS  59           2HB      HIS  59   6.079   1.226  -0.164
  436    HB3  HIS  59           1HB      HIS  59   4.337   1.220   0.088
  437    HD1  HIS  59           1HD      HIS  59   6.878   4.019  -0.135
  438    HD2  HIS  59           2HD      HIS  59   3.263   2.837  -1.867
  439    HE1  HIS  59           1HE      HIS  59   6.293   5.825  -1.764
  440    HE2  HIS  59           2HE      HIS  59   4.143   5.068  -2.845
  441    H    ARG  60           H        ARG  60   3.256   2.909   2.436
  442    HA   ARG  60           HA       ARG  60   2.654   0.563   4.117
  443    HB2  ARG  60           2HB      ARG  60   1.270   2.141   5.397
  444    HB3  ARG  60           1HB      ARG  60   2.893   2.771   5.232
  445    HG2  ARG  60           2HG      ARG  60   1.733   3.877   3.071
  446    HG3  ARG  60           1HG      ARG  60   0.364   3.793   4.174
  447    HD2  ARG  60           2HD      ARG  60   2.897   5.347   4.396
  448    HD3  ARG  60           1HD      ARG  60   1.240   5.850   4.709
  449    HE   ARG  60           HE       ARG  60   1.368   4.902   6.850
  450   HH11  ARG  60          1HH1      ARG  60   4.357   4.513   5.082
  451   HH12  ARG  60          2HH1      ARG  60   5.291   4.168   6.498
  452   HH21  ARG  60          1HH2      ARG  60   2.598   4.453   8.709
  453   HH22  ARG  60          2HH2      ARG  60   4.293   4.133   8.556
  454    H    LEU  61           H        LEU  61   0.080   0.148   4.170
  455    HA   LEU  61           HA       LEU  61  -0.909   0.777   1.463
  456    HB2  LEU  61           2HB      LEU  61  -0.735  -1.818   2.634
  457    HB3  LEU  61           1HB      LEU  61  -2.425  -1.448   2.515
  458    HG   LEU  61           HG       LEU  61  -2.447  -1.628   0.243
  459   HD11  LEU  61          1HD1      LEU  61  -0.391  -1.057  -1.118
  460   HD12  LEU  61          2HD1      LEU  61   0.262  -0.415   0.390
  461   HD13  LEU  61          3HD1      LEU  61  -1.225   0.263  -0.294
  462   HD21  LEU  61          3HD2      LEU  61  -1.284  -3.435  -0.522
  463   HD22  LEU  61          1HD2      LEU  61  -1.002  -3.653   1.193
  464   HD23  LEU  61          2HD2      LEU  61   0.234  -2.909   0.195
  465    H    CYS  62           H        CYS  62  -3.438   1.134   1.382
  466    HA   CYS  62           HA       CYS  62  -4.141   2.325   3.936
  467    HB2  CYS  62           2HB      CYS  62  -4.416   4.246   2.888
  468    HB3  CYS  62           1HB      CYS  62  -3.679   3.461   1.511
  469    H    SER  63           H        SER  63  -6.500   2.994   4.026
  470    HA   SER  63           HA       SER  63  -8.059   1.562   5.250
  471    HB2  SER  63           2HB      SER  63  -8.664   3.575   3.280
  472    HB3  SER  63           1HB      SER  63  -9.956   2.379   3.337
  473    HG   SER  63           HG       SER  63 -10.536   3.163   5.183
  474    H    VAL  64           H        VAL  64  -8.730   1.227   1.836
  475    HA   VAL  64           HA       VAL  64 -10.056  -1.282   2.515
  476    HB   VAL  64           HB       VAL  64 -10.824  -1.107   0.026
  477   HG11  VAL  64          1HG1      VAL  64 -12.127  -0.815   2.189
  478   HG12  VAL  64          2HG1      VAL  64 -12.757   0.022   0.770
  479   HG13  VAL  64          3HG1      VAL  64 -11.857   0.919   1.995
  480   HG21  VAL  64          3HG2      VAL  64 -10.616   1.803   0.433
  481   HG22  VAL  64          1HG2      VAL  64 -10.560   0.851  -1.050
  482   HG23  VAL  64          2HG2      VAL  64  -9.128   0.977  -0.027
  483    H    HIS  65           H        HIS  65  -6.963  -0.728   1.406
  484    HA   HIS  65           HA       HIS  65  -6.800  -2.718  -0.613
  485    HB2  HIS  65           2HB      HIS  65  -4.594  -1.858   1.286
  486    HB3  HIS  65           1HB      HIS  65  -4.381  -2.680  -0.253
  487    HD1  HIS  65           1HD      HIS  65  -3.799  -1.124  -2.143
  488    HD2  HIS  65           2HD      HIS  65  -5.962   0.722   0.834
  489    HE1  HIS  65           1HE      HIS  65  -4.158   1.234  -2.930
  490    H    PHE  66           H        PHE  66  -7.371  -3.004   2.738
  491    HA   PHE  66           HA       PHE  66  -6.403  -5.768   2.791
  492    HB2  PHE  66           2HB      PHE  66  -7.194  -3.875   5.016
  493    HB3  PHE  66           1HB      PHE  66  -6.708  -5.529   5.293
  494    HD1  PHE  66           1HD      PHE  66  -4.440  -6.227   5.012
  495    HD2  PHE  66           2HD      PHE  66  -5.580  -2.166   4.462
  496    HE1  PHE  66           1HE      PHE  66  -2.091  -5.553   5.214
  497    HE2  PHE  66           2HE      PHE  66  -3.218  -1.486   4.651
  498    HZ   PHE  66           HZ       PHE  66  -1.483  -3.195   5.041
  499    H    GLN  67           H        GLN  67  -7.955  -7.379   4.124
  500    HA   GLN  67           HA       GLN  67 -10.726  -6.822   3.363
  501    HB2  GLN  67           2HB      GLN  67  -9.474  -8.916   2.637
  502    HB3  GLN  67           1HB      GLN  67  -9.566  -9.437   4.308
  503    HG2  GLN  67           2HG      GLN  67 -11.641 -10.152   4.044
  504    HG3  GLN  67           1HG      GLN  67 -12.152  -8.605   3.372
  505   HE21  GLN  67          1HE2      GLN  67 -11.001  -8.347   1.052
  506   HE22  GLN  67          2HE2      GLN  67 -11.349  -9.661  -0.015
  507    H    GLY  68           H        GLY  68 -11.752  -5.765   5.465
  508    HA2  GLY  68           2HA      GLY  68 -12.446  -5.801   7.630
  509    HA3  GLY  68           1HA      GLY  68 -11.926  -7.471   7.727
  510    H    GLY  69           H        GLY  69  -9.375  -7.716   7.976
  511    HA2  GLY  69           2HA      GLY  69  -7.727  -5.673   8.820
  512    HA3  GLY  69           1HA      GLY  69  -8.627  -6.155  10.251
  513    H    ARG  70           H        ARG  70  -5.802  -6.370   9.968
  514    HA   ARG  70           HA       ARG  70  -4.048  -7.848  10.098
  515    HB2  ARG  70           2HB      ARG  70  -5.672  -8.293  12.133
  516    HB3  ARG  70           1HB      ARG  70  -5.906  -9.837  11.328
  517    HG2  ARG  70           2HG      ARG  70  -3.838 -10.578  11.842
  518    HG3  ARG  70           1HG      ARG  70  -3.109  -8.978  11.688
  519    HD2  ARG  70           2HD      ARG  70  -4.790  -9.953  13.996
  520    HD3  ARG  70           1HD      ARG  70  -3.038  -9.764  13.999
  521    HE   ARG  70           HE       ARG  70  -5.008  -7.692  14.294
  522   HH11  ARG  70          1HH1      ARG  70  -1.726  -8.401  13.342
  523   HH12  ARG  70          2HH1      ARG  70  -1.158  -6.795  13.653
  524   HH21  ARG  70          1HH2      ARG  70  -4.263  -5.580  14.702
  525   HH22  ARG  70          2HH2      ARG  70  -2.596  -5.194  14.427
  526    H    LYS  71           H        LYS  71  -5.082  -7.918   7.622
  527    HA   LYS  71           HA       LYS  71  -6.174 -10.085   6.501
  528    HB2  LYS  71           2HB      LYS  71  -5.562  -9.116   4.558
  529    HB3  LYS  71           1HB      LYS  71  -4.919  -7.857   5.578
  530    HG2  LYS  71           2HG      LYS  71  -3.120 -10.119   4.871
  531    HG3  LYS  71           1HG      LYS  71  -3.515  -8.962   3.620
  532    HD2  LYS  71           2HD      LYS  71  -1.435  -8.697   5.302
  533    HD3  LYS  71           1HD      LYS  71  -2.239  -7.347   4.512
  534    HE2  LYS  71           2HE      LYS  71  -3.596  -6.990   6.521
  535    HE3  LYS  71           1HE      LYS  71  -2.816  -8.360   7.288
  536    HZ1  LYS  71           3HZ      LYS  71  -0.826  -6.623   6.389
  537    HZ2  LYS  71           1HZ      LYS  71  -1.220  -7.032   7.983
  538    HZ3  LYS  71           2HZ      LYS  71  -1.967  -5.709   7.239
  539    H    THR  72           H        THR  72  -2.802  -9.842   7.410
  540    HA   THR  72           HA       THR  72  -1.291 -11.667   6.517
  541    HB   THR  72           HB       THR  72  -0.578 -12.405   8.787
  542    HG1  THR  72           1HG      THR  72  -2.725 -10.794   9.693
  543   HG21  THR  72          3HG2      THR  72  -0.749  -9.761   9.603
  544   HG22  THR  72          1HG2      THR  72  -0.739  -9.691   7.839
  545   HG23  THR  72          2HG2      THR  72   0.564 -10.515   8.697
  546    H    TYR  73           H        TYR  73  -3.812 -12.879   8.769
  547    HA   TYR  73           HA       TYR  73  -3.296 -15.585   7.908
  548    HB2  TYR  73           2HB      TYR  73  -5.301 -16.073   9.442
  549    HB3  TYR  73           1HB      TYR  73  -3.824 -15.471  10.179
  550    HD1  TYR  73           1HD      TYR  73  -6.459 -13.518   8.398
  551    HD2  TYR  73           2HD      TYR  73  -4.595 -14.426  12.113
  552    HE1  TYR  73           1HE      TYR  73  -7.747 -11.727   9.475
  553    HE2  TYR  73           2HE      TYR  73  -5.878 -12.635  13.200
  554    HH   TYR  73           HH       TYR  73  -8.488 -11.022  11.619
  555    H    THR  74           H        THR  74  -3.988 -14.320   5.642
  556    HA   THR  74           HA       THR  74  -6.040 -15.825   4.563
  557    HB   THR  74           HB       THR  74  -7.467 -13.448   4.286
  558    HG1  THR  74           1HG      THR  74  -7.831 -12.810   6.442
  559   HG21  THR  74          3HG2      THR  74  -8.384 -15.209   6.452
  560   HG22  THR  74          1HG2      THR  74  -8.097 -15.992   4.898
  561   HG23  THR  74          2HG2      THR  74  -9.223 -14.639   5.009
  562    H    VAL  75           H        VAL  75  -4.949 -12.458   4.463
  563    HA   VAL  75           HA       VAL  75  -4.615 -12.687   1.553
  564    HB   VAL  75           HB       VAL  75  -4.424 -10.055   2.937
  565   HG11  VAL  75          1HG1      VAL  75  -6.160 -10.146   0.659
  566   HG12  VAL  75          2HG1      VAL  75  -4.661 -10.993   0.286
  567   HG13  VAL  75          3HG1      VAL  75  -4.612  -9.321   0.844
  568   HG21  VAL  75          3HG2      VAL  75  -7.127 -11.230   2.326
  569   HG22  VAL  75          1HG2      VAL  75  -6.744  -9.731   3.175
  570   HG23  VAL  75          2HG2      VAL  75  -6.412 -11.288   3.934
  571    H    ARG  76           H        ARG  76  -2.557 -12.720   0.722
  572    HA   ARG  76           HA       ARG  76  -0.343 -12.362   2.521
  573    HB2  ARG  76           2HB      ARG  76  -0.336 -14.091   0.732
  574    HB3  ARG  76           1HB      ARG  76  -0.305 -12.811  -0.472
  575    HG2  ARG  76           2HG      ARG  76   1.823 -12.122   1.050
  576    HG3  ARG  76           1HG      ARG  76   1.849 -13.879   1.207
  577    HD2  ARG  76           2HD      ARG  76   1.387 -13.515  -1.475
  578    HD3  ARG  76           1HD      ARG  76   2.481 -12.189  -1.087
  579    HE   ARG  76           HE       ARG  76   3.481 -14.559   0.036
  580   HH11  ARG  76          1HH1      ARG  76   2.987 -13.071  -3.081
  581   HH12  ARG  76          2HH1      ARG  76   4.309 -13.903  -3.829
  582   HH21  ARG  76          1HH2      ARG  76   5.222 -15.657  -0.947
  583   HH22  ARG  76          2HH2      ARG  76   5.576 -15.371  -2.618
  584    H    VAL  77           H        VAL  77  -1.761 -10.581  -0.186
  585    HA   VAL  77           HA       VAL  77  -0.243  -8.226   0.663
  586    HB   VAL  77           HB       VAL  77   0.535  -7.699  -1.497
  587   HG11  VAL  77          1HG1      VAL  77   1.632  -9.717  -2.359
  588   HG12  VAL  77          2HG1      VAL  77   0.599 -10.708  -1.328
  589   HG13  VAL  77          3HG1      VAL  77   1.756  -9.596  -0.604
  590   HG21  VAL  77          3HG2      VAL  77  -1.182  -7.820  -2.979
  591   HG22  VAL  77          1HG2      VAL  77  -1.720  -9.399  -2.411
  592   HG23  VAL  77          2HG2      VAL  77  -0.301  -9.269  -3.448
  593    HA   PRO  78           HA       PRO  78  -4.414  -6.552   0.740
  594    HB2  PRO  78           2HB      PRO  78  -2.871  -4.018   0.658
  595    HB3  PRO  78           1HB      PRO  78  -4.189  -4.487   1.723
  596    HG2  PRO  78           2HG      PRO  78  -1.755  -4.513   2.680
  597    HG3  PRO  78           1HG      PRO  78  -2.782  -5.935   2.966
  598    HD2  PRO  78           2HD      PRO  78  -0.639  -5.557   0.885
  599    HD3  PRO  78           1HD      PRO  78  -0.888  -6.904   2.021
  600    H    THR  79           H        THR  79  -4.212  -7.298  -1.855
  601    HA   THR  79           HA       THR  79  -4.832  -4.645  -2.961
  602    HB   THR  79           HB       THR  79  -4.333  -6.490  -5.102
  603    HG1  THR  79           1HG      THR  79  -2.156  -6.197  -3.318
  604   HG21  THR  79          3HG2      THR  79  -2.823  -4.060  -4.170
  605   HG22  THR  79          1HG2      THR  79  -4.089  -4.121  -5.398
  606   HG23  THR  79          2HG2      THR  79  -2.539  -4.907  -5.690
  607    H    ILE  80           H        ILE  80  -6.839  -4.482  -2.836
  608    HA   ILE  80           HA       ILE  80  -8.569  -6.546  -4.066
  609    HB   ILE  80           HB       ILE  80  -8.983  -4.913  -1.575
  610   HG12  ILE  80          2HG1      ILE  80  -8.201  -7.437  -1.827
  611   HG13  ILE  80          1HG1      ILE  80  -9.244  -6.919  -0.506
  612   HG21  ILE  80          1HG2      ILE  80 -11.428  -5.835  -1.770
  613   HG22  ILE  80          2HG2      ILE  80 -11.085  -5.779  -3.499
  614   HG23  ILE  80          3HG2      ILE  80 -10.973  -4.310  -2.530
  615   HD11  ILE  80          3HD1      ILE  80 -10.577  -7.815  -2.980
  616   HD12  ILE  80          1HD1      ILE  80 -11.026  -8.054  -1.291
  617   HD13  ILE  80          2HD1      ILE  80  -9.758  -9.044  -2.017
  618    H    PHE  81           H        PHE  81  -8.694  -5.466  -6.144
  619    HA   PHE  81           HA       PHE  81 -10.465  -3.250  -6.249
  620    HB2  PHE  81           2HB      PHE  81  -7.922  -2.331  -7.477
  621    HB3  PHE  81           1HB      PHE  81  -9.166  -1.405  -6.657
  622    HD1  PHE  81           1HD      PHE  81  -9.212  -1.614  -4.050
  623    HD2  PHE  81           2HD      PHE  81  -5.858  -2.635  -6.465
  624    HE1  PHE  81           1HE      PHE  81  -7.761  -1.511  -2.070
  625    HE2  PHE  81           2HE      PHE  81  -4.391  -2.487  -4.488
  626    HZ   PHE  81           HZ       PHE  81  -5.361  -2.010  -2.262